A0A087XGY8_POEFO Loading...

Chloride channel protein

Voltage-gated channel mediating the exchange of chloride ions against protons. Functions as antiporter and contributes to the acidification of the late endosome lumen. The CLC channel family contains both chloride channels and proton-coupled anion transporters that exchange chloride or another anion for protons. The presence of conserved gating glutamate residues is typical for family members that function as antiporters.

AlphaFold DB , UniProt , Accession A0A087XGY8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 868 aa.

						>A0A087XGY8_POEFO|A0A087XGY8
MACCRSCFCCQCCCREGETRTPEELTILGELRDEEDEILPRKDYESLDYDRCINEPYVEVLEGLDNKKARKYEAVRWVMVFVIGVTVGLVGLFVDFFVHLFTKIKFSVVADSIEKCTDRGCLSLSLLELLTFNMVFVFIASLLVLIEPVAAGSGIPEIKSYLNGVKIPGIVRLRTFLCKAAGVLFSVAGGLFVGKEGPMIHSGAIVGAGLPQFQSITFKRVKFDFPYFRSDRDKRDFVSAGAAAGVAAAFGAPIGGTLFSLEEGSSFWNQALTWKVLFCSMSATFTLNFFRSGINFNKWGSFQLPGLLNFGEFKCSDGEKKCHLWTAVDLGFFVLMGVVGGLLGALFNCMNKCLAKYRMRHIHPKARFIRVLESLLVAMVTTVVIFLASVLLGECRDLSSPTTHNSTTALCRQVSGSEDINSTIRQFFCSNKSYNDMATLFFNPQEAAIHQLFHQDGTFSPATLSIFFLLYFLLACWTYGVSVPSGLFVPSLLCGAAFGRLVANILKVKLGLHIYSGTFALIGAAAFLGGVVRMTISLTVILIESTNEITYGLPIMITLMVAKWTGDFFNKGIYDIHIQLKGVPLLEWETEVEMDKLTASDIMEPNLTYVYPHTRVQSLVSILRTTVYHAFPVVTENRQNERDFMKGNILISNNIRFKKSNIVSRAAEQRRRCQSMKSYPSSELRNVCDDQNAAAEPAEEGEDLLQQMLERRHAPYPNLYPDQSPSEEWTMEERFRPLTFHGLILRSQLVNLLIRGVCYSENQSSATQPRLSFTEMTEDYPRYPDIHEVDLALLNPRMIVDVTPYMNSCPYTVSPNTRISQVFNLFRTMGLRHLPVVNAVGEIVGIITRHNLTHEFLVAKLRQHYITI
					

Structure Viewer

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	29	Very low	28.6	Very low	251 Å²	251	156.9 Å²	156.9	100%	1.236	89%	0.887	S	S	*	*				0	125.3	0	-72.8	174.3	174	0	0	106.4
2	A	29	Very low	28.6	Very low	95 Å²	95	154.7 Å²	154.7	79%	0.785	89%	0.886	S	S	*	*			cis	-165.6	163.8	-9.2	0	0	0	0	0	105.8
3	C	26.2	Very low	28.8	Very low	129 Å²	129	152.2 Å²	152.2	87%	0.872	88%	0.881	S	S	*	*			trans	78.9	124.7	-178.1	-72.7	0	0	0	0	116
4	C	27.2	Very low	29	Very low	126 Å²	126	150.2 Å²	150.2	85%	0.851	88%	0.879	S	S	*	*			cis	-144.6	134.1	21.6	-93	0	0	0	0	111.5
5	R	30.6	Very low	28.8	Very low	253 Å²	253	156.8 Å²	156.8	96%	0.955	88%	0.883	S	S	*	*			trans	-95.4	117	163.3	-82.1	177.1	168.6	175.2	-3.7	108.2
6	S	31.3	Very low	29	Very low	117 Å²	117	159.3 Å²	159.3	82%	0.818	89%	0.885	S	S	*	*			trans	169.4	93.7	139.3	59	0	0	0	0	111.3
7	C	26.5	Very low	29	Very low	123 Å²	123	154.2 Å²	154.2	83%	0.831	88%	0.877	S	S	*	*			trans	-151.9	103.5	155	-139.1	0	0	0	0	108.8	C9	C7-C9 VanDerWaalsContact C-N 3.33Å; C7-C9 PolarHBondContact O-N 2.94Å
8	F	28	Very low	29	Very low	207 Å²	207	155.8 Å²	155.8	91%	0.908	88%	0.876	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.8	83.4	174.4	-99.2	-95.7	0	0	0	109
9	C	29.9	Very low	29.1	Very low	123 Å²	123	155.4 Å²	155.4	83%	0.831	88%	0.877	S	S	*	*	T	Hydrogen-bonded Turn	trans	-163.7	-4.7	160.8	-121.1	0	0	0	0	115.8	C7	C7-C9 VanDerWaalsContact C-N 3.33Å; C7-C9 PolarHBondContact O-N 2.94Å
10	C	30.4	Very low	29.3	Very low	123 Å²	123	157.2 Å²	157.2	83%	0.831	87%	0.87	S	S	*	*			trans	-116.1	47.6	-173.3	-70.3	0	0	0	0	113.8
11	Q	26.6	Very low	29.6	Very low	179 Å²	179	153.9 Å²	153.9	84%	0.836	85%	0.854	S	S	*	*			trans	-119.6	25.6	-175.5	-137.5	168.7	1	0	0	115.1
12	C	28.5	Very low	30.1	Very low	130 Å²	130	147.1 Å²	147.1	88%	0.878	83%	0.829	S	S	*	*	S	Bend	trans	-115	2.6	173.1	-80.3	0	0	0	0	115.6
13	C	31.7	Very low	30.5	Very low	122 Å²	122	150 Å²	150	82%	0.824	83%	0.826	S	S	*	*	S	Bend	trans	-128.9	11.2	-172.1	-75.7	0	0	0	0	117.2
14	C	31	Very low	30.9	Very low	125 Å²	125	149.1 Å²	149.1	85%	0.845	81%	0.809	S	S	*	*			trans	-132	97.3	174.2	-61.5	0	0	0	0	110.4
15	R	26.6	Very low	31.4	Very low	249 Å²	249	147.9 Å²	147.9	94%	0.94	79%	0.793	S	S	*	*			trans	-103.9	106.1	159.3	-157.8	176.3	-173.9	179.3	0.6	106.5	G17	R15-G17 PolarHBondContact O-N 3.5Å
16	E	31	Very low	31.7	Very low	197 Å²	197	141.5 Å²	141.5	92%	0.921	78%	0.783	S	S	*	*			trans	-60.7	127.1	172.6	-73.9	169.5	146.9	0	0	109.6
17	G	29.1	Very low	32.1	Very low	73 Å²	73	143.1 Å²	143.1	75%	0.753	78%	0.781	S	S	*	*			trans	-133	136.5	168.4	0	0	0	0	0	108.1	R15	R15-G17 PolarHBondContact O-N 3.5Å
18	E	28.7	Very low	32.2	Very low	183 Å²	183	143.3 Å²	143.3	86%	0.855	77%	0.773	S	S	*	*			trans	-52.4	139.8	-163	-66	162	149.1	0	0	115.3	R20	E18-R20 PolarHBondContact O-N 3.21Å
19	T	31.3	Very low	32.6	Very low	147 Å²	147	137.2 Å²	137.2	90%	0.902	77%	0.769	S	S	*	*			trans	-65.1	114.4	176.8	48.5	0	0	0	0	111.6
20	R	33	Very low	32.8	Very low	191 Å²	191	139 Å²	139	72%	0.721	76%	0.764	S	S	*	*			trans	-106.8	146.5	161.1	-68	-172.9	-178.3	171.1	-0.2	110.3	E18	E18-R20 PolarHBondContact O-N 3.21Å
21	T	35.9	Very low	32.8	Very low	89 Å²	89	139.3 Å²	139.3	55%	0.546	76%	0.757	S	S	.	*			trans	-70.2	149.6	-171.6	40.3	0	0	0	0	113	E23 E24	T21-E23 PolarHBondContact O-N 3.18Å; T21-E24 PolarHBondContact O-N 3.15Å; T21-E24 VanDerWaalsContact O-N 3.14Å
22	P	40.2	Very low	33.1	Very low	108 Å²	108	140 Å²	140	70%	0.701	75%	0.752	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.7	-15.7	-169.4	23.2	-33.5	0	0	0	115.6	T26	P22-T26 PolarHBondContact O-OG1 3.34Å
23	E	36.8	Very low	33.3	Very low	155 Å²	155	138.2 Å²	138.2	72%	0.724	73%	0.734	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.2	-21.6	178.3	-65	178.3	169.9	0	0	113.2	T21 T26	T21-E23 PolarHBondContact O-N 3.18Å; E23-T26 PolarHBondContact O-OG1 3.13Å
24	E	34.3	Very low	33.3	Very low	111 Å²	111	140.4 Å²	140.4	52%	0.519	73%	0.732	S	S	.	*	T	Hydrogen-bonded Turn	trans	-82	-22.7	176.7	-71.6	-172.3	155.3	0	0	112.8	T21	T21-E24 PolarHBondContact O-N 3.15Å; T21-E24 VanDerWaalsContact O-N 3.14Å
25	L	38.5	Very low	33.7	Very low	100 Å²	100	141.6 Å²	141.6	52%	0.524	73%	0.725	S	S	.	*	T	Hydrogen-bonded Turn	trans	-77.5	-18.5	178.9	-93.2	95.1	0	0	0	113.9	L31	L25-L31 HydrophobicContact CD2-CD1 3.96Å
26	T	37.3	Very low	34.3	Very low	119 Å²	119	135.6 Å²	135.6	73%	0.73	71%	0.712	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.7	-19.3	-176.9	12.6	0	0	0	0	113.3	P22 E23	P22-T26 PolarHBondContact O-OG1 3.34Å; E23-T26 PolarHBondContact O-OG1 3.13Å
27	I	37.9	Very low	34.5	Very low	151 Å²	151	132.3 Å²	132.3	77%	0.774	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.7	-19.2	-173.8	-60.5	175.8	0	0	0	112.5
28	L	30.3	Very low	35.2	Very low	128 Å²	128	133 Å²	133	67%	0.67	68%	0.682	S	S	*	*	S	Bend	trans	-98.5	-4.8	-170.6	-91.7	159.3	0	0	0	116.6	E30	L28-E30 PolarHBondContact O-N 3.04Å
29	G	35.3	Very low	35.7	Very low	79 Å²	79	126.8 Å²	126.8	81%	0.814	65%	0.654	S	S	*	*			trans	56.8	15.3	173.5	0	0	0	0	0	115.4
30	E	33.4	Very low	36	Very low	159 Å²	159	123.8 Å²	123.8	74%	0.743	64%	0.637	S	S	*	*			trans	-117.7	96.9	178.8	-80.2	-174.4	163.4	0	0	108.1	L28	L28-E30 PolarHBondContact O-N 3.04Å
31	L	31.6	Very low	36.6	Very low	130 Å²	130	124.2 Å²	124.2	68%	0.681	64%	0.639	S	S	*	*			trans	-176.8	74.8	136	-89.9	173	0	0	0	106.5	L25	L25-L31 HydrophobicContact CD2-CD1 3.96Å
32	R	33	Very low	37.6	Very low	195 Å²	195	126.2 Å²	126.2	74%	0.736	64%	0.64	S	S	*	*			trans	-67.4	115.3	134.7	-91.1	179.6	172.4	176.6	-4.2	104	E34 E37	R32-E34 PolarHBondContact O-N 3.07Å; R32-E34 VanDerWaalsContact O-N 3.1Å; R32-E37 WeakPolarHBondContact CD-OE1 3.33Å; R32-E37 IonicContact CZ-OE1 3.96Å; R32-E37 IonicContact NE-OE1 2.93Å; R32-E37 IonicContact NH1-OE1 3.43Å; R32-E37 PolarHBondContact NH1-OE1 3.23Å
33	D	31.6	Very low	38.8	Very low	91 Å²	91	128.8 Å²	128.8	49%	0.487	65%	0.648	S	S	.	*			trans	-52.1	122.8	165.8	-77.3	-43.1	0	0	0	107.4	E35 D36	D33-E35 HydrophobicContact CB-CB 4.43Å; D33-E35 PolarHBondContact O-N 3.25Å; D33-D36 PolarHBondContact O-N 3.4Å
34	E	33.4	Very low	41	Very low	169 Å²	169	123.2 Å²	123.2	79%	0.79	62%	0.621	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.1	-4.5	172.5	-71.2	-163	154.5	0	0	112.5	R32 I38	R32-E34 PolarHBondContact O-N 3.07Å; R32-E34 VanDerWaalsContact O-N 3.1Å; E34-I38 WeakPolarHBondContact O-CD1 3.27Å
35	E	39.2	Very low	43.5	Very low	149 Å²	149	121.2 Å²	121.2	70%	0.696	61%	0.611	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.5	-26	173.4	-58.1	-152	147	0	0	113.7	D33	D33-E35 HydrophobicContact CB-CB 4.43Å; D33-E35 PolarHBondContact O-N 3.25Å
36	D	38.8	Very low	45.8	Very low	124 Å²	124	117.3 Å²	117.3	66%	0.663	59%	0.592	S	S	*	*	S	Bend	trans	-96.5	-12.8	-172.7	-75.3	-17.8	0	0	0	114.6	D33 I38	D33-D36 PolarHBondContact O-N 3.4Å; D36-I38 VanDerWaalsContact C-N 3.31Å; D36-I38 PolarHBondContact O-N 3.37Å
37	E	36	Very low	48.2	Very low	128 Å²	128	112.1 Å²	112.1	60%	0.598	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.5	-1.2	178.3	-93.7	-172.7	173.3	0	0	114.6	R32	R32-E37 WeakPolarHBondContact CD-OE1 3.33Å; R32-E37 IonicContact CZ-OE1 3.96Å; R32-E37 IonicContact NE-OE1 2.93Å; R32-E37 IonicContact NH1-OE1 3.43Å; R32-E37 PolarHBondContact NH1-OE1 3.23Å
38	I	42.3	Very low	50.5	Low	86 Å²	86	106.8 Å²	106.8	44%	0.441	53%	0.533	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.5	-12.8	-168.7	-55.8	166	0	0	0	113	E34 D36 P40 R360	E34-I38 WeakPolarHBondContact O-CD1 3.27Å; D36-I38 VanDerWaalsContact C-N 3.31Å; D36-I38 PolarHBondContact O-N 3.37Å; I38-P40 VanDerWaalsContact O-CD 3.22Å; I38-P40 WeakPolarHBondContact O-CD 3.46Å; I38-R360 VanDerWaalsContact CD1-NH2 3.32Å
39	L	40.6	Very low	53	Low	54 Å²	54	101.8 Å²	101.8	28%	0.283	51%	0.505	S	S	.	.	S	Bend	trans	-79.7	114.8	174.5	-69.4	167.6	0	0	0	108.4	R41 Q579 L580	L39-R41 VanDerWaalsContact C-N 3.35Å; L39-R41 PolarHBondContact O-N 3Å; L39-Q579 VanDerWaalsContact CD2-O 3.24Å; L39-Q579 WeakPolarHBondContact CD2-O 3.35Å; L39-L580 VanDerWaalsContact CD2-C 3.42Å; L39-L580 WeakPolarHBondContact CD2-O 3.37Å
40	P	37.3	Very low	55.3	Low	84 Å²	84	100.4 Å²	100.4	55%	0.545	48%	0.479	S	S	.	.			trans	-61.4	104.3	169.3	25.8	-31.1	0	0	0	106.6	I38 K42	I38-P40 VanDerWaalsContact O-CD 3.22Å; I38-P40 WeakPolarHBondContact O-CD 3.46Å; P40-K42 PolarHBondContact O-N 3.24Å
41	R	45.9	Very low	57.5	Low	199 Å²	199	97 Å²	97	75%	0.751	46%	0.46	S	S	*	.			trans	-63.2	88.1	168.3	-79.6	-174	177.6	-176.9	-0.6	106.5	L39	L39-R41 VanDerWaalsContact C-N 3.35Å; L39-R41 PolarHBondContact O-N 3Å
42	K	56.2	Low	59.9	Low	131 Å²	131	92 Å²	92	57%	0.57	44%	0.435	S	S	*	.			trans	-71.6	132.7	163	-72.5	179.7	179.2	174.1	0	105.8	P40 Y44	P40-K42 PolarHBondContact O-N 3.24Å; K42-Y44 HydrophobicContact CB-CD2 4.21Å; K42-Y44 HydrophobicContact CB-CE2 3.81Å; K42-Y44 WeakPolarHBondContact O-CD2 3.22Å; K42-Y44 PolarHBondContact O-N 3.14Å
43	D	64.1	Low	62.4	Low	162 Å²	162	86 Å²	86	87%	0.866	42%	0.417	S	S	*	.			trans	-67.2	88.6	174.4	-60.5	-39	0	0	0	108.8
44	Y	83.3	Confident	65	Low	39 Å²	39	82 Å²	82	15%	0.153	40%	0.396	C	S	.	.	P	Polyproline II helix	trans	-80.2	119.3	175.5	-72.6	-69.9	0	0	0	109.2	K42 V165 I167 K581 V583	K42-Y44 HydrophobicContact CB-CD2 4.21Å; K42-Y44 HydrophobicContact CB-CE2 3.81Å; K42-Y44 WeakPolarHBondContact O-CD2 3.22Å; K42-Y44 PolarHBondContact O-N 3.14Å; Y44-V165 HydrophobicContact CD1-CG1 4.24Å; Y44-V165 HydrophobicContact CG-CG1 4.18Å; Y44-I167 HydrophobicContact CD1-CG1 4.36Å; Y44-I167 HydrophobicContact CE1-CG1 4.14Å; Y44-K581 PolarHBondContact OH-O 3.38Å; Y44-V583 HydrophobicContact CD2-CG2 4.45Å; Y44-V583 HydrophobicContact CE1-CG2 4.12Å; Y44-V583 HydrophobicContact CE2-CB 4.42Å; Y44-V583 HydrophobicContact CE2-CG2 3.79Å
45	E	86.7	Confident	67.6	Low	69 Å²	69	77.6 Å²	77.6	32%	0.322	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	158.5	172.4	-66.1	-177.7	168.7	0	0	111.2	K166 H629	E45-K166 HydrophobicContact CB-CB 4.21Å; E45-K166 HydrophobicContact CB-CD 4.33Å; E45-K166 WeakPolarHBondContact O-CB 3.17Å; E45-K166 PolarHBondContact O-N 3.21Å; E45-K166 IonicContact OE2-NZ 3.03Å; E45-K166 PolarHBondContact OE2-NZ 3.23Å; E45-H629 IonicContact OE1-CE1 3.63Å; E45-H629 PolarHBondContact OE1-CE1 3.35Å; E45-H629 VanDerWaalsContact OE1-CE1 3.31Å; E45-H629 IonicContact OE1-NE2 3.8Å
46	S	88.7	Confident	69.9	Low	17 Å²	17	70.9 Å²	70.9	12%	0.119	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	151.4	168.4	-66.3	0	0	0	0	110.7	G164 R849	S46-G164 CarbonylContact C-O 3.53Å; S46-G164 VanDerWaalsContact CA-O 3.31Å; S46-G164 WeakPolarHBondContact CA-O 3.32Å; S46-R849 PolarHBondContact OG-NE 3.43Å
47	L	87.1	Confident	72.1	Confident	10 Å²	10	66.4 Å²	66.4	5%	0.052	32%	0.318	C	S	.	.	P	Polyproline II helix	trans	-77	143.9	172.8	-66.5	169.6	0	0	0	110.8	Y49 Y161 G164 K166	L47-Y49 PolarHBondContact O-N 3.34Å; L47-Y161 HydrophobicContact CD1-CD1 4.34Å; L47-Y161 HydrophobicContact CD1-CD2 4.1Å; L47-Y161 HydrophobicContact CD1-CE1 4.05Å; L47-Y161 HydrophobicContact CD1-CE2 3.78Å; L47-Y161 HydrophobicContact CD1-CG 4.37Å; L47-Y161 WeakPolarHBondContact CD1-O 3.26Å; L47-Y161 HydrophobicContact CD2-CE2 4Å; L47-Y161 HydrophobicContact CG-CE2 4.41Å; L47-G164 PolarHBondContact N-O 3.14Å; L47-K166 HydrophobicContact CD2-CB 4Å; L47-K166 HydrophobicContact CD2-CD 4.27Å; L47-K166 HydrophobicContact CD2-CG 4.16Å; L47-K166 HydrophobicContact CG-CB 4.25Å
48	D	85.8	Confident	74.5	Confident	40 Å²	40	62.6 Å²	62.6	21%	0.214	30%	0.304	C	S	.	.			trans	-89	85.3	178.3	-67.2	-42.3	0	0	0	110.3	D231 R832	D48-D231 PolarHBondContact N-OD2 3.07Å; D48-D231 VanDerWaalsContact N-OD2 3.14Å; D48-D231 WeakPolarHBondContact O-CB 3.38Å; D48-R832 WeakPolarHBondContact OD1-CD 3.43Å; D48-R832 IonicContact OD1-CZ 3.88Å; D48-R832 IonicContact OD1-NE 2.77Å; D48-R832 IonicContact OD1-NH1 2.74Å; D48-R832 PolarHBondContact OD1-NH1 3.39Å; D48-R832 IonicContact OD2-NH1 2.8Å; D48-R832 PolarHBondContact OD2-NH1 2.03Å
49	Y	82.3	Confident	76.6	Confident	22 Å²	22	62.8 Å²	62.8	9%	0.086	30%	0.303	C	S	.	.			trans	-81.6	-38.3	-178.7	-171.1	-99.9	0	0	0	113.9	L47 R51 R232 F267 G830	L47-Y49 PolarHBondContact O-N 3.34Å; Y49-R51 PolarHBondContact O-N 3.19Å; Y49-R232 HydrophobicContact CD2-CB 3.76Å; Y49-R232 HydrophobicContact CD2-CG 4.03Å; Y49-R232 HydrophobicContact CE2-CB 3.62Å; Y49-R232 HydrophobicContact CE2-CG 3.36Å; Y49-R232 PolarHBondContact OH-NE 2.82Å; Y49-R232 PolarHBondContact OH-NH2 3.19Å; Y49-F267 HydrophobicContact CD1-CD2 4.47Å; Y49-F267 AromaticContact CD1-CE1 3.69Å; Y49-F267 HydrophobicContact CD1-CE1 3.69Å; Y49-F267 AromaticContact CD1-CE2 3.69Å; Y49-F267 HydrophobicContact CD1-CE2 3.69Å; Y49-F267 AromaticContact CD1-CZ 3.16Å; Y49-F267 HydrophobicContact CD1-CZ 3.16Å; Y49-F267 HydrophobicContact CD2-CE1 4.29Å; Y49-F267 AromaticContact CD2-CE2 3.8Å; Y49-F267 HydrophobicContact CD2-CE2 3.8Å; Y49-F267 AromaticContact CD2-CZ 3.25Å; Y49-F267 HydrophobicContact CD2-CZ 3.25Å; Y49-F267 AromaticContact CE1-CD2 3.74Å; Y49-F267 HydrophobicContact CE1-CD2 3.74Å; Y49-F267 AromaticContact CE1-CE1 3.94Å; Y49-F267 HydrophobicContact CE1-CE1 3.94Å; Y49-F267 AromaticContact CE1-CE2 3.09Å; Y49-F267 HydrophobicContact CE1-CE2 3.09Å; Y49-F267 HydrophobicContact CE1-CG 4.42Å; Y49-F267 AromaticContact CE1-CZ 3.14Å; Y49-F267 HydrophobicContact CE1-CZ 3.14Å; Y49-F267 HydrophobicContact CE2-CD2 4.42Å; Y49-F267 HydrophobicContact CE2-CE1 4.47Å; Y49-F267 AromaticContact CE2-CE2 3.18Å; Y49-F267 HydrophobicContact CE2-CE2 3.18Å; Y49-F267 AromaticContact CE2-CZ 3.18Å; Y49-F267 HydrophobicContact CE2-CZ 3.18Å; Y49-F267 AromaticContact CG-CE1 3.89Å; Y49-F267 HydrophobicContact CG-CE1 3.89Å; Y49-F267 HydrophobicContact CG-CE2 4.01Å; Y49-F267 AromaticContact CG-CZ 3.22Å; Y49-F267 HydrophobicContact CG-CZ 3.22Å; Y49-F267 AromaticContact CZ-CD2 3.72Å; Y49-F267 AromaticContact CZ-CE2 2.81Å; Y49-F267 AromaticContact CZ-CZ 3.17Å; Y49-F267 WeakPolarHBondContact OH-CE2 3.49Å; Y49-G830 WeakPolarHBondContact CB-O 3.27Å
50	D	84.3	Confident	78.7	Confident	51 Å²	51	63 Å²	63	27%	0.273	31%	0.306	S	S	.	.	S	Bend	trans	-65.1	129.2	176.7	-171.8	28.5	0	0	0	109.7	C52 L831	D50-C52 PolarHBondContact O-N 2.81Å; D50-L831 HydrophobicContact CB-CD2 4.19Å
51	R	80.2	Confident	81	Confident	87 Å²	87	62.6 Å²	62.6	33%	0.328	30%	0.299	S	S	.	.			trans	-80.1	122.1	-178.4	-78.8	-173.1	173.7	171.3	0.4	108.2	Y49 I53 Y57 D233	Y49-R51 PolarHBondContact O-N 3.19Å; R51-I53 PolarHBondContact O-N 3.47Å; R51-Y57 PolarHBondContact NH1-OH 3.18Å; R51-D233 IonicContact NH2-OD1 2.7Å; R51-D233 IonicContact NH2-OD2 3.7Å; R51-D233 PolarHBondContact NH2-OD2 3.43Å
52	C	81.8	Confident	82.9	Confident	25 Å²	25	60.7 Å²	60.7	17%	0.169	30%	0.299	C	S	.	.			trans	-65.7	106.1	170.1	-176	0	0	0	0	109.4	D50 N54 Q748	D50-C52 PolarHBondContact O-N 2.81Å; C52-N54 PolarHBondContact O-N 3.2Å; C52-Q748 PolarHBondContact SG-NE2 3.38Å
53	I	84.3	Confident	84.2	Confident	70 Å²	70	56.2 Å²	56.2	36%	0.359	29%	0.29	S	S	.	.			trans	-85.7	89.5	174.7	-55.4	175.2	0	0	0	107.5	R51 V58	R51-I53 PolarHBondContact O-N 3.47Å; I53-V58 HydrophobicContact CG2-CG2 3.78Å
54	N	87.6	Confident	85.1	Confident	5 Å²	5	51.4 Å²	51.4	3%	0.027	26%	0.264	C	S	.	.			trans	-107.7	168	175.5	65.5	0.7	0	0	0	111.1	C52 Y57 V58 M776 Y805	C52-N54 PolarHBondContact O-N 3.2Å; N54-Y57 PolarHBondContact O-N 3.4Å; N54-Y57 WeakPolarHBondContact OD1-CB 3.2Å; N54-Y57 PolarHBondContact OD1-N 3.49Å; N54-V58 WeakPolarHBondContact O-CG2 3.12Å; N54-V58 PolarHBondContact O-N 3.44Å; N54-M776 WeakPolarHBondContact ND2-CE 3.4Å; N54-Y805 WeakPolarHBondContact CB-O 3.25Å; N54-Y805 PolarHBondContact ND2-O 3.01Å
55	E	86.9	Confident	85.3	Confident	78 Å²	78	54 Å²	54	36%	0.364	28%	0.28	S	S	.	.	H	α-helix	trans	-56.7	-45.2	-176.6	-164.7	-178.4	167	0	0	112.3	Y57 V58 E59 R770 P804	E55-Y57 VanDerWaalsContact C-N 3.27Å; E55-Y57 PolarHBondContact O-N 3.48Å; E55-V58 PolarHBondContact O-N 2.97Å; E55-V58 VanDerWaalsContact O-N 3.1Å; E55-E59 WeakPolarHBondContact O-CG 3.37Å; E55-E59 PolarHBondContact O-N 3.28Å; E55-R770 IonicContact OE1-CZ 2.74Å; E55-R770 VanDerWaalsContact OE1-CZ 3.27Å; E55-R770 IonicContact OE1-NH1 3.48Å; E55-R770 PolarHBondContact OE1-NH1 3.21Å; E55-R770 IonicContact OE1-NH2 2.75Å; E55-R770 PolarHBondContact OE1-NH2 3.27Å; E55-R770 IonicContact OE2-NH2 3.72Å; E55-P804 HydrophobicContact CB-CB 4.25Å; E55-P804 WeakPolarHBondContact CB-O 3.36Å; E55-P804 PolarHBondContact N-O 3.4Å; E55-P804 VanDerWaalsContact OE2-CB 3.25Å; E55-P804 WeakPolarHBondContact OE2-CB 3.34Å
56	P	87.2	Confident	85.3	Confident	7 Å²	7	57.4 Å²	57.4	5%	0.045	30%	0.3	C	S	.	.	H	α-helix	trans	-60.4	-33	175.8	-24.8	34.4	0	0	0	114.2	V60 L771 F773 M776 P804 Y805	P56-V60 WeakPolarHBondContact O-CG2 3.38Å; P56-V60 PolarHBondContact O-N 2.87Å; P56-L771 WeakPolarHBondContact CG-O 3.18Å; P56-F773 HydrophobicContact CB-CB 4.34Å; P56-M776 HydrophobicContact CB-SD 4.33Å; P56-M776 HydrophobicContact CG-SD 4.13Å; P56-P804 WeakPolarHBondContact CD-O 3.21Å; P56-Y805 HydrophobicContact CG-CD1 3.8Å; P56-Y805 HydrophobicContact CG-CE1 3.73Å
57	Y	85.4	Confident	85.3	Confident	31 Å²	31	65.2 Å²	65.2	12%	0.122	33%	0.333	C	S	.	.	H	α-helix	trans	-75.7	-35.7	176.2	-174.5	-112	0	0	0	111.9	R51 N54 E55 E59 V60 L61 F773	R51-Y57 PolarHBondContact NH1-OH 3.18Å; N54-Y57 PolarHBondContact O-N 3.4Å; N54-Y57 WeakPolarHBondContact OD1-CB 3.2Å; N54-Y57 PolarHBondContact OD1-N 3.49Å; E55-Y57 VanDerWaalsContact C-N 3.27Å; E55-Y57 PolarHBondContact O-N 3.48Å; Y57-E59 VanDerWaalsContact C-N 3.34Å; Y57-V60 WeakPolarHBondContact O-CB 3.44Å; Y57-V60 PolarHBondContact O-N 3.24Å; Y57-L61 HydrophobicContact CD1-CD1 3.97Å; Y57-L61 HydrophobicContact CD1-CG 4.29Å; Y57-L61 HydrophobicContact CE1-CD1 3.75Å; Y57-L61 HydrophobicContact CE1-CD2 4.21Å; Y57-L61 HydrophobicContact CE1-CG 4.02Å; Y57-L61 WeakPolarHBondContact O-CG 3.43Å; Y57-L61 PolarHBondContact O-N 3.46Å; Y57-F773 HydrophobicContact CD2-CD1 4.35Å; Y57-F773 AromaticContact CD2-CD2 3.75Å; Y57-F773 HydrophobicContact CD2-CD2 3.75Å; Y57-F773 HydrophobicContact CD2-CE1 4.14Å; Y57-F773 AromaticContact CD2-CE2 3.51Å; Y57-F773 HydrophobicContact CD2-CE2 3.51Å; Y57-F773 HydrophobicContact CD2-CG 4.17Å; Y57-F773 AromaticContact CD2-CZ 3.72Å; Y57-F773 HydrophobicContact CD2-CZ 3.72Å; Y57-F773 HydrophobicContact CE2-CE1 4.4Å; Y57-F773 HydrophobicContact CE2-CE2 4.29Å; Y57-F773 HydrophobicContact CE2-CZ 4.08Å; Y57-F773 HydrophobicContact CG-CD2 4.29Å; Y57-F773 HydrophobicContact CG-CE2 4.17Å
58	V	87.3	Confident	85.1	Confident	48 Å²	48	69.2 Å²	69.2	29%	0.291	35%	0.349	S	S	.	.	H	α-helix	trans	-62.9	-42.2	173.7	175.1	0	0	0	0	110.5	I53 N54 E55 V60 L61 E62	I53-V58 HydrophobicContact CG2-CG2 3.78Å; N54-V58 WeakPolarHBondContact O-CG2 3.12Å; N54-V58 PolarHBondContact O-N 3.44Å; E55-V58 PolarHBondContact O-N 2.97Å; E55-V58 VanDerWaalsContact O-N 3.1Å; V58-V60 VanDerWaalsContact C-N 3.26Å; V58-V60 PolarHBondContact O-N 3.14Å; V58-L61 CarbonylContact O-C 3.57Å; V58-L61 WeakPolarHBondContact O-CA 3.27Å; V58-L61 WeakPolarHBondContact O-CB 3.46Å; V58-L61 PolarHBondContact O-N 3.09Å; V58-E62 HydrophobicContact CG1-CG 4.28Å; V58-E62 WeakPolarHBondContact O-CG 3.38Å; V58-E62 PolarHBondContact O-N 2.94Å
59	E	86.4	Confident	85	Confident	89 Å²	89	69.3 Å²	69.3	42%	0.416	36%	0.356	S	S	.	.	H	α-helix	trans	-57.4	-39.6	173.6	-70.8	177.8	179.8	0	0	111.8	E55 Y57 G63 R770	E55-E59 WeakPolarHBondContact O-CG 3.37Å; E55-E59 PolarHBondContact O-N 3.28Å; Y57-E59 VanDerWaalsContact C-N 3.34Å; E59-G63 PolarHBondContact O-N 3.28Å; E59-R770 IonicContact OE1-NH1 3.99Å; E59-R770 PolarHBondContact OE1-NH1 2.96Å
60	V	84.9	Confident	85.2	Confident	58 Å²	58	77.8 Å²	77.8	35%	0.352	39%	0.387	S	S	.	.	H	α-helix	trans	-62.7	-45.6	172.8	173.3	0	0	0	0	110.9	P56 Y57 V58 G63 L64 F773	P56-V60 WeakPolarHBondContact O-CG2 3.38Å; P56-V60 PolarHBondContact O-N 2.87Å; Y57-V60 WeakPolarHBondContact O-CB 3.44Å; Y57-V60 PolarHBondContact O-N 3.24Å; V58-V60 VanDerWaalsContact C-N 3.26Å; V58-V60 PolarHBondContact O-N 3.14Å; V60-G63 PolarHBondContact O-N 2.88Å; V60-L64 WeakPolarHBondContact O-CG 3.36Å; V60-L64 PolarHBondContact O-N 3.49Å; V60-F773 HydrophobicContact CG2-CB 3.73Å; V60-F773 HydrophobicContact CG2-CD1 4.46Å; V60-F773 HydrophobicContact CG2-CG 4.31Å
61	L	84.7	Confident	85.3	Confident	77 Å²	77	82.5 Å²	82.5	40%	0.403	41%	0.406	S	S	.	.	H	α-helix	trans	-62.5	-41.7	179.4	-69.2	174.5	0	0	0	112.2	Y57 V58 G63 L64	Y57-L61 HydrophobicContact CD1-CD1 3.97Å; Y57-L61 HydrophobicContact CD1-CG 4.29Å; Y57-L61 HydrophobicContact CE1-CD1 3.75Å; Y57-L61 HydrophobicContact CE1-CD2 4.21Å; Y57-L61 HydrophobicContact CE1-CG 4.02Å; Y57-L61 WeakPolarHBondContact O-CG 3.43Å; Y57-L61 PolarHBondContact O-N 3.46Å; V58-L61 CarbonylContact O-C 3.57Å; V58-L61 WeakPolarHBondContact O-CA 3.27Å; V58-L61 WeakPolarHBondContact O-CB 3.46Å; V58-L61 PolarHBondContact O-N 3.09Å; L61-G63 VanDerWaalsContact C-N 3.28Å; L61-G63 PolarHBondContact O-N 3.2Å; L61-L64 HydrophobicContact CD2-CD1 3.89Å; L61-L64 WeakPolarHBondContact O-CB 3.37Å; L61-L64 PolarHBondContact O-N 3.49Å; L61-L64 VanDerWaalsContact O-N 3.16Å
62	E	86.3	Confident	85.5	Confident	158 Å²	158	81.2 Å²	81.2	74%	0.738	40%	0.401	S	S	*	.	H	α-helix	trans	-66.4	-31.7	176.7	-69.7	179.7	173.4	0	0	111.8	V58 L64	V58-E62 HydrophobicContact CG1-CG 4.28Å; V58-E62 WeakPolarHBondContact O-CG 3.38Å; V58-E62 PolarHBondContact O-N 2.94Å; E62-L64 VanDerWaalsContact C-N 3.3Å; E62-L64 PolarHBondContact O-N 2.8Å
63	G	83.3	Confident	85.8	Confident	37 Å²	37	83.6 Å²	83.6	38%	0.381	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.4	-3.1	173.1	0	0	0	0	0	115.8	E59 V60 L61 D65 K68	E59-G63 PolarHBondContact O-N 3.28Å; V60-G63 PolarHBondContact O-N 2.88Å; L61-G63 VanDerWaalsContact C-N 3.28Å; L61-G63 PolarHBondContact O-N 3.2Å; G63-D65 PolarHBondContact O-N 3.49Å; G63-K68 PolarHBondContact O-NZ 2.72Å
64	L	82.3	Confident	86.1	Confident	62 Å²	62	82.8 Å²	82.8	33%	0.325	41%	0.414	S	S	.	.			trans	-82.1	96.8	179.4	-74	176.8	0	0	0	112	V60 L61 E62 Y72	V60-L64 WeakPolarHBondContact O-CG 3.36Å; V60-L64 PolarHBondContact O-N 3.49Å; L61-L64 HydrophobicContact CD2-CD1 3.89Å; L61-L64 WeakPolarHBondContact O-CB 3.37Å; L61-L64 PolarHBondContact O-N 3.49Å; L61-L64 VanDerWaalsContact O-N 3.16Å; E62-L64 VanDerWaalsContact C-N 3.3Å; E62-L64 PolarHBondContact O-N 2.8Å; L64-Y72 HydrophobicContact CD2-CD2 4Å; L64-Y72 HydrophobicContact CD2-CE2 3.35Å
65	D	88.1	Confident	86.1	Confident	94 Å²	94	84.4 Å²	84.4	50%	0.503	42%	0.424	S	S	.	.			trans	-68.6	152.4	166.6	-59.1	-50.5	0	0	0	112.1	G63 K67 K68 A69	G63-D65 PolarHBondContact O-N 3.49Å; D65-K67 PolarHBondContact O-N 3.15Å; D65-K67 VanDerWaalsContact O-N 3.07Å; D65-K68 HydrophobicContact CB-CG 4.33Å; D65-K68 WeakPolarHBondContact O-CA 3.5Å; D65-K68 WeakPolarHBondContact O-CB 3.4Å; D65-K68 PolarHBondContact O-N 3.23Å; D65-K68 WeakPolarHBondContact OD2-CE 3.33Å; D65-K68 IonicContact OD2-NZ 3.86Å; D65-A69 PolarHBondContact O-N 3.23Å
66	N	87.4	Confident	86.2	Confident	139 Å²	139	82.4 Å²	82.4	74%	0.743	41%	0.413	S	S	*	.	H	α-helix	trans	-51.5	-34.6	172.4	-79.9	-24.7	0	0	0	113.3	R70	N66-R70 WeakPolarHBondContact O-CG 3.29Å; N66-R70 PolarHBondContact O-N 3.5Å
67	K	86.9	Confident	86.5	Confident	182 Å²	182	86.2 Å²	86.2	79%	0.791	43%	0.426	S	S	*	.	H	α-helix	trans	-66.9	-42.8	175.7	-70.2	-176.9	-178	176.5	0	111.9	D65 K71	D65-K67 PolarHBondContact O-N 3.15Å; D65-K67 VanDerWaalsContact O-N 3.07Å; K67-K71 PolarHBondContact O-N 2.72Å
68	K	83.6	Confident	86.9	Confident	93 Å²	93	88.8 Å²	88.8	40%	0.404	45%	0.445	S	S	.	.	H	α-helix	trans	-67.1	-44.2	176.9	-63.4	178.9	-166.7	163.9	0	110.2	G63 D65 R70 K71 Y72	G63-K68 PolarHBondContact O-NZ 2.72Å; D65-K68 HydrophobicContact CB-CG 4.33Å; D65-K68 WeakPolarHBondContact O-CA 3.5Å; D65-K68 WeakPolarHBondContact O-CB 3.4Å; D65-K68 PolarHBondContact O-N 3.23Å; D65-K68 WeakPolarHBondContact OD2-CE 3.33Å; D65-K68 IonicContact OD2-NZ 3.86Å; K68-R70 PolarHBondContact O-N 2.8Å; K68-K71 CarbonylContact O-C 3.54Å; K68-K71 WeakPolarHBondContact O-CA 3.24Å; K68-K71 WeakPolarHBondContact O-CB 3.43Å; K68-K71 PolarHBondContact O-N 3.11Å; K68-Y72 VanDerWaalsContact C-CD2 3.5Å; K68-Y72 HydrophobicContact CB-CD2 4.46Å; K68-Y72 HydrophobicContact CB-CE2 3.92Å; K68-Y72 WeakPolarHBondContact O-CD2 3.37Å; K68-Y72 PolarHBondContact O-N 3Å
69	A	84	Confident	87	Confident	42 Å²	42	87.2 Å²	87.2	35%	0.347	44%	0.435	S	S	.	.	H	α-helix	trans	-54.7	-48.3	174.9	0	0	0	0	0	112.6	D65 K71 Y72 E73	D65-A69 PolarHBondContact O-N 3.23Å; A69-K71 VanDerWaalsContact C-N 3.33Å; A69-K71 PolarHBondContact O-N 2.96Å; A69-Y72 PolarHBondContact O-N 2.7Å; A69-E73 PolarHBondContact O-N 3.13Å
70	R	86.9	Confident	87.4	Confident	200 Å²	200	83.1 Å²	83.1	76%	0.755	42%	0.416	S	S	*	.	H	α-helix	trans	-61.6	-39.6	174.5	-75	-179.5	179.6	-178.9	0.5	112.6	N66 K68 E73 A74	N66-R70 WeakPolarHBondContact O-CG 3.29Å; N66-R70 PolarHBondContact O-N 3.5Å; K68-R70 PolarHBondContact O-N 2.8Å; R70-E73 PolarHBondContact O-N 2.98Å; R70-A74 WeakPolarHBondContact O-CB 3.42Å; R70-A74 PolarHBondContact O-N 3.22Å
71	K	86.8	Confident	87.9	Confident	151 Å²	151	85 Å²	85	66%	0.657	42%	0.419	S	S	*	.	H	α-helix	trans	-62.8	-43.6	175.2	-172.3	-179.8	178.3	-178.6	0	111.5	K67 K68 A69 E73 A74 V75	K67-K71 PolarHBondContact O-N 2.72Å; K68-K71 CarbonylContact O-C 3.54Å; K68-K71 WeakPolarHBondContact O-CA 3.24Å; K68-K71 WeakPolarHBondContact O-CB 3.43Å; K68-K71 PolarHBondContact O-N 3.11Å; A69-K71 VanDerWaalsContact C-N 3.33Å; A69-K71 PolarHBondContact O-N 2.96Å; K71-E73 VanDerWaalsContact C-N 3.35Å; K71-E73 PolarHBondContact O-N 3.3Å; K71-A74 PolarHBondContact O-N 3.34Å; K71-V75 VanDerWaalsContact O-CG2 3.29Å; K71-V75 WeakPolarHBondContact O-CG2 3.37Å; K71-V75 PolarHBondContact O-N 3.43Å
72	Y	83.8	Confident	88.4	Confident	60 Å²	60	83.8 Å²	83.8	24%	0.235	42%	0.415	C	S	.	.	H	α-helix	trans	-59.9	-46	176.2	-71	-58	0	0	0	112.2	L64 K68 A69 V75 R76 Y227	L64-Y72 HydrophobicContact CD2-CD2 4Å; L64-Y72 HydrophobicContact CD2-CE2 3.35Å; K68-Y72 VanDerWaalsContact C-CD2 3.5Å; K68-Y72 HydrophobicContact CB-CD2 4.46Å; K68-Y72 HydrophobicContact CB-CE2 3.92Å; K68-Y72 WeakPolarHBondContact O-CD2 3.37Å; K68-Y72 PolarHBondContact O-N 3Å; A69-Y72 PolarHBondContact O-N 2.7Å; Y72-V75 PolarHBondContact O-N 2.93Å; Y72-R76 WeakPolarHBondContact O-CB 3.35Å; Y72-R76 PolarHBondContact O-N 3.34Å; Y72-Y227 HydrophobicContact CD1-CD1 4.08Å; Y72-Y227 HydrophobicContact CD1-CD2 4.27Å; Y72-Y227 AromaticContact CD1-CG 3.91Å; Y72-Y227 HydrophobicContact CD1-CG 3.91Å; Y72-Y227 AromaticContact CE1-CD1 3.15Å; Y72-Y227 HydrophobicContact CE1-CD1 3.15Å; Y72-Y227 AromaticContact CE1-CD2 3.57Å; Y72-Y227 HydrophobicContact CE1-CD2 3.57Å; Y72-Y227 AromaticContact CE1-CE1 3.31Å; Y72-Y227 HydrophobicContact CE1-CE1 3.31Å; Y72-Y227 AromaticContact CE1-CE2 3.69Å; Y72-Y227 HydrophobicContact CE1-CE2 3.69Å; Y72-Y227 AromaticContact CE1-CG 3.27Å; Y72-Y227 HydrophobicContact CE1-CG 3.27Å; Y72-Y227 AromaticContact CE1-CZ 3.54Å; Y72-Y227 AromaticContact CZ-CD1 3.63Å; Y72-Y227 AromaticContact CZ-CE1 3.4Å; Y72-Y227 VanDerWaalsContact CZ-CE1 3.4Å; Y72-Y227 AromaticContact CZ-CZ 3.76Å; Y72-Y227 WeakPolarHBondContact OH-CE1 3.29Å; Y72-Y227 PolarHBondContact OH-OH 3.33Å
73	E	87.6	Confident	88.9	Confident	74 Å²	74	76.3 Å²	76.3	35%	0.346	38%	0.38	S	S	.	.	H	α-helix	trans	-65.1	-42.5	179.5	-171	60	-168.3	0	0	110.8	A69 R70 K71 V75 R76 W77 K275	A69-E73 PolarHBondContact O-N 3.13Å; R70-E73 PolarHBondContact O-N 2.98Å; K71-E73 VanDerWaalsContact C-N 3.35Å; K71-E73 PolarHBondContact O-N 3.3Å; E73-V75 PolarHBondContact O-N 3.49Å; E73-R76 WeakPolarHBondContact O-CB 3.33Å; E73-R76 PolarHBondContact O-N 3.05Å; E73-R76 VanDerWaalsContact O-N 3.15Å; E73-W77 PolarHBondContact O-N 3.44Å; E73-W77 PolarHBondContact OE1-NE1 3.27Å; E73-K275 VanDerWaalsContact CD-NZ 3.26Å; E73-K275 WeakPolarHBondContact OE1-CE 3.48Å; E73-K275 IonicContact OE1-NZ 3.53Å; E73-K275 PolarHBondContact OE1-NZ 2.95Å; E73-K275 IonicContact OE2-NZ 2.75Å; E73-K275 PolarHBondContact OE2-NZ 3.25Å
74	A	89.8	Confident	89.5	Confident	54 Å²	54	74.6 Å²	74.6	45%	0.446	36%	0.362	S	S	.	.	H	α-helix	trans	-59.7	-46.1	174.7	0	0	0	0	0	112.5	R70 K71 R76 W77 V78	R70-A74 WeakPolarHBondContact O-CB 3.42Å; R70-A74 PolarHBondContact O-N 3.22Å; K71-A74 PolarHBondContact O-N 3.34Å; A74-R76 VanDerWaalsContact C-N 3.26Å; A74-R76 PolarHBondContact O-N 2.83Å; A74-W77 PolarHBondContact O-N 3.21Å; A74-V78 WeakPolarHBondContact O-CG2 3.2Å; A74-V78 PolarHBondContact O-N 3.37Å
75	V	88.9	Confident	90.2	Very high	38 Å²	38	73.3 Å²	73.3	23%	0.23	36%	0.357	C	S	.	.	H	α-helix	trans	-61.9	-37.9	176	177.1	0	0	0	0	110.6	K71 Y72 E73 V78 M79 F228	K71-V75 VanDerWaalsContact O-CG2 3.29Å; K71-V75 WeakPolarHBondContact O-CG2 3.37Å; K71-V75 PolarHBondContact O-N 3.43Å; Y72-V75 PolarHBondContact O-N 2.93Å; E73-V75 PolarHBondContact O-N 3.49Å; V75-V78 PolarHBondContact O-N 3.34Å; V75-M79 HydrophobicContact CG1-CE 4.5Å; V75-M79 HydrophobicContact CG1-CG 4.37Å; V75-M79 WeakPolarHBondContact O-CG 3.32Å; V75-M79 PolarHBondContact O-N 3.45Å; V75-F228 HydrophobicContact CB-CE2 4.5Å; V75-F228 HydrophobicContact CB-CZ 4.34Å; V75-F228 HydrophobicContact CG1-CE2 3.65Å; V75-F228 HydrophobicContact CG1-CZ 3.96Å
76	R	89.5	Confident	90.6	Very high	37 Å²	37	70.7 Å²	70.7	14%	0.14	34%	0.344	C	S	.	.	H	α-helix	trans	-62.6	-43.6	176.5	-172.9	166.2	177.4	169.8	8.9	111.8	Y72 E73 A74 M79 V80 F228 D233 D236 F237 K275	Y72-R76 WeakPolarHBondContact O-CB 3.35Å; Y72-R76 PolarHBondContact O-N 3.34Å; E73-R76 WeakPolarHBondContact O-CB 3.33Å; E73-R76 PolarHBondContact O-N 3.05Å; E73-R76 VanDerWaalsContact O-N 3.15Å; A74-R76 VanDerWaalsContact C-N 3.26Å; A74-R76 PolarHBondContact O-N 2.83Å; R76-M79 PolarHBondContact O-N 3.28Å; R76-V80 VanDerWaalsContact O-CG2 3.26Å; R76-V80 WeakPolarHBondContact O-CG2 3.28Å; R76-V80 PolarHBondContact O-N 3.48Å; R76-F228 HydrophobicContact CB-CE1 4.02Å; R76-F228 HydrophobicContact CB-CZ 4.04Å; R76-F228 HydrophobicContact CG-CE1 4.28Å; R76-D233 IonicContact CZ-OD1 2.88Å; R76-D233 IonicContact NH1-OD1 3.22Å; R76-D233 PolarHBondContact NH1-OD1 2.85Å; R76-D233 IonicContact NH2-OD1 3.66Å; R76-D236 IonicContact CZ-OD2 3.15Å; R76-D236 IonicContact NH2-OD2 2.58Å; R76-D236 PolarHBondContact NH2-OD2 2.92Å; R76-F237 HydrophobicContact CG-CE1 4.15Å; R76-F237 HydrophobicContact CG-CZ 4.03Å; R76-K275 HydrophobicContact CG-CD 4.42Å
77	W	93.1	Very high	91	Very high	87 Å²	87	64.1 Å²	64.1	33%	0.33	31%	0.309	S	S	.	.	H	α-helix	trans	-62	-42.3	173.6	-80.4	100.3	0	0	0	112.7	E73 A74 V80 F81 W274 K275 F278	E73-W77 PolarHBondContact O-N 3.44Å; E73-W77 PolarHBondContact OE1-NE1 3.27Å; A74-W77 PolarHBondContact O-N 3.21Å; W77-V80 PolarHBondContact O-N 3.14Å; W77-F81 PolarHBondContact O-N 3.03Å; W77-W274 HydrophobicContact CH2-CB 4.06Å; W77-K275 HydrophobicContact CD2-CG 4.34Å; W77-K275 HydrophobicContact CE3-CG 4.43Å; W77-K275 HydrophobicContact CH2-CG 3.96Å; W77-K275 HydrophobicContact CZ2-CG 3.82Å; W77-K275 HydrophobicContact CZ3-CG 4.26Å; W77-F278 HydrophobicContact CE3-CB 4.46Å; W77-F278 AromaticContact CE3-CD1 3.66Å; W77-F278 HydrophobicContact CE3-CD1 3.66Å; W77-F278 HydrophobicContact CE3-CE1 4.07Å; W77-F278 HydrophobicContact CE3-CG 4.14Å; W77-F278 HydrophobicContact CZ3-CB 3.68Å; W77-F278 AromaticContact CZ3-CD1 3.73Å; W77-F278 HydrophobicContact CZ3-CD1 3.73Å; W77-F278 HydrophobicContact CZ3-CE1 4.49Å; W77-F278 AromaticContact CZ3-CG 3.74Å; W77-F278 HydrophobicContact CZ3-CG 3.74Å
78	V	92.4	Very high	91.4	Very high	84 Å²	84	55.5 Å²	55.5	51%	0.509	27%	0.272	S	S	.	.	H	α-helix	trans	-62.7	-43.3	175.8	172.9	0	0	0	0	111.2	A74 V75 V80 F81 V82	A74-V78 WeakPolarHBondContact O-CG2 3.2Å; A74-V78 PolarHBondContact O-N 3.37Å; V75-V78 PolarHBondContact O-N 3.34Å; V78-V80 VanDerWaalsContact C-N 3.35Å; V78-V80 PolarHBondContact O-N 3.01Å; V78-F81 WeakPolarHBondContact O-CB 3.38Å; V78-F81 PolarHBondContact O-N 3.22Å; V78-V82 HydrophobicContact CG1-CG2 4.46Å; V78-V82 WeakPolarHBondContact O-CG2 3.23Å; V78-V82 PolarHBondContact O-N 3.5Å
79	M	91.1	Very high	92	Very high	15 Å²	15	54.4 Å²	54.4	7%	0.074	27%	0.27	C	S	.	.	H	α-helix	trans	-62.4	-42.9	177.3	-73.9	-63.8	170.4	0	0	111.9	V75 R76 F81 V82 I83 F225 F228 F237	V75-M79 HydrophobicContact CG1-CE 4.5Å; V75-M79 HydrophobicContact CG1-CG 4.37Å; V75-M79 WeakPolarHBondContact O-CG 3.32Å; V75-M79 PolarHBondContact O-N 3.45Å; R76-M79 PolarHBondContact O-N 3.28Å; M79-F81 VanDerWaalsContact C-N 3.33Å; M79-F81 PolarHBondContact O-N 3.21Å; M79-V82 PolarHBondContact O-N 3.22Å; M79-I83 VanDerWaalsContact O-CG1 3.25Å; M79-I83 WeakPolarHBondContact O-CG1 3.5Å; M79-I83 PolarHBondContact O-N 3.26Å; M79-F225 HydrophobicContact CE-CD2 3.89Å; M79-F225 HydrophobicContact CE-CE2 3.77Å; M79-F225 HydrophobicContact CE-CG 4.33Å; M79-F225 HydrophobicContact CE-CZ 4.11Å; M79-F228 HydrophobicContact CG-CE2 4.28Å; M79-F237 HydrophobicContact CB-CE1 4.11Å; M79-F237 HydrophobicContact CB-CZ 4.44Å
80	V	93.9	Very high	92.5	Very high	3 Å²	3	53.6 Å²	53.6	2%	0.018	26%	0.261	C	S	.	.	H	α-helix	trans	-61.4	-41.3	175.1	173.9	0	0	0	0	111.5	R76 W77 V78 I83 G84 F237 K275 F278 C279	R76-V80 VanDerWaalsContact O-CG2 3.26Å; R76-V80 WeakPolarHBondContact O-CG2 3.28Å; R76-V80 PolarHBondContact O-N 3.48Å; W77-V80 PolarHBondContact O-N 3.14Å; V78-V80 VanDerWaalsContact C-N 3.35Å; V78-V80 PolarHBondContact O-N 3.01Å; V80-I83 PolarHBondContact O-N 3.4Å; V80-G84 PolarHBondContact O-N 2.95Å; V80-F237 HydrophobicContact CG2-CD1 4.08Å; V80-F237 HydrophobicContact CG2-CE1 3.87Å; V80-K275 HydrophobicContact CG1-CB 4.38Å; V80-K275 WeakPolarHBondContact CG1-O 3.43Å; V80-K275 HydrophobicContact CG2-CB 4.29Å; V80-F278 HydrophobicContact CG1-CD1 4.26Å; V80-C279 HydrophobicContact CG1-CB 3.48Å; V80-C279 VanDerWaalsContact CG1-CB 3.48Å; V80-C279 PolarHBondContact O-SG 3.4Å
81	F	95.9	Very high	92.8	Very high	98 Å²	98	44.1 Å²	44.1	43%	0.43	23%	0.225	S	C	.	.	H	α-helix	trans	-59	-49.1	174.1	-179.2	-110.1	0	0	0	111.9	W77 V78 M79 I83 G84 V85 F278	W77-F81 PolarHBondContact O-N 3.03Å; V78-F81 WeakPolarHBondContact O-CB 3.38Å; V78-F81 PolarHBondContact O-N 3.22Å; M79-F81 VanDerWaalsContact C-N 3.33Å; M79-F81 PolarHBondContact O-N 3.21Å; F81-I83 VanDerWaalsContact C-N 3.33Å; F81-I83 PolarHBondContact O-N 2.87Å; F81-G84 PolarHBondContact O-N 3Å; F81-V85 HydrophobicContact CD1-CG2 4.36Å; F81-V85 HydrophobicContact CD2-CG2 4.48Å; F81-V85 HydrophobicContact CE1-CG2 3.95Å; F81-V85 HydrophobicContact CE2-CG2 4.07Å; F81-V85 HydrophobicContact CZ-CG2 3.79Å; F81-V85 WeakPolarHBondContact O-CG2 3.22Å; F81-V85 PolarHBondContact O-N 3.43Å; F81-F278 HydrophobicContact CB-CE1 3.81Å; F81-F278 HydrophobicContact CB-CZ 4.3Å; F81-F278 HydrophobicContact CD2-CE1 4.04Å; F81-F278 AromaticContact CD2-CZ 3.77Å; F81-F278 HydrophobicContact CD2-CZ 3.77Å; F81-F278 HydrophobicContact CG-CE1 4.39Å; F81-F278 HydrophobicContact CG-CZ 4.42Å
82	V	95.3	Very high	93.1	Very high	52 Å²	52	38.3 Å²	38.3	32%	0.315	20%	0.201	S	C	.	.	H	α-helix	trans	-63	-39.3	179.9	174.2	0	0	0	0	111.3	V78 M79 V85 T86 L210	V78-V82 HydrophobicContact CG1-CG2 4.46Å; V78-V82 WeakPolarHBondContact O-CG2 3.23Å; V78-V82 PolarHBondContact O-N 3.5Å; M79-V82 PolarHBondContact O-N 3.22Å; V82-V85 PolarHBondContact O-N 3.04Å; V82-T86 HydrophobicContact CG1-CG2 4.29Å; V82-T86 WeakPolarHBondContact O-CB 3.45Å; V82-T86 VanDerWaalsContact O-CG2 3.31Å; V82-T86 WeakPolarHBondContact O-CG2 3.35Å; V82-T86 PolarHBondContact O-N 2.78Å; V82-T86 PolarHBondContact O-OG1 2.8Å; V82-L210 HydrophobicContact CG1-CD1 4.33Å
83	I	95.6	Very high	93.6	Very high	1 Å²	1	40.1 Å²	40.1	1%	0.005	21%	0.21	C	C	.	.	H	α-helix	trans	-58.5	-51	173.3	-68.3	161.4	0	0	0	109.9	M79 V80 F81 V85 T86 V87 V206 L210 P211 F237	M79-I83 VanDerWaalsContact O-CG1 3.25Å; M79-I83 WeakPolarHBondContact O-CG1 3.5Å; M79-I83 PolarHBondContact O-N 3.26Å; V80-I83 PolarHBondContact O-N 3.4Å; F81-I83 VanDerWaalsContact C-N 3.33Å; F81-I83 PolarHBondContact O-N 2.87Å; I83-V85 PolarHBondContact O-N 3.18Å; I83-T86 WeakPolarHBondContact CA-OG1 3.42Å; I83-T86 PolarHBondContact O-N 2.65Å; I83-T86 PolarHBondContact O-OG1 3.2Å; I83-V87 HydrophobicContact CG2-CG2 4.26Å; I83-V87 WeakPolarHBondContact O-CB 3.28Å; I83-V87 VanDerWaalsContact O-CG2 3.24Å; I83-V87 WeakPolarHBondContact O-CG2 3.45Å; I83-V87 PolarHBondContact O-N 3.12Å; I83-V206 HydrophobicContact CG2-CG1 4.47Å; I83-L210 HydrophobicContact CB-CD1 4.45Å; I83-L210 HydrophobicContact CG1-CB 4.29Å; I83-L210 HydrophobicContact CG1-CD1 3.87Å; I83-P211 HydrophobicContact CD1-CG 4.03Å; I83-F237 HydrophobicContact CD1-CB 4.05Å; I83-F237 HydrophobicContact CD1-CD1 3.67Å; I83-F237 HydrophobicContact CD1-CE1 4.48Å; I83-F237 HydrophobicContact CD1-CG 4.16Å
84	G	96.8	Very high	93.9	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-61.4	-44.1	-179.7	0	0	0	0	0	113.3	V80 F81 T86 V87 G88 C279 S282 A283	V80-G84 PolarHBondContact O-N 2.95Å; F81-G84 PolarHBondContact O-N 3Å; G84-T86 PolarHBondContact O-N 3.19Å; G84-V87 PolarHBondContact O-N 2.95Å; G84-G88 PolarHBondContact O-N 3.38Å; G84-C279 WeakPolarHBondContact CA-O 3.35Å; G84-S282 WeakPolarHBondContact CA-OG 3.33Å; G84-A283 WeakPolarHBondContact O-CA 3.13Å; G84-A283 VanDerWaalsContact O-CB 3.31Å; G84-A283 WeakPolarHBondContact O-CB 3.18Å
85	V	96.9	Very high	93.9	Very high	36 Å²	36	35.2 Å²	35.2	22%	0.218	18%	0.179	C	C	.	.	H	α-helix	trans	-60	-47.7	176.7	173.2	0	0	0	0	111.6	F81 V82 I83 V87 G88 L89 T286	F81-V85 HydrophobicContact CD1-CG2 4.36Å; F81-V85 HydrophobicContact CD2-CG2 4.48Å; F81-V85 HydrophobicContact CE1-CG2 3.95Å; F81-V85 HydrophobicContact CE2-CG2 4.07Å; F81-V85 HydrophobicContact CZ-CG2 3.79Å; F81-V85 WeakPolarHBondContact O-CG2 3.22Å; F81-V85 PolarHBondContact O-N 3.43Å; V82-V85 PolarHBondContact O-N 3.04Å; I83-V85 PolarHBondContact O-N 3.18Å; V85-V87 PolarHBondContact O-N 2.91Å; V85-G88 PolarHBondContact O-N 2.96Å; V85-L89 HydrophobicContact CG1-CD1 4.29Å; V85-L89 WeakPolarHBondContact O-CG 3.41Å; V85-L89 PolarHBondContact O-N 2.94Å; V85-T286 HydrophobicContact CG1-CG2 4.08Å
86	T	95.8	Very high	94	Very high	38 Å²	38	37.9 Å²	37.9	23%	0.233	19%	0.188	C	C	.	.	H	α-helix	trans	-65.1	-38.9	179.8	51.2	0	0	0	0	112.3	V82 I83 G84 L89 V90 V206 L210	V82-T86 HydrophobicContact CG1-CG2 4.29Å; V82-T86 WeakPolarHBondContact O-CB 3.45Å; V82-T86 VanDerWaalsContact O-CG2 3.31Å; V82-T86 WeakPolarHBondContact O-CG2 3.35Å; V82-T86 PolarHBondContact O-N 2.78Å; V82-T86 PolarHBondContact O-OG1 2.8Å; I83-T86 WeakPolarHBondContact CA-OG1 3.42Å; I83-T86 PolarHBondContact O-N 2.65Å; I83-T86 PolarHBondContact O-OG1 3.2Å; G84-T86 PolarHBondContact O-N 3.19Å; T86-L89 PolarHBondContact O-N 2.98Å; T86-V90 WeakPolarHBondContact O-CG2 3.4Å; T86-V90 PolarHBondContact O-N 3.12Å; T86-V206 VanDerWaalsContact OG1-CG1 3.25Å; T86-V206 WeakPolarHBondContact OG1-CG1 3.43Å; T86-L210 HydrophobicContact CG2-CD1 4.08Å; T86-L210 VanDerWaalsContact OG1-CD1 3.25Å; T86-L210 WeakPolarHBondContact OG1-CD1 3.37Å
87	V	96.4	Very high	94.2	Very high	1 Å²	1	39.1 Å²	39.1	1%	0.006	20%	0.195	C	C	.	.	H	α-helix	trans	-63.3	-44.4	173.9	174.8	0	0	0	0	110.9	I83 G84 V85 L89 V90 G91 M199 V206 A244	I83-V87 HydrophobicContact CG2-CG2 4.26Å; I83-V87 WeakPolarHBondContact O-CB 3.28Å; I83-V87 VanDerWaalsContact O-CG2 3.24Å; I83-V87 WeakPolarHBondContact O-CG2 3.45Å; I83-V87 PolarHBondContact O-N 3.12Å; G84-V87 PolarHBondContact O-N 2.95Å; V85-V87 PolarHBondContact O-N 2.91Å; V87-L89 VanDerWaalsContact C-N 3.31Å; V87-L89 PolarHBondContact O-N 2.88Å; V87-V90 PolarHBondContact O-N 3.07Å; V87-G91 PolarHBondContact O-N 2.9Å; V87-M199 HydrophobicContact CG1-CE 3.5Å; V87-M199 WeakPolarHBondContact O-CE 3.29Å; V87-V206 HydrophobicContact CG2-CB 4Å; V87-V206 HydrophobicContact CG2-CG1 3.85Å; V87-A244 HydrophobicContact CB-CB 4.3Å; V87-A244 HydrophobicContact CG1-CB 4.07Å
88	G	95.6	Very high	94.1	Very high	1 Å²	1	35.4 Å²	35.4	1%	0.01	18%	0.181	C	C	.	.	H	α-helix	trans	-57.3	-42.1	174.4	0	0	0	0	0	113.1	G84 V85 G91 L92	G84-G88 PolarHBondContact O-N 3.38Å; V85-G88 PolarHBondContact O-N 2.96Å; G88-G91 PolarHBondContact O-N 3.02Å; G88-L92 PolarHBondContact O-N 3.48Å
89	L	95.1	Very high	93.9	Very high	71 Å²	71	37 Å²	37	37%	0.372	18%	0.183	S	C	.	.	H	α-helix	trans	-66.1	-38.4	176	-69.6	174.1	0	0	0	113.1	V85 T86 V87 L92 F93 T286 F290	V85-L89 HydrophobicContact CG1-CD1 4.29Å; V85-L89 WeakPolarHBondContact O-CG 3.41Å; V85-L89 PolarHBondContact O-N 2.94Å; T86-L89 PolarHBondContact O-N 2.98Å; V87-L89 VanDerWaalsContact C-N 3.31Å; V87-L89 PolarHBondContact O-N 2.88Å; L89-L92 PolarHBondContact O-N 2.94Å; L89-F93 WeakPolarHBondContact O-CB 3.42Å; L89-F93 PolarHBondContact O-N 3.44Å; L89-T286 HydrophobicContact CD2-CG2 4.28Å; L89-T286 HydrophobicContact CG-CG2 4.17Å; L89-F290 HydrophobicContact CD2-CD2 3.77Å; L89-F290 HydrophobicContact CD2-CE2 3.61Å; L89-F290 HydrophobicContact CD2-CG 4.47Å; L89-F290 HydrophobicContact CD2-CZ 4.16Å
90	V	95.2	Very high	93.9	Very high	25 Å²	25	39.5 Å²	39.5	15%	0.152	20%	0.196	C	C	.	.	H	α-helix	trans	-64.4	-42.3	174.5	171.8	0	0	0	0	110.7	T86 V87 L92 F93 V94 F176 M199	T86-V90 WeakPolarHBondContact O-CG2 3.4Å; T86-V90 PolarHBondContact O-N 3.12Å; V87-V90 PolarHBondContact O-N 3.07Å; V90-L92 VanDerWaalsContact C-N 3.33Å; V90-L92 PolarHBondContact O-N 3.42Å; V90-F93 PolarHBondContact O-N 2.79Å; V90-V94 WeakPolarHBondContact O-CG2 3.48Å; V90-V94 PolarHBondContact O-N 3.16Å; V90-F176 HydrophobicContact CG1-CE2 4.08Å; V90-F176 HydrophobicContact CG1-CZ 4.24Å; V90-F176 HydrophobicContact CG2-CE2 4.08Å; V90-F176 HydrophobicContact CG2-CZ 3.75Å; V90-M199 HydrophobicContact CB-CE 4.49Å; V90-M199 HydrophobicContact CG1-SD 4.33Å
91	G	93.4	Very high	93.8	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-58.8	-45.7	174.8	0	0	0	0	0	111.7	V87 G88 F93 V94 D95	V87-G91 PolarHBondContact O-N 2.9Å; G88-G91 PolarHBondContact O-N 3.02Å; G91-F93 PolarHBondContact O-N 3.44Å; G91-V94 PolarHBondContact O-N 3.33Å; G91-D95 PolarHBondContact O-N 2.93Å
92	L	93	Very high	93.5	Very high	30 Å²	30	37.6 Å²	37.6	16%	0.157	19%	0.189	C	C	.	.	H	α-helix	trans	-61.5	-43.7	176.7	-176.9	131.6	0	0	0	112.9	G88 L89 V90 V94 D95 F96 L287 F290 I294	G88-L92 PolarHBondContact O-N 3.48Å; L89-L92 PolarHBondContact O-N 2.94Å; V90-L92 VanDerWaalsContact C-N 3.33Å; V90-L92 PolarHBondContact O-N 3.42Å; L92-V94 VanDerWaalsContact C-N 3.33Å; L92-V94 PolarHBondContact O-N 3.2Å; L92-D95 PolarHBondContact O-N 3.09Å; L92-F96 VanDerWaalsContact O-CB 3.31Å; L92-F96 WeakPolarHBondContact O-CB 2.86Å; L92-F96 PolarHBondContact O-N 3.3Å; L92-L287 HydrophobicContact CB-CD1 3.84Å; L92-F290 HydrophobicContact CD1-CB 3.23Å; L92-F290 HydrophobicContact CD1-CG 4.35Å; L92-I294 HydrophobicContact CD1-CD1 4.07Å; L92-I294 HydrophobicContact CD2-CD1 3.97Å; L92-I294 HydrophobicContact CG-CD1 4.35Å
93	F	94.2	Very high	93.2	Very high	97 Å²	97	41.8 Å²	41.8	43%	0.425	20%	0.203	S	C	.	.	H	α-helix	trans	-58.3	-47.7	175.6	174.9	-91.1	0	0	0	110.8	L89 V90 G91 D95 F97 L184	L89-F93 WeakPolarHBondContact O-CB 3.42Å; L89-F93 PolarHBondContact O-N 3.44Å; V90-F93 PolarHBondContact O-N 2.79Å; G91-F93 PolarHBondContact O-N 3.44Å; F93-D95 PolarHBondContact O-N 3.48Å; F93-F97 HydrophobicContact CD1-CD2 4.34Å; F93-F97 AromaticContact CD2-CD2 3.67Å; F93-F97 HydrophobicContact CD2-CD2 3.67Å; F93-F97 AromaticContact CD2-CE2 3.46Å; F93-F97 HydrophobicContact CD2-CE2 3.46Å; F93-F97 VanDerWaalsContact CD2-CE2 3.46Å; F93-F97 HydrophobicContact CE1-CD2 4.17Å; F93-F97 AromaticContact CE2-CD2 3.48Å; F93-F97 HydrophobicContact CE2-CD2 3.48Å; F93-F97 VanDerWaalsContact CE2-CD2 3.48Å; F93-F97 AromaticContact CE2-CE2 3.12Å; F93-F97 HydrophobicContact CE2-CE2 3.12Å; F93-F97 HydrophobicContact CE2-CZ 4.07Å; F93-F97 HydrophobicContact CG-CD2 4.1Å; F93-F97 HydrophobicContact CG-CE2 4.34Å; F93-F97 AromaticContact CZ-CD2 3.74Å; F93-F97 HydrophobicContact CZ-CD2 3.74Å; F93-F97 AromaticContact CZ-CE2 3.77Å; F93-F97 HydrophobicContact CZ-CE2 3.77Å; F93-F97 VanDerWaalsContact O-CD2 3.32Å; F93-F97 WeakPolarHBondContact O-CD2 3.34Å; F93-F97 PolarHBondContact O-N 3.3Å; F93-L184 HydrophobicContact CE1-CD1 4.06Å
94	V	93.4	Very high	92.9	Very high	6 Å²	6	45.8 Å²	45.8	4%	0.036	22%	0.224	C	C	.	.	H	α-helix	trans	-62.3	-44.6	178.7	171.8	0	0	0	0	111.4	V90 G91 L92 V98 V183 L184 K195	V90-V94 WeakPolarHBondContact O-CG2 3.48Å; V90-V94 PolarHBondContact O-N 3.16Å; G91-V94 PolarHBondContact O-N 3.33Å; L92-V94 VanDerWaalsContact C-N 3.33Å; L92-V94 PolarHBondContact O-N 3.2Å; V94-V98 HydrophobicContact CG1-CG2 4.34Å; V94-V98 WeakPolarHBondContact O-CB 3.13Å; V94-V98 WeakPolarHBondContact O-CG2 3.22Å; V94-V98 PolarHBondContact O-N 3.32Å; V94-V98 VanDerWaalsContact O-N 3.07Å; V94-V183 HydrophobicContact CG1-CG1 4.03Å; V94-V183 HydrophobicContact CG2-CG1 4.35Å; V94-L184 HydrophobicContact CB-CD2 4.07Å; V94-L184 HydrophobicContact CG1-CD2 3.94Å; V94-L184 HydrophobicContact CG2-CD2 4.06Å; V94-K195 HydrophobicContact CG1-CB 4.17Å; V94-K195 HydrophobicContact CG1-CD 4.19Å
95	D	89.4	Confident	92.6	Very high	20 Å²	20	46 Å²	46	11%	0.107	23%	0.225	C	C	.	.	H	α-helix	trans	-60.7	-51.3	179.1	-161	46.8	0	0	0	112.4	G91 L92 F93 F97 V98 H99 K195 R291 L307	G91-D95 PolarHBondContact O-N 2.93Å; L92-D95 PolarHBondContact O-N 3.09Å; F93-D95 PolarHBondContact O-N 3.48Å; D95-F97 PolarHBondContact O-N 2.81Å; D95-V98 PolarHBondContact O-N 3.3Å; D95-H99 WeakPolarHBondContact O-CB 3.26Å; D95-H99 PolarHBondContact O-N 3.22Å; D95-K195 IonicContact OD1-NZ 3.88Å; D95-K195 PolarHBondContact OD1-NZ 3.29Å; D95-R291 IonicContact OD2-CZ 2.71Å; D95-R291 IonicContact OD2-NE 3.92Å; D95-R291 PolarHBondContact OD2-NE 3.07Å; D95-R291 IonicContact OD2-NH2 2.93Å; D95-R291 PolarHBondContact OD2-NH2 2.92Å; D95-L307 HydrophobicContact CB-CD2 3.44Å; D95-L307 VanDerWaalsContact CB-CD2 3.44Å
96	F	91.4	Very high	92	Very high	93 Å²	93	45.6 Å²	45.6	41%	0.408	22%	0.22	S	C	.	.	H	α-helix	trans	-60	-48.7	-175.4	178.4	-95.9	0	0	0	111.7	L92 H99 L100 I294	L92-F96 VanDerWaalsContact O-CB 3.31Å; L92-F96 WeakPolarHBondContact O-CB 2.86Å; L92-F96 PolarHBondContact O-N 3.3Å; F96-H99 PolarHBondContact O-N 3.47Å; F96-L100 HydrophobicContact CE1-CD2 4.44Å; F96-L100 WeakPolarHBondContact O-CB 3.4Å; F96-L100 PolarHBondContact O-N 3.18Å; F96-I294 HydrophobicContact CD2-CG2 4.37Å; F96-I294 HydrophobicContact CE2-CG2 4.35Å
97	F	93.4	Very high	91.6	Very high	64 Å²	64	47.6 Å²	47.6	28%	0.281	24%	0.235	S	C	.	.	H	α-helix	trans	-71.5	-36.8	-178.9	-80.6	-76.1	0	0	0	112.8	F93 D95 H99 L100 F101 L184	F93-F97 HydrophobicContact CD1-CD2 4.34Å; F93-F97 AromaticContact CD2-CD2 3.67Å; F93-F97 HydrophobicContact CD2-CD2 3.67Å; F93-F97 AromaticContact CD2-CE2 3.46Å; F93-F97 HydrophobicContact CD2-CE2 3.46Å; F93-F97 VanDerWaalsContact CD2-CE2 3.46Å; F93-F97 HydrophobicContact CE1-CD2 4.17Å; F93-F97 AromaticContact CE2-CD2 3.48Å; F93-F97 HydrophobicContact CE2-CD2 3.48Å; F93-F97 VanDerWaalsContact CE2-CD2 3.48Å; F93-F97 AromaticContact CE2-CE2 3.12Å; F93-F97 HydrophobicContact CE2-CE2 3.12Å; F93-F97 HydrophobicContact CE2-CZ 4.07Å; F93-F97 HydrophobicContact CG-CD2 4.1Å; F93-F97 HydrophobicContact CG-CE2 4.34Å; F93-F97 AromaticContact CZ-CD2 3.74Å; F93-F97 HydrophobicContact CZ-CD2 3.74Å; F93-F97 AromaticContact CZ-CE2 3.77Å; F93-F97 HydrophobicContact CZ-CE2 3.77Å; F93-F97 VanDerWaalsContact O-CD2 3.32Å; F93-F97 WeakPolarHBondContact O-CD2 3.34Å; F93-F97 PolarHBondContact O-N 3.3Å; D95-F97 PolarHBondContact O-N 2.81Å; F97-H99 VanDerWaalsContact C-N 3.35Å; F97-L100 HydrophobicContact CD1-CD2 4.41Å; F97-L100 PolarHBondContact O-N 2.91Å; F97-F101 HydrophobicContact CB-CE2 4.38Å; F97-F101 HydrophobicContact CD1-CZ 4.2Å; F97-F101 VanDerWaalsContact O-CD2 3.29Å; F97-F101 WeakPolarHBondContact O-CD2 3.33Å; F97-F101 WeakPolarHBondContact O-CG 3.47Å; F97-F101 PolarHBondContact O-N 3.37Å; F97-L184 HydrophobicContact CB-CD1 4.09Å; F97-L184 HydrophobicContact CB-CD2 4.2Å
98	V	91.7	Very high	91.2	Very high	9 Å²	9	50.5 Å²	50.5	6%	0.055	25%	0.253	C	S	.	.	H	α-helix	trans	-61.7	-45.5	173.2	168.8	0	0	0	0	110.5	V94 D95 T102 L184 V187	V94-V98 HydrophobicContact CG1-CG2 4.34Å; V94-V98 WeakPolarHBondContact O-CB 3.13Å; V94-V98 WeakPolarHBondContact O-CG2 3.22Å; V94-V98 PolarHBondContact O-N 3.32Å; V94-V98 VanDerWaalsContact O-N 3.07Å; D95-V98 PolarHBondContact O-N 3.3Å; V98-T102 WeakPolarHBondContact O-CB 3.28Å; V98-T102 PolarHBondContact O-N 3.12Å; V98-T102 PolarHBondContact O-OG1 3.4Å; V98-L184 HydrophobicContact CG2-CB 4.41Å; V98-L184 HydrophobicContact CG2-CD2 3.98Å; V98-V187 HydrophobicContact CG1-CB 4.26Å; V98-V187 HydrophobicContact CG1-CG1 3.67Å; V98-V187 HydrophobicContact CG2-CB 4.45Å
99	H	88	Confident	90.8	Very high	117 Å²	117	50.5 Å²	50.5	54%	0.542	25%	0.253	S	S	.	.	H	α-helix	trans	-63.8	-43.7	178.5	-169.7	77.5	0	0	0	111.6	D95 F96 F97 T102 K103	D95-H99 WeakPolarHBondContact O-CB 3.26Å; D95-H99 PolarHBondContact O-N 3.22Å; F96-H99 PolarHBondContact O-N 3.47Å; F97-H99 VanDerWaalsContact C-N 3.35Å; H99-T102 PolarHBondContact O-N 3.34Å; H99-K103 WeakPolarHBondContact O-CB 3.46Å; H99-K103 PolarHBondContact O-N 2.59Å
100	L	91.2	Very high	90.2	Very high	68 Å²	68	48.1 Å²	48.1	36%	0.356	24%	0.243	S	C	.	.	H	α-helix	trans	-58.6	-52.2	176.8	-180	62.5	0	0	0	112	F96 F97 T102 K103 I104	F96-L100 HydrophobicContact CE1-CD2 4.44Å; F96-L100 WeakPolarHBondContact O-CB 3.4Å; F96-L100 PolarHBondContact O-N 3.18Å; F97-L100 HydrophobicContact CD1-CD2 4.41Å; F97-L100 PolarHBondContact O-N 2.91Å; L100-T102 VanDerWaalsContact C-N 3.34Å; L100-T102 PolarHBondContact O-N 3.39Å; L100-K103 PolarHBondContact O-N 2.95Å; L100-I104 HydrophobicContact CD1-CD1 3.99Å; L100-I104 HydrophobicContact CD1-CG1 4.48Å; L100-I104 HydrophobicContact CG-CD1 4.05Å; L100-I104 VanDerWaalsContact O-CG1 3.29Å; L100-I104 WeakPolarHBondContact O-CG1 3.33Å; L100-I104 PolarHBondContact O-N 3.29Å
101	F	93.1	Very high	89.7	Confident	46 Å²	46	50.7 Å²	50.7	20%	0.202	26%	0.256	C	S	.	.	H	α-helix	trans	-65.4	-38.5	-179.8	-64.9	-32.1	0	0	0	112.5	F97 K105 F136 L184 F185 A188	F97-F101 HydrophobicContact CB-CE2 4.38Å; F97-F101 HydrophobicContact CD1-CZ 4.2Å; F97-F101 VanDerWaalsContact O-CD2 3.29Å; F97-F101 WeakPolarHBondContact O-CD2 3.33Å; F97-F101 WeakPolarHBondContact O-CG 3.47Å; F97-F101 PolarHBondContact O-N 3.37Å; F101-K105 WeakPolarHBondContact O-CB 3.09Å; F101-K105 PolarHBondContact O-N 3.45Å; F101-F136 HydrophobicContact CB-CZ 4.37Å; F101-L184 HydrophobicContact CE2-CB 4.42Å; F101-F185 HydrophobicContact CD2-CE1 4.4Å; F101-F185 HydrophobicContact CE2-CD1 4.34Å; F101-F185 AromaticContact CE2-CE1 3.81Å; F101-F185 HydrophobicContact CE2-CE1 3.81Å; F101-F185 HydrophobicContact CE2-CZ 4.27Å; F101-F185 HydrophobicContact CZ-CE1 4.19Å; F101-A188 HydrophobicContact CB-CB 3.76Å; F101-A188 HydrophobicContact CD2-CB 4.44Å
102	T	88.6	Confident	89.3	Confident	14 Å²	14	51.1 Å²	51.1	9%	0.086	26%	0.259	C	S	.	.	H	α-helix	trans	-67.5	-41.2	178.3	-58.6	0	0	0	0	111.4	V98 H99 L100 K105 F106 P444	V98-T102 WeakPolarHBondContact O-CB 3.28Å; V98-T102 PolarHBondContact O-N 3.12Å; V98-T102 PolarHBondContact O-OG1 3.4Å; H99-T102 PolarHBondContact O-N 3.34Å; L100-T102 VanDerWaalsContact C-N 3.34Å; L100-T102 PolarHBondContact O-N 3.39Å; T102-K105 PolarHBondContact O-N 3.36Å; T102-F106 HydrophobicContact CG2-CD2 3.43Å; T102-F106 VanDerWaalsContact CG2-CD2 3.43Å; T102-F106 HydrophobicContact CG2-CE2 3.41Å; T102-F106 VanDerWaalsContact CG2-CE2 3.41Å; T102-F106 VanDerWaalsContact O-CD2 3.3Å; T102-F106 WeakPolarHBondContact O-CD2 3.47Å; T102-F106 PolarHBondContact O-N 3.5Å; T102-P444 HydrophobicContact CG2-CG 4.17Å
103	K	88.1	Confident	88.9	Confident	140 Å²	140	49.8 Å²	49.8	61%	0.609	25%	0.252	S	S	*	.	H	α-helix	trans	-63.9	-45.3	176.1	-174.2	175.9	-177.3	175.4	0	111.7	H99 L100 S107	H99-K103 WeakPolarHBondContact O-CB 3.46Å; H99-K103 PolarHBondContact O-N 2.59Å; L100-K103 PolarHBondContact O-N 2.95Å; K103-S107 WeakPolarHBondContact O-CB 3.28Å; K103-S107 PolarHBondContact O-N 3.1Å
104	I	90	Very high	88.3	Confident	86 Å²	86	51.7 Å²	51.7	44%	0.441	26%	0.263	S	S	.	.	H	α-helix	trans	-59.2	-51	175.8	-68.8	165.9	0	0	0	110.1	L100 S107 V108	L100-I104 HydrophobicContact CD1-CD1 3.99Å; L100-I104 HydrophobicContact CD1-CG1 4.48Å; L100-I104 HydrophobicContact CG-CD1 4.05Å; L100-I104 VanDerWaalsContact O-CG1 3.29Å; L100-I104 WeakPolarHBondContact O-CG1 3.33Å; L100-I104 PolarHBondContact O-N 3.29Å; I104-S107 PolarHBondContact O-N 3.2Å; I104-V108 WeakPolarHBondContact O-CG2 3.26Å; I104-V108 PolarHBondContact O-N 2.89Å; I104-V108 VanDerWaalsContact O-N 3.17Å
105	K	90.3	Very high	87.8	Confident	5 Å²	5	56.5 Å²	56.5	2%	0.022	28%	0.283	C	S	.	.	H	α-helix	trans	-56.6	-55.4	179.9	-176.4	-176.3	75.2	176.8	0	111.9	F101 T102 S107 V108 V109 F132 N133 F136 A188	F101-K105 WeakPolarHBondContact O-CB 3.09Å; F101-K105 PolarHBondContact O-N 3.45Å; T102-K105 PolarHBondContact O-N 3.36Å; K105-S107 VanDerWaalsContact C-N 3.35Å; K105-S107 PolarHBondContact O-N 3.2Å; K105-V108 PolarHBondContact O-N 3.23Å; K105-V109 WeakPolarHBondContact O-CB 3.28Å; K105-V109 VanDerWaalsContact O-CG2 3.28Å; K105-V109 WeakPolarHBondContact O-CG2 3.23Å; K105-V109 PolarHBondContact O-N 2.76Å; K105-F132 HydrophobicContact CD-CB 4.11Å; K105-F132 HydrophobicContact CG-CB 3.98Å; K105-F132 HydrophobicContact CG-CD2 4.41Å; K105-F132 HydrophobicContact CG-CG 4.14Å; K105-N133 WeakPolarHBondContact CD-OD1 3.5Å; K105-N133 PolarHBondContact NZ-OD1 3.08Å; K105-F136 HydrophobicContact CD-CE2 4.49Å; K105-A188 PolarHBondContact NZ-O 3.08Å
106	F	85.8	Confident	87.4	Confident	27 Å²	27	55.8 Å²	55.8	12%	0.118	28%	0.279	C	S	.	.	H	α-helix	trans	-71.9	-27.2	-176	-73.1	-57.4	0	0	0	113.2	T102 A110 F442	T102-F106 HydrophobicContact CG2-CD2 3.43Å; T102-F106 VanDerWaalsContact CG2-CD2 3.43Å; T102-F106 HydrophobicContact CG2-CE2 3.41Å; T102-F106 VanDerWaalsContact CG2-CE2 3.41Å; T102-F106 VanDerWaalsContact O-CD2 3.3Å; T102-F106 WeakPolarHBondContact O-CD2 3.47Å; T102-F106 PolarHBondContact O-N 3.5Å; F106-A110 WeakPolarHBondContact O-CB 3.39Å; F106-A110 PolarHBondContact O-N 2.8Å; F106-F442 HydrophobicContact CE1-CB 4.36Å; F106-F442 HydrophobicContact CE1-CD1 4.08Å; F106-F442 WeakPolarHBondContact CE1-O 3.25Å; F106-F442 WeakPolarHBondContact CZ-O 3.3Å
107	S	86.8	Confident	86.8	Confident	80 Å²	80	54.2 Å²	54.2	56%	0.559	28%	0.278	S	S	*	.	H	α-helix	trans	-65.4	-42.6	173.5	-172.8	0	0	0	0	111.9	K103 I104 K105 D111	K103-S107 WeakPolarHBondContact O-CB 3.28Å; K103-S107 PolarHBondContact O-N 3.1Å; I104-S107 PolarHBondContact O-N 3.2Å; K105-S107 VanDerWaalsContact C-N 3.35Å; K105-S107 PolarHBondContact O-N 3.2Å; S107-D111 PolarHBondContact O-N 3.47Å
108	V	88.3	Confident	85.9	Confident	62 Å²	62	58 Å²	58	38%	0.376	30%	0.301	S	S	.	.	H	α-helix	trans	-69	-46	177.6	174.7	0	0	0	0	110.5	I104 K105 A110 D111 S112 F132	I104-V108 WeakPolarHBondContact O-CG2 3.26Å; I104-V108 PolarHBondContact O-N 2.89Å; I104-V108 VanDerWaalsContact O-N 3.17Å; K105-V108 PolarHBondContact O-N 3.23Å; V108-A110 VanDerWaalsContact C-N 3.35Å; V108-A110 PolarHBondContact O-N 2.85Å; V108-D111 PolarHBondContact O-N 2.87Å; V108-S112 WeakPolarHBondContact O-CB 3.49Å; V108-S112 PolarHBondContact O-N 3.42Å; V108-S112 VanDerWaalsContact O-N 3.08Å; V108-F132 HydrophobicContact CB-CE2 4.29Å; V108-F132 HydrophobicContact CB-CZ 4.48Å; V108-F132 HydrophobicContact CG1-CE2 3.93Å; V108-F132 HydrophobicContact CG1-CZ 4.28Å
109	V	86.1	Confident	85.3	Confident	1 Å²	1	67.4 Å²	67.4	1%	0.006	34%	0.335	C	S	.	.	H	α-helix	trans	-65.4	-37.7	-179.8	172.6	0	0	0	0	111.6	K105 S112 I113 L129	K105-V109 WeakPolarHBondContact O-CB 3.28Å; K105-V109 VanDerWaalsContact O-CG2 3.28Å; K105-V109 WeakPolarHBondContact O-CG2 3.23Å; K105-V109 PolarHBondContact O-N 2.76Å; V109-S112 PolarHBondContact O-N 3.12Å; V109-I113 HydrophobicContact CG1-CD1 3.63Å; V109-I113 HydrophobicContact CG1-CG1 4.23Å; V109-I113 WeakPolarHBondContact O-CB 3.42Å; V109-I113 VanDerWaalsContact O-CG1 3.23Å; V109-I113 WeakPolarHBondContact O-CG1 3.44Å; V109-I113 PolarHBondContact O-N 3.16Å; V109-L129 HydrophobicContact CG1-CD1 4.45Å; V109-L129 HydrophobicContact CG2-CB 4.18Å; V109-L129 HydrophobicContact CG2-CD1 4.05Å
110	A	83.1	Confident	84.8	Confident	21 Å²	21	65 Å²	65	17%	0.174	34%	0.342	C	S	.	.	H	α-helix	trans	-64	-46.9	177.6	0	0	0	0	0	112.3	F106 V108 S112 I113 E114 F427	F106-A110 WeakPolarHBondContact O-CB 3.39Å; F106-A110 PolarHBondContact O-N 2.8Å; V108-A110 VanDerWaalsContact C-N 3.35Å; V108-A110 PolarHBondContact O-N 2.85Å; A110-S112 VanDerWaalsContact C-N 3.29Å; A110-S112 PolarHBondContact O-N 3.42Å; A110-I113 PolarHBondContact O-N 3.2Å; A110-E114 PolarHBondContact O-N 2.96Å; A110-F427 HydrophobicContact CB-CE1 4Å; A110-F427 HydrophobicContact CB-CZ 3.94Å
111	D	84.8	Confident	84.5	Confident	78 Å²	78	63.7 Å²	63.7	42%	0.417	34%	0.338	S	S	.	.	H	α-helix	trans	-62.6	-37.2	177.7	-177.7	43.1	0	0	0	111.7	S107 V108 K115	S107-D111 PolarHBondContact O-N 3.47Å; V108-D111 PolarHBondContact O-N 2.87Å; D111-K115 WeakPolarHBondContact O-CG 3.33Å; D111-K115 PolarHBondContact O-N 3.09Å; D111-K115 WeakPolarHBondContact OD1-CE 3.48Å; D111-K115 IonicContact OD1-NZ 2.91Å; D111-K115 PolarHBondContact OD1-NZ 2.82Å; D111-K115 IonicContact OD2-NZ 2.69Å; D111-K115 PolarHBondContact OD2-NZ 3.02Å
112	S	85.1	Confident	84	Confident	10 Å²	10	64.2 Å²	64.2	7%	0.07	34%	0.343	C	S	.	.	H	α-helix	trans	-65.4	-47.1	173.6	-176.6	0	0	0	0	112.6	V108 V109 A110 E114 K115 C116 S125 E128	V108-S112 WeakPolarHBondContact O-CB 3.49Å; V108-S112 PolarHBondContact O-N 3.42Å; V108-S112 VanDerWaalsContact O-N 3.08Å; V109-S112 PolarHBondContact O-N 3.12Å; A110-S112 VanDerWaalsContact C-N 3.29Å; A110-S112 PolarHBondContact O-N 3.42Å; S112-E114 PolarHBondContact O-N 2.96Å; S112-K115 PolarHBondContact O-N 2.72Å; S112-C116 VanDerWaalsContact O-CB 3.25Å; S112-C116 WeakPolarHBondContact O-CB 3.11Å; S112-C116 PolarHBondContact O-N 3.16Å; S112-S125 PolarHBondContact O-OG 3.02Å; S112-S125 PolarHBondContact OG-OG 2.99Å; S112-E128 WeakPolarHBondContact CB-OE2 3.37Å; S112-E128 PolarHBondContact OG-OE2 2.96Å
113	I	83.8	Confident	83.8	Confident	1 Å²	1	68.1 Å²	68.1	1%	0.005	37%	0.37	C	S	.	.	H	α-helix	trans	-62.2	-42.8	179.5	-71.3	168.7	0	0	0	110.8	V109 A110 C116 T117 F427 F428	V109-I113 HydrophobicContact CG1-CD1 3.63Å; V109-I113 HydrophobicContact CG1-CG1 4.23Å; V109-I113 WeakPolarHBondContact O-CB 3.42Å; V109-I113 VanDerWaalsContact O-CG1 3.23Å; V109-I113 WeakPolarHBondContact O-CG1 3.44Å; V109-I113 PolarHBondContact O-N 3.16Å; A110-I113 PolarHBondContact O-N 3.2Å; I113-C116 PolarHBondContact O-N 3.19Å; I113-T117 WeakPolarHBondContact O-CB 2.95Å; I113-T117 PolarHBondContact O-N 3.4Å; I113-T117 PolarHBondContact O-OG1 2.85Å; I113-F427 HydrophobicContact CB-CD1 4.45Å; I113-F427 HydrophobicContact CD1-CD1 4.45Å; I113-F427 HydrophobicContact CD1-CD2 4.06Å; I113-F427 HydrophobicContact CD1-CE1 4.4Å; I113-F427 HydrophobicContact CD1-CE2 4.01Å; I113-F427 HydrophobicContact CD1-CG 4.29Å; I113-F427 HydrophobicContact CD1-CZ 4.19Å; I113-F427 HydrophobicContact CG2-CB 4.22Å; I113-F427 HydrophobicContact CG2-CD1 3.85Å; I113-F427 HydrophobicContact CG2-CE1 4.43Å; I113-F427 HydrophobicContact CG2-CG 4.1Å; I113-F428 HydrophobicContact CD1-CZ 4.33Å; I113-F428 HydrophobicContact CG2-CD1 4.45Å; I113-F428 HydrophobicContact CG2-CE1 3.88Å; I113-F428 HydrophobicContact CG2-CZ 4.2Å
114	E	81.8	Confident	83.8	Confident	138 Å²	138	65.5 Å²	65.5	65%	0.645	36%	0.363	S	S	*	.	H	α-helix	trans	-62.6	-52.4	179.6	-169.9	173.7	177.9	0	0	111	A110 S112 C116 T117	A110-E114 PolarHBondContact O-N 2.96Å; S112-E114 PolarHBondContact O-N 2.96Å; E114-C116 VanDerWaalsContact C-N 3.29Å; E114-C116 PolarHBondContact O-N 2.6Å; E114-T117 PolarHBondContact O-N 3.04Å
115	K	82.6	Confident	83.7	Confident	107 Å²	107	61.4 Å²	61.4	47%	0.465	34%	0.342	S	S	.	.	H	α-helix	trans	-61.5	-35.3	178.1	-72.2	169	-179.7	160.2	0	113.3	D111 S112 R119	D111-K115 WeakPolarHBondContact O-CG 3.33Å; D111-K115 PolarHBondContact O-N 3.09Å; D111-K115 WeakPolarHBondContact OD1-CE 3.48Å; D111-K115 IonicContact OD1-NZ 2.91Å; D111-K115 PolarHBondContact OD1-NZ 2.82Å; D111-K115 IonicContact OD2-NZ 2.69Å; D111-K115 PolarHBondContact OD2-NZ 3.02Å; S112-K115 PolarHBondContact O-N 2.72Å; K115-R119 WeakPolarHBondContact O-CG 3.33Å
116	C	82.1	Confident	83.6	Confident	5 Å²	5	63.2 Å²	63.2	3%	0.034	35%	0.352	C	S	.	.	H	α-helix	trans	-87.6	-19.4	-177.2	-83.1	0	0	0	0	114.8	S112 I113 E114 D118 R119 G120 C121	S112-C116 VanDerWaalsContact O-CB 3.25Å; S112-C116 WeakPolarHBondContact O-CB 3.11Å; S112-C116 PolarHBondContact O-N 3.16Å; I113-C116 PolarHBondContact O-N 3.19Å; E114-C116 VanDerWaalsContact C-N 3.29Å; E114-C116 PolarHBondContact O-N 2.6Å; C116-D118 VanDerWaalsContact C-N 3.31Å; C116-R119 PolarHBondContact O-N 3.38Å; C116-G120 WeakPolarHBondContact O-CA 3.18Å; C116-G120 PolarHBondContact O-N 2.96Å; C116-C121 WeakPolarHBondContact CA-SG 3.33Å; C116-C121 HydrophobicContact CB-CB 3.98Å; C116-C121 WeakPolarHBondContact CB-SG 3.44Å; C116-C121 PolarHBondContact O-N 3.03Å; C116-C121 WeakPolarHBondContact SG-CB 3.24Å; C116-C121 PolarHBondContact SG-O 3.47Å; C116-C121 CovalentContact SG-SG 2.06Å; C116-C121 PolarHBondContact SG-SG 3.23Å
117	T	77.8	Confident	83.9	Confident	60 Å²	60	66.7 Å²	66.7	37%	0.368	37%	0.371	S	S	.	.	H	α-helix	trans	-64	-41.3	171.5	-61.3	0	0	0	0	110	I113 E114	I113-T117 WeakPolarHBondContact O-CB 2.95Å; I113-T117 PolarHBondContact O-N 3.4Å; I113-T117 PolarHBondContact O-OG1 2.85Å; E114-T117 PolarHBondContact O-N 3.04Å
118	D	75.8	Confident	84.1	Confident	143 Å²	143	65.7 Å²	65.7	77%	0.765	36%	0.357	S	S	*	.	H	α-helix	trans	-73.6	-30.9	178.1	-68.3	-19.7	0	0	0	113.7	C116	C116-D118 VanDerWaalsContact C-N 3.31Å
119	R	77.7	Confident	84.2	Confident	207 Å²	207	63 Å²	63	78%	0.781	34%	0.341	S	S	*	.	H	α-helix	trans	-99.5	-4.8	-174.4	-64.3	-177.7	-174.7	-174.8	2.2	114.6	K115 C116	K115-R119 WeakPolarHBondContact O-CG 3.33Å; C116-R119 PolarHBondContact O-N 3.38Å
120	G	77.6	Confident	84.6	Confident	67 Å²	67	64.9 Å²	64.9	69%	0.691	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.8	20.6	-177.2	0	0	0	0	0	115.4	C116	C116-G120 WeakPolarHBondContact O-CA 3.18Å; C116-G120 PolarHBondContact O-N 2.96Å
121	C	84.7	Confident	85.1	Confident	40 Å²	40	67.4 Å²	67.4	27%	0.27	36%	0.364	S	S	.	.			trans	-99.7	35.7	-176.3	54.2	0	0	0	0	115.2	C116 S123 L124	C116-C121 WeakPolarHBondContact CA-SG 3.33Å; C116-C121 HydrophobicContact CB-CB 3.98Å; C116-C121 WeakPolarHBondContact CB-SG 3.44Å; C116-C121 PolarHBondContact O-N 3.03Å; C116-C121 WeakPolarHBondContact SG-CB 3.24Å; C116-C121 PolarHBondContact SG-O 3.47Å; C116-C121 CovalentContact SG-SG 2.06Å; C116-C121 PolarHBondContact SG-SG 3.23Å; C121-S123 PolarHBondContact O-N 3.03Å; C121-L124 WeakPolarHBondContact O-CB 3.39Å; C121-L124 PolarHBondContact O-N 3.11Å
122	L	82.4	Confident	85.5	Confident	56 Å²	56	66.6 Å²	66.6	29%	0.293	36%	0.357	S	S	.	.	H	α-helix	trans	-56.9	-25.6	-174.2	-71.9	171.2	0	0	0	115.3	L124 S125 L126 F428	L122-L124 VanDerWaalsContact C-N 3.29Å; L122-L124 PolarHBondContact O-N 3.27Å; L122-S125 PolarHBondContact O-N 3.37Å; L122-L126 PolarHBondContact O-N 2.65Å; L122-F428 HydrophobicContact CD2-CD1 3.97Å; L122-F428 HydrophobicContact CD2-CE1 3.58Å
123	S	85.2	Confident	86	Confident	96 Å²	96	66.3 Å²	66.3	67%	0.671	36%	0.355	S	S	*	.	H	α-helix	trans	-65.5	-29.7	176.6	55.8	0	0	0	0	113.2	C121 L126 L127	C121-S123 PolarHBondContact O-N 3.03Å; S123-L126 PolarHBondContact O-N 2.92Å; S123-L127 PolarHBondContact O-N 2.98Å
124	L	87.8	Confident	86.5	Confident	85 Å²	85	68.9 Å²	68.9	45%	0.445	37%	0.367	S	S	.	.	H	α-helix	trans	-67.7	-44.9	176.6	-175.4	67.1	0	0	0	110.7	C121 L122 L126 L127 E128	C121-L124 WeakPolarHBondContact O-CB 3.39Å; C121-L124 PolarHBondContact O-N 3.11Å; L122-L124 VanDerWaalsContact C-N 3.29Å; L122-L124 PolarHBondContact O-N 3.27Å; L124-L126 VanDerWaalsContact C-N 3.31Å; L124-L126 PolarHBondContact O-N 3.07Å; L124-L127 PolarHBondContact O-N 2.83Å; L124-L127 VanDerWaalsContact O-N 3.13Å; L124-E128 WeakPolarHBondContact O-CG 3.41Å; L124-E128 PolarHBondContact O-N 3.02Å
125	S	87.7	Confident	87.2	Confident	0 Å²	0	65.7 Å²	65.7	0%	0	36%	0.357	C	S	.	.	H	α-helix	trans	-64	-36.3	177.5	-48.9	0	0	0	0	112.2	S112 L122 L129	S112-S125 PolarHBondContact O-OG 3.02Å; S112-S125 PolarHBondContact OG-OG 2.99Å; L122-S125 PolarHBondContact O-N 3.37Å; S125-L129 WeakPolarHBondContact O-CB 3.25Å; S125-L129 PolarHBondContact O-N 3.03Å; S125-L129 VanDerWaalsContact O-N 3.08Å
126	L	89.7	Confident	87.8	Confident	44 Å²	44	61.9 Å²	61.9	23%	0.23	34%	0.341	C	S	.	.	H	α-helix	trans	-63.4	-44.8	171.5	175.2	61.4	0	0	0	111.5	L122 S123 L124 L129 L130 F386	L122-L126 PolarHBondContact O-N 2.65Å; S123-L126 PolarHBondContact O-N 2.92Å; L124-L126 VanDerWaalsContact C-N 3.31Å; L124-L126 PolarHBondContact O-N 3.07Å; L126-L129 PolarHBondContact O-N 2.96Å; L126-L130 VanDerWaalsContact O-CB 3.25Å; L126-L130 WeakPolarHBondContact O-CB 3.42Å; L126-L130 PolarHBondContact O-N 3.21Å; L126-F386 HydrophobicContact CB-CD1 4.2Å; L126-F386 HydrophobicContact CB-CD2 4.46Å; L126-F386 HydrophobicContact CB-CE1 4.03Å; L126-F386 HydrophobicContact CB-CE2 4.32Å; L126-F386 HydrophobicContact CB-CG 4.42Å; L126-F386 HydrophobicContact CB-CZ 4.1Å; L126-F386 HydrophobicContact CD1-CB 3.76Å; L126-F386 HydrophobicContact CD1-CD1 3.98Å; L126-F386 HydrophobicContact CD1-CD2 4.21Å; L126-F386 HydrophobicContact CD1-CG 3.73Å; L126-F386 HydrophobicContact CD2-CD1 4.35Å; L126-F386 HydrophobicContact CG-CD1 4.4Å
127	L	91.4	Very high	88.5	Confident	100 Å²	100	61.7 Å²	61.7	52%	0.524	34%	0.339	S	S	.	.	H	α-helix	trans	-64.2	-40.4	179.7	-175.7	65.8	0	0	0	111.9	S123 L124 L130 T131	S123-L127 PolarHBondContact O-N 2.98Å; L124-L127 PolarHBondContact O-N 2.83Å; L124-L127 VanDerWaalsContact O-N 3.13Å; L127-L130 PolarHBondContact O-N 2.91Å; L127-T131 WeakPolarHBondContact O-CB 3.2Å; L127-T131 PolarHBondContact O-N 2.99Å; L127-T131 PolarHBondContact O-OG1 3.17Å
128	E	90.8	Very high	89.3	Confident	59 Å²	59	63.3 Å²	63.3	28%	0.276	34%	0.341	S	S	.	.	H	α-helix	trans	-62.4	-49.5	175.3	-73.8	174.9	172.8	0	0	111.3	S112 L124 L130 T131 F132	S112-E128 WeakPolarHBondContact CB-OE2 3.37Å; S112-E128 PolarHBondContact OG-OE2 2.96Å; L124-E128 WeakPolarHBondContact O-CG 3.41Å; L124-E128 PolarHBondContact O-N 3.02Å; E128-L130 VanDerWaalsContact C-N 3.34Å; E128-L130 PolarHBondContact O-N 3.3Å; E128-T131 PolarHBondContact O-N 3.1Å; E128-F132 VanDerWaalsContact O-CD2 3.22Å; E128-F132 WeakPolarHBondContact O-CD2 3.46Å; E128-F132 PolarHBondContact O-N 3.45Å
129	L	91.1	Very high	90.2	Very high	6 Å²	6	59.2 Å²	59.2	3%	0.031	32%	0.319	C	S	.	.	H	α-helix	trans	-59.8	-44.9	176.9	179	65.4	0	0	0	111.8	V109 S125 L126 T131 F132 N133 F386 F442	V109-L129 HydrophobicContact CG1-CD1 4.45Å; V109-L129 HydrophobicContact CG2-CB 4.18Å; V109-L129 HydrophobicContact CG2-CD1 4.05Å; S125-L129 WeakPolarHBondContact O-CB 3.25Å; S125-L129 PolarHBondContact O-N 3.03Å; S125-L129 VanDerWaalsContact O-N 3.08Å; L126-L129 PolarHBondContact O-N 2.96Å; L129-T131 VanDerWaalsContact C-N 3.33Å; L129-T131 PolarHBondContact O-N 2.95Å; L129-F132 PolarHBondContact O-N 3.18Å; L129-N133 WeakPolarHBondContact CD1-ND2 3.46Å; L129-N133 PolarHBondContact O-N 3.31Å; L129-N133 VanDerWaalsContact O-N 3.09Å; L129-N133 PolarHBondContact O-ND2 3.23Å; L129-N133 VanDerWaalsContact O-ND2 3.11Å; L129-F386 HydrophobicContact CD2-CD2 4.37Å; L129-F442 HydrophobicContact CD2-CE1 3.78Å; L129-F442 HydrophobicContact CD2-CZ 4.39Å
130	L	93.6	Very high	91.1	Very high	39 Å²	39	49.4 Å²	49.4	20%	0.204	28%	0.282	C	S	.	.	H	α-helix	trans	-60.3	-44.6	177.2	-179.5	66.3	0	0	0	110.6	L126 L127 E128 N133 M134 M379 T382	L126-L130 VanDerWaalsContact O-CB 3.25Å; L126-L130 WeakPolarHBondContact O-CB 3.42Å; L126-L130 PolarHBondContact O-N 3.21Å; L127-L130 PolarHBondContact O-N 2.91Å; E128-L130 VanDerWaalsContact C-N 3.34Å; E128-L130 PolarHBondContact O-N 3.3Å; L130-N133 PolarHBondContact O-N 2.85Å; L130-M134 HydrophobicContact CD1-CG 3.88Å; L130-M134 HydrophobicContact CG-CG 4.14Å; L130-M134 VanDerWaalsContact O-CB 3.29Å; L130-M134 WeakPolarHBondContact O-CB 3.37Å; L130-M134 WeakPolarHBondContact O-CG 3.14Å; L130-M134 PolarHBondContact O-N 3.16Å; L130-M379 HydrophobicContact CD1-CB 3.99Å; L130-M379 HydrophobicContact CD1-CG 3.82Å; L130-T382 VanDerWaalsContact CD1-OG1 3.29Å; L130-T382 WeakPolarHBondContact CD1-OG1 3.37Å
131	T	94.1	Very high	91.8	Very high	75 Å²	75	46.2 Å²	46.2	46%	0.46	25%	0.249	S	C	.	.	H	α-helix	trans	-61.3	-47.9	-179.9	-58.7	0	0	0	0	111.3	L127 E128 L129 N133 M134 V135	L127-T131 WeakPolarHBondContact O-CB 3.2Å; L127-T131 PolarHBondContact O-N 2.99Å; L127-T131 PolarHBondContact O-OG1 3.17Å; E128-T131 PolarHBondContact O-N 3.1Å; L129-T131 VanDerWaalsContact C-N 3.33Å; L129-T131 PolarHBondContact O-N 2.95Å; T131-N133 PolarHBondContact O-N 3.24Å; T131-M134 PolarHBondContact O-N 3.27Å; T131-V135 HydrophobicContact CG2-CG2 4.43Å; T131-V135 WeakPolarHBondContact O-CB 3.45Å; T131-V135 VanDerWaalsContact O-CG2 3.27Å; T131-V135 WeakPolarHBondContact O-CG2 3.41Å; T131-V135 PolarHBondContact O-N 3.25Å
132	F	93.9	Very high	92.2	Very high	61 Å²	61	48.2 Å²	48.2	27%	0.268	26%	0.256	S	S	.	.	H	α-helix	trans	-58.9	-48.5	176.8	-81.9	-68	0	0	0	112.3	K105 V108 E128 L129 V135 F136	K105-F132 HydrophobicContact CD-CB 4.11Å; K105-F132 HydrophobicContact CG-CB 3.98Å; K105-F132 HydrophobicContact CG-CD2 4.41Å; K105-F132 HydrophobicContact CG-CG 4.14Å; V108-F132 HydrophobicContact CB-CE2 4.29Å; V108-F132 HydrophobicContact CB-CZ 4.48Å; V108-F132 HydrophobicContact CG1-CE2 3.93Å; V108-F132 HydrophobicContact CG1-CZ 4.28Å; E128-F132 VanDerWaalsContact O-CD2 3.22Å; E128-F132 WeakPolarHBondContact O-CD2 3.46Å; E128-F132 PolarHBondContact O-N 3.45Å; L129-F132 PolarHBondContact O-N 3.18Å; F132-V135 PolarHBondContact O-N 3.04Å; F132-F136 HydrophobicContact CD1-CE2 4.5Å; F132-F136 HydrophobicContact CD1-CZ 4.45Å; F132-F136 WeakPolarHBondContact O-CD2 3.49Å; F132-F136 WeakPolarHBondContact O-CG 3.44Å; F132-F136 PolarHBondContact O-N 3.36Å; F132-F136 VanDerWaalsContact O-N 3.1Å
133	N	94.6	Very high	92.7	Very high	4 Å²	4	47.2 Å²	47.2	2%	0.021	25%	0.251	C	S	.	.	H	α-helix	trans	-67.3	-40.2	-177.1	-68.3	-31.3	0	0	0	111.6	K105 L129 L130 T131 F136 V137 G189 T382	K105-N133 WeakPolarHBondContact CD-OD1 3.5Å; K105-N133 PolarHBondContact NZ-OD1 3.08Å; L129-N133 WeakPolarHBondContact CD1-ND2 3.46Å; L129-N133 PolarHBondContact O-N 3.31Å; L129-N133 VanDerWaalsContact O-N 3.09Å; L129-N133 PolarHBondContact O-ND2 3.23Å; L129-N133 VanDerWaalsContact O-ND2 3.11Å; L130-N133 PolarHBondContact O-N 2.85Å; T131-N133 PolarHBondContact O-N 3.24Å; N133-F136 PolarHBondContact O-N 3.05Å; N133-V137 WeakPolarHBondContact O-CB 3.34Å; N133-V137 VanDerWaalsContact O-CG2 3.27Å; N133-V137 WeakPolarHBondContact O-CG2 3.49Å; N133-V137 PolarHBondContact O-N 2.94Å; N133-G189 VanDerWaalsContact CB-O 3.24Å; N133-G189 WeakPolarHBondContact CB-O 3.47Å; N133-G189 VanDerWaalsContact OD1-C 3.27Å; N133-G189 PolarHBondContact OD1-O 3.12Å; N133-T382 HydrophobicContact CB-CG2 3.8Å; N133-T382 WeakPolarHBondContact ND2-CG2 3.2Å
134	M	94.9	Very high	93	Very high	54 Å²	54	43 Å²	43	27%	0.266	22%	0.221	S	C	.	.	H	α-helix	trans	-65	-42.8	177	-69.9	-69.8	-81.9	0	0	112.3	L130 T131 F138 L375 A378 M379	L130-M134 HydrophobicContact CD1-CG 3.88Å; L130-M134 HydrophobicContact CG-CG 4.14Å; L130-M134 VanDerWaalsContact O-CB 3.29Å; L130-M134 WeakPolarHBondContact O-CB 3.37Å; L130-M134 WeakPolarHBondContact O-CG 3.14Å; L130-M134 PolarHBondContact O-N 3.16Å; T131-M134 PolarHBondContact O-N 3.27Å; M134-F138 WeakPolarHBondContact O-CB 3.39Å; M134-F138 PolarHBondContact O-N 3.45Å; M134-L375 HydrophobicContact CE-CB 3.73Å; M134-L375 HydrophobicContact CE-CD2 4.02Å; M134-L375 HydrophobicContact CE-CG 4.3Å; M134-L375 HydrophobicContact SD-CB 4.19Å; M134-L375 HydrophobicContact SD-CD2 4.07Å; M134-A378 HydrophobicContact SD-CB 4.12Å; M134-M379 HydrophobicContact CE-CB 4.45Å; M134-M379 HydrophobicContact SD-CB 4.02Å
135	V	95.6	Very high	93	Very high	72 Å²	72	41.2 Å²	41.2	44%	0.436	21%	0.212	S	C	.	.	H	α-helix	trans	-63.3	-45.9	177.9	169.7	0	0	0	0	111.1	T131 F132 F138 I139	T131-V135 HydrophobicContact CG2-CG2 4.43Å; T131-V135 WeakPolarHBondContact O-CB 3.45Å; T131-V135 VanDerWaalsContact O-CG2 3.27Å; T131-V135 WeakPolarHBondContact O-CG2 3.41Å; T131-V135 PolarHBondContact O-N 3.25Å; F132-V135 PolarHBondContact O-N 3.04Å; V135-F138 PolarHBondContact O-N 2.96Å; V135-I139 HydrophobicContact CG1-CD1 4.15Å; V135-I139 WeakPolarHBondContact O-CG1 3.32Å; V135-I139 PolarHBondContact O-N 3.5Å; V135-I139 VanDerWaalsContact O-N 3.14Å
136	F	95.9	Very high	93.1	Very high	27 Å²	27	44.8 Å²	44.8	12%	0.118	23%	0.23	C	C	.	.	H	α-helix	trans	-65.2	-45.8	178.4	-67.5	-29.9	0	0	0	112.2	F101 K105 F132 N133 F138 I139 A140 F185 A188	F101-F136 HydrophobicContact CB-CZ 4.37Å; K105-F136 HydrophobicContact CD-CE2 4.49Å; F132-F136 HydrophobicContact CD1-CE2 4.5Å; F132-F136 HydrophobicContact CD1-CZ 4.45Å; F132-F136 WeakPolarHBondContact O-CD2 3.49Å; F132-F136 WeakPolarHBondContact O-CG 3.44Å; F132-F136 PolarHBondContact O-N 3.36Å; F132-F136 VanDerWaalsContact O-N 3.1Å; N133-F136 PolarHBondContact O-N 3.05Å; F136-F138 VanDerWaalsContact C-N 3.31Å; F136-F138 PolarHBondContact O-N 3.42Å; F136-I139 PolarHBondContact O-N 2.89Å; F136-A140 PolarHBondContact O-N 3.25Å; F136-F185 HydrophobicContact CB-CB 4.32Å; F136-F185 WeakPolarHBondContact CB-O 3.47Å; F136-F185 AromaticContact CD1-CD1 3.79Å; F136-F185 HydrophobicContact CD1-CD1 3.79Å; F136-F185 HydrophobicContact CD1-CE1 4.34Å; F136-F185 HydrophobicContact CE1-CD1 4.39Å; F136-F185 HydrophobicContact CG-CD1 4.41Å; F136-F185 WeakPolarHBondContact O-CB 3.35Å; F136-A188 HydrophobicContact CD2-CB 3.98Å; F136-A188 HydrophobicContact CE2-CB 4.15Å
137	V	95.8	Very high	93.1	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-65.4	-35.5	178.3	174.8	0	0	0	0	111.7	N133 A140 S141 L191 L375 A378 V483	N133-V137 WeakPolarHBondContact O-CB 3.34Å; N133-V137 VanDerWaalsContact O-CG2 3.27Å; N133-V137 WeakPolarHBondContact O-CG2 3.49Å; N133-V137 PolarHBondContact O-N 2.94Å; V137-A140 PolarHBondContact O-N 3.47Å; V137-S141 WeakPolarHBondContact O-CB 3.47Å; V137-S141 PolarHBondContact O-N 3.27Å; V137-L191 HydrophobicContact CG1-CD1 4.17Å; V137-L191 HydrophobicContact CG2-CD1 3.69Å; V137-L191 HydrophobicContact CG2-CD2 4.34Å; V137-L191 HydrophobicContact CG2-CG 3.77Å; V137-L375 HydrophobicContact CG1-CD2 4.43Å; V137-A378 HydrophobicContact CB-CB 4.14Å; V137-A378 HydrophobicContact CG1-CB 4.15Å; V137-A378 HydrophobicContact CG2-CB 3.89Å; V137-V483 HydrophobicContact CG1-CG1 4.46Å
138	F	95.6	Very high	93	Very high	94 Å²	94	42.3 Å²	42.3	41%	0.412	22%	0.222	S	C	.	.	H	α-helix	trans	-58.4	-48.7	173.7	-178.6	-109.8	0	0	0	111.9	M134 V135 F136 S141 L142 V371 L375	M134-F138 WeakPolarHBondContact O-CB 3.39Å; M134-F138 PolarHBondContact O-N 3.45Å; V135-F138 PolarHBondContact O-N 2.96Å; F136-F138 VanDerWaalsContact C-N 3.31Å; F136-F138 PolarHBondContact O-N 3.42Å; F138-S141 PolarHBondContact O-N 3.45Å; F138-L142 WeakPolarHBondContact O-CB 3.44Å; F138-L142 PolarHBondContact O-N 3.26Å; F138-V371 HydrophobicContact CD2-CG1 3.9Å; F138-V371 HydrophobicContact CE2-CG1 4.12Å; F138-L375 HydrophobicContact CB-CD2 3.98Å; F138-L375 HydrophobicContact CD2-CD1 4.18Å
139	I	95.3	Very high	92.8	Very high	58 Å²	58	41.1 Å²	41.1	30%	0.297	22%	0.218	S	C	.	.	H	α-helix	trans	-62.9	-44.8	177.9	-63.9	166.2	0	0	0	110.5	V135 F136 S141 L142 L143 F185	V135-I139 HydrophobicContact CG1-CD1 4.15Å; V135-I139 WeakPolarHBondContact O-CG1 3.32Å; V135-I139 PolarHBondContact O-N 3.5Å; V135-I139 VanDerWaalsContact O-N 3.14Å; F136-I139 PolarHBondContact O-N 2.89Å; I139-S141 PolarHBondContact O-N 2.82Å; I139-L142 PolarHBondContact O-N 3.31Å; I139-L143 WeakPolarHBondContact O-CG 3.32Å; I139-L143 PolarHBondContact O-N 2.95Å; I139-L143 VanDerWaalsContact O-N 3.11Å; I139-F185 HydrophobicContact CB-CD2 4.35Å; I139-F185 HydrophobicContact CB-CG 4.34Å; I139-F185 HydrophobicContact CD1-CE1 4.43Å; I139-F185 HydrophobicContact CG2-CD1 4.5Å; I139-F185 HydrophobicContact CG2-CD2 3.58Å; I139-F185 HydrophobicContact CG2-CE2 3.63Å; I139-F185 HydrophobicContact CG2-CG 4.04Å; I139-F185 HydrophobicContact CG2-CZ 4.13Å
140	A	95	Very high	92.7	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-59.1	-46.5	178.1	0	0	0	0	0	111.9	F136 V137 L143 V144 F185 V483	F136-A140 PolarHBondContact O-N 3.25Å; V137-A140 PolarHBondContact O-N 3.47Å; A140-L143 PolarHBondContact O-N 3.08Å; A140-V144 PolarHBondContact O-N 3.19Å; A140-F185 HydrophobicContact CB-CB 3.96Å; A140-V483 HydrophobicContact CB-CG1 4.18Å
141	S	93.3	Very high	92.6	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-70.4	-31.8	179.8	-169.6	0	0	0	0	112.3	V137 F138 I139 V144 L145 S374 S482	V137-S141 WeakPolarHBondContact O-CB 3.47Å; V137-S141 PolarHBondContact O-N 3.27Å; F138-S141 PolarHBondContact O-N 3.45Å; I139-S141 PolarHBondContact O-N 2.82Å; S141-V144 PolarHBondContact O-N 3.19Å; S141-L145 PolarHBondContact O-N 2.84Å; S141-S374 WeakPolarHBondContact CB-OG 3.32Å; S141-S374 PolarHBondContact OG-OG 3.29Å; S141-S482 PolarHBondContact OG-O 2.94Å; S141-S482 PolarHBondContact OG-OG 3.27Å
142	L	93	Very high	92.4	Very high	82 Å²	82	37.5 Å²	37.5	43%	0.429	20%	0.204	S	C	.	.	H	α-helix	trans	-63.8	-41.3	174.6	-176.5	64.8	0	0	0	111.4	F138 I139 V144 L145 I146	F138-L142 WeakPolarHBondContact O-CB 3.44Å; F138-L142 PolarHBondContact O-N 3.26Å; I139-L142 PolarHBondContact O-N 3.31Å; L142-V144 VanDerWaalsContact C-N 3.28Å; L142-V144 PolarHBondContact O-N 2.99Å; L142-L145 HydrophobicContact CD1-CD1 4.41Å; L142-L145 WeakPolarHBondContact O-CB 3.4Å; L142-L145 PolarHBondContact O-N 2.88Å; L142-L145 VanDerWaalsContact O-N 3.11Å; L142-I146 PolarHBondContact O-N 3.31Å
143	L	93	Very high	92.3	Very high	36 Å²	36	34.7 Å²	34.7	19%	0.188	19%	0.192	C	C	.	.	H	α-helix	trans	-62.7	-34.5	175.2	-68.8	173.5	0	0	0	112.4	I139 A140 I146 E147 A181 F185	I139-L143 WeakPolarHBondContact O-CG 3.32Å; I139-L143 PolarHBondContact O-N 2.95Å; I139-L143 VanDerWaalsContact O-N 3.11Å; A140-L143 PolarHBondContact O-N 3.08Å; L143-I146 HydrophobicContact CD2-CD1 4.35Å; L143-I146 WeakPolarHBondContact O-CB 3.15Å; L143-I146 PolarHBondContact O-N 3.11Å; L143-E147 PolarHBondContact O-N 3.35Å; L143-A181 HydrophobicContact CD1-CB 3.78Å; L143-F185 HydrophobicContact CD1-CD2 4.47Å
144	V	91.3	Very high	92.1	Very high	6 Å²	6	34.5 Å²	34.5	4%	0.036	19%	0.191	C	C	.	.	H	α-helix	trans	-73.1	-27.4	174.5	173.4	0	0	0	0	112.3	A140 S141 L142 I146 E147 P148 A151 S482 P484	A140-V144 PolarHBondContact O-N 3.19Å; S141-V144 PolarHBondContact O-N 3.19Å; L142-V144 VanDerWaalsContact C-N 3.28Å; L142-V144 PolarHBondContact O-N 2.99Å; V144-I146 PolarHBondContact O-N 3.2Å; V144-E147 CarbonylContact O-C 3.51Å; V144-E147 PolarHBondContact O-N 2.89Å; V144-P148 VanDerWaalsContact O-CA 3.27Å; V144-P148 WeakPolarHBondContact O-CA 3.5Å; V144-A151 HydrophobicContact CG1-CB 3.72Å; V144-S482 WeakPolarHBondContact CB-O 3.16Å; V144-P484 HydrophobicContact CG2-CG 3.92Å
145	L	88.6	Confident	91.9	Very high	49 Å²	49	32.1 Å²	32.1	26%	0.257	18%	0.179	S	C	.	.	H	α-helix	trans	-65.4	-31.3	171.7	-69.7	-170.8	0	0	0	112.6	S141 L142 R367 V371	S141-L145 PolarHBondContact O-N 2.84Å; L142-L145 HydrophobicContact CD1-CD1 4.41Å; L142-L145 WeakPolarHBondContact O-CB 3.4Å; L142-L145 PolarHBondContact O-N 2.88Å; L142-L145 VanDerWaalsContact O-N 3.11Å; L145-R367 HydrophobicContact CD2-CB 4.1Å; L145-V371 HydrophobicContact CD1-CG2 3.41Å; L145-V371 VanDerWaalsContact CD1-CG2 3.41Å; L145-V371 HydrophobicContact CD2-CG2 4.08Å; L145-V371 HydrophobicContact CG-CG2 3.78Å
146	I	89.6	Confident	91.8	Very high	74 Å²	74	28.9 Å²	28.9	38%	0.379	16%	0.16	S	C	.	.	H	α-helix	trans	-68	-46.9	176.8	-64.4	177.6	0	0	0	110.1	L142 L143 V144 R174	L142-I146 PolarHBondContact O-N 3.31Å; L143-I146 HydrophobicContact CD2-CD1 4.35Å; L143-I146 WeakPolarHBondContact O-CB 3.15Å; L143-I146 PolarHBondContact O-N 3.11Å; V144-I146 PolarHBondContact O-N 3.2Å; I146-R174 VanDerWaalsContact CG2-NE 3.33Å
147	E	89.8	Confident	91.5	Very high	15 Å²	15	28.3 Å²	28.3	7%	0.07	16%	0.157	C	C	.	.			trans	-133.8	98	178	-168.3	68.3	-137.8	0	0	110.4	L143 V144 V149 A150 T175 C178	L143-E147 PolarHBondContact O-N 3.35Å; V144-E147 CarbonylContact O-C 3.51Å; V144-E147 PolarHBondContact O-N 2.89Å; E147-V149 PolarHBondContact O-N 2.92Å; E147-V149 VanDerWaalsContact O-N 3.15Å; E147-A150 WeakPolarHBondContact O-CB 3.48Å; E147-A150 PolarHBondContact O-N 2.75Å; E147-T175 HydrophobicContact CG-CG2 4.31Å; E147-C178 HydrophobicContact CB-CB 4.35Å
148	P	87.8	Confident	91.4	Very high	78 Å²	78	28.4 Å²	28.4	51%	0.506	16%	0.158	S	C	.	.	G	3₁₀ helix	trans	-67	-20.5	-172.8	26.4	-34.9	0	0	0	113.3	V144 A150 A151	V144-P148 VanDerWaalsContact O-CA 3.27Å; V144-P148 WeakPolarHBondContact O-CA 3.5Å; P148-A150 PolarHBondContact O-N 3.44Å; P148-A151 WeakPolarHBondContact O-CB 3.41Å; P148-A151 PolarHBondContact O-N 2.83Å
149	V	87.4	Confident	91.2	Very high	34 Å²	34	25 Å²	25	21%	0.206	14%	0.143	C	C	.	.	G	3₁₀ helix	trans	-67.3	-18.3	176	-173.1	0	0	0	0	111.7	E147 A151	E147-V149 PolarHBondContact O-N 2.92Å; E147-V149 VanDerWaalsContact O-N 3.15Å; V149-A151 VanDerWaalsContact C-N 3.27Å; V149-A151 PolarHBondContact O-N 2.88Å
150	A	89.5	Confident	90.9	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	13%	0.13	C	C	.	.	G	3₁₀ helix	trans	-74.4	-15.5	177.1	0	0	0	0	0	113.6	E147 P148 T175 C178 K179	E147-A150 WeakPolarHBondContact O-CB 3.48Å; E147-A150 PolarHBondContact O-N 2.75Å; P148-A150 PolarHBondContact O-N 3.44Å; A150-T175 HydrophobicContact CB-CG2 4.41Å; A150-C178 HydrophobicContact CB-CB 4.19Å; A150-K179 HydrophobicContact CB-CB 4.18Å; A150-K179 PolarHBondContact O-NZ 2.88Å
151	A	90.4	Very high	90.7	Very high	28 Å²	28	22.7 Å²	22.7	23%	0.231	13%	0.131	C	C	.	.	S	Bend	trans	-60	147.5	-179.7	0	0	0	0	0	112.7	V144 P148 V149	V144-A151 HydrophobicContact CG1-CB 3.72Å; P148-A151 WeakPolarHBondContact O-CB 3.41Å; P148-A151 PolarHBondContact O-N 2.83Å; V149-A151 VanDerWaalsContact C-N 3.27Å; V149-A151 PolarHBondContact O-N 2.88Å
152	G	90.9	Very high	90.5	Very high	16 Å²	16	22.8 Å²	22.8	17%	0.165	13%	0.132	C	C	.	.	S	Bend	trans	67.5	-162.4	178.8	0	0	0	0	0	114	K179 V483 S485	G152-K179 PolarHBondContact O-NZ 3.29Å; G152-V483 PolarHBondContact N-O 3.42Å; G152-S485 CarbonylContact C-O 3.41Å; G152-S485 PolarHBondContact O-N 2.88Å
153	S	90.3	Very high	90.3	Very high	2 Å²	2	19.6 Å²	19.6	1%	0.014	12%	0.115	C	C	.	.			trans	-74.2	-34.9	-170.5	-170.8	0	0	0	0	113.2	I155 K179 G197 P198 S485	S153-I155 VanDerWaalsContact C-N 3.3Å; S153-I155 VanDerWaalsContact OG-CD1 3.29Å; S153-I155 WeakPolarHBondContact OG-CD1 3.47Å; S153-I155 WeakPolarHBondContact OG-CG1 3.29Å; S153-K179 VanDerWaalsContact O-CE 3.23Å; S153-K179 WeakPolarHBondContact O-CE 2.97Å; S153-K179 PolarHBondContact O-NZ 3.05Å; S153-G197 CarbonylContact O-C 3.07Å; S153-G197 WeakPolarHBondContact OG-CA 3.48Å; S153-P198 WeakPolarHBondContact O-CA 3.07Å; S153-S485 WeakPolarHBondContact CA-O 3.34Å; S153-S485 VanDerWaalsContact CB-O 3.32Å; S153-S485 WeakPolarHBondContact CB-O 3.24Å; S153-S485 PolarHBondContact N-O 3.14Å
154	G	90.9	Very high	90.1	Very high	0 Å²	0	18.2 Å²	18.2	0%	0	11%	0.109	C	C	.	.	S	Bend	trans	87.4	-11.4	-170.6	0	0	0	0	0	115	E157 I158 H201	G154-E157 WeakPolarHBondContact CA-OE2 3.08Å; G154-E157 PolarHBondContact O-N 2.98Å; G154-I158 WeakPolarHBondContact O-CG1 3.22Å; G154-I158 PolarHBondContact O-N 2.78Å; G154-H201 VanDerWaalsContact CA-ND1 3.33Å; G154-H201 WeakPolarHBondContact CA-ND1 3.17Å
155	I	92.1	Very high	90	Very high	3 Å²	3	18 Å²	18	2%	0.015	11%	0.108	C	C	.	.	H	α-helix	trans	-65.6	-46.5	180	-63.2	168.4	0	0	0	111.9	S153 E157 I158 K159 I200 F259 F488 Y574	S153-I155 VanDerWaalsContact C-N 3.3Å; S153-I155 VanDerWaalsContact OG-CD1 3.29Å; S153-I155 WeakPolarHBondContact OG-CD1 3.47Å; S153-I155 WeakPolarHBondContact OG-CG1 3.29Å; I155-E157 PolarHBondContact O-N 2.99Å; I155-I158 PolarHBondContact O-N 3.11Å; I155-K159 WeakPolarHBondContact O-CB 3.41Å; I155-K159 PolarHBondContact O-N 3.41Å; I155-I200 HydrophobicContact CD1-CD1 3.8Å; I155-I200 HydrophobicContact CG1-CB 4.48Å; I155-I200 HydrophobicContact CG1-CD1 4.09Å; I155-F259 HydrophobicContact CG2-CZ 4.12Å; I155-F488 HydrophobicContact CD1-CD2 4.27Å; I155-F488 HydrophobicContact CD1-CE2 3.62Å; I155-Y574 HydrophobicContact CB-CE1 4.3Å; I155-Y574 HydrophobicContact CB-CE2 4.48Å; I155-Y574 HydrophobicContact CD1-CE1 4.37Å; I155-Y574 HydrophobicContact CD1-CE2 4.2Å; I155-Y574 WeakPolarHBondContact CD1-OH 3.32Å; I155-Y574 HydrophobicContact CG2-CD2 3.97Å; I155-Y574 HydrophobicContact CG2-CE1 4.5Å; I155-Y574 HydrophobicContact CG2-CE2 3.9Å; I155-Y574 HydrophobicContact CG2-CG 4.31Å
156	P	91.6	Very high	90	Very high	4 Å²	4	19.5 Å²	19.5	3%	0.026	11%	0.112	C	C	.	.	H	α-helix	trans	-53.8	-40.3	174.4	-30.3	38.6	0	0	0	113.2	S160 Y574 H577 I578	P156-S160 WeakPolarHBondContact O-CB 3.4Å; P156-S160 PolarHBondContact O-N 3.3Å; P156-S160 PolarHBondContact O-OG 2.86Å; P156-Y574 HydrophobicContact CG-CD1 3.76Å; P156-Y574 HydrophobicContact CG-CG 4.34Å; P156-H577 HydrophobicContact CG-CB 4.48Å; P156-I578 HydrophobicContact CB-CD1 4.35Å; P156-I578 HydrophobicContact CB-CG1 3.79Å
157	E	91.4	Very high	89.8	Confident	15 Å²	15	16.9 Å²	16.9	7%	0.07	10%	0.099	C	C	.	.	H	α-helix	trans	-69.3	-43.9	-180	-63.8	80.5	-179.8	0	0	111.6	G154 I155 S160 Y161 I167 I170 K581	G154-E157 WeakPolarHBondContact CA-OE2 3.08Å; G154-E157 PolarHBondContact O-N 2.98Å; I155-E157 PolarHBondContact O-N 2.99Å; E157-S160 PolarHBondContact O-N 3.38Å; E157-Y161 WeakPolarHBondContact O-CB 3.22Å; E157-Y161 PolarHBondContact O-N 3.28Å; E157-I167 HydrophobicContact CB-CD1 3.99Å; E157-I167 HydrophobicContact CG-CD1 4.2Å; E157-I170 VanDerWaalsContact C-CD1 3.48Å; E157-I170 HydrophobicContact CB-CD1 3.47Å; E157-I170 VanDerWaalsContact CB-CD1 3.47Å; E157-I170 HydrophobicContact CB-CG1 4.11Å; E157-I170 WeakPolarHBondContact O-CD1 3.34Å; E157-K581 IonicContact OE1-NZ 3.31Å; E157-K581 PolarHBondContact OE1-NZ 2.8Å
158	I	92.1	Very high	89.5	Confident	3 Å²	3	20.3 Å²	20.3	2%	0.015	12%	0.123	C	C	.	.	H	α-helix	trans	-66.3	-43.1	175.7	-66.7	-54.9	0	0	0	111.3	G154 I155 S160 Y161 L162 I170 H201 A204 A242	G154-I158 WeakPolarHBondContact O-CG1 3.22Å; G154-I158 PolarHBondContact O-N 2.78Å; I155-I158 PolarHBondContact O-N 3.11Å; I158-S160 VanDerWaalsContact C-N 3.29Å; I158-S160 PolarHBondContact O-N 3.05Å; I158-Y161 WeakPolarHBondContact O-CB 3.46Å; I158-Y161 PolarHBondContact O-N 2.89Å; I158-Y161 VanDerWaalsContact O-N 3.16Å; I158-L162 HydrophobicContact CG2-CD1 3.73Å; I158-L162 HydrophobicContact CG2-CG 4.11Å; I158-L162 WeakPolarHBondContact O-CB 3.37Å; I158-L162 VanDerWaalsContact O-CG 3.3Å; I158-L162 WeakPolarHBondContact O-CG 3.47Å; I158-L162 PolarHBondContact O-N 2.85Å; I158-I170 HydrophobicContact CD1-CD1 3.77Å; I158-I170 HydrophobicContact CD1-CG1 4.29Å; I158-H201 HydrophobicContact CG1-CB 4.32Å; I158-A204 HydrophobicContact CD1-CB 3.3Å; I158-A204 HydrophobicContact CG1-CB 3.83Å; I158-A204 HydrophobicContact CG2-CB 4.3Å; I158-A242 HydrophobicContact CG2-CB 4.22Å
159	K	91.1	Very high	89.2	Confident	23 Å²	23	17 Å²	17	10%	0.1	10%	0.103	C	C	.	.	H	α-helix	trans	-55	-45.4	173.5	-179.9	169.9	-171.3	170.4	0	111.3	I155 L162 N163 E263 D575 I578	I155-K159 WeakPolarHBondContact O-CB 3.41Å; I155-K159 PolarHBondContact O-N 3.41Å; K159-L162 PolarHBondContact O-N 3.05Å; K159-N163 WeakPolarHBondContact O-CB 3.4Å; K159-N163 PolarHBondContact O-N 2.94Å; K159-E263 VanDerWaalsContact CD-OE2 3.26Å; K159-E263 WeakPolarHBondContact CD-OE2 3.32Å; K159-E263 WeakPolarHBondContact CE-OE2 3.07Å; K159-E263 IonicContact NZ-OE2 3.64Å; K159-E263 PolarHBondContact NZ-OE2 3.4Å; K159-D575 WeakPolarHBondContact CE-OD1 3.4Å; K159-D575 IonicContact NZ-OD1 3.48Å; K159-D575 PolarHBondContact NZ-OD1 3.22Å; K159-D575 IonicContact NZ-OD2 3.35Å; K159-I578 HydrophobicContact CB-CD1 4.33Å; K159-I578 HydrophobicContact CD-CD1 3.87Å; K159-I578 HydrophobicContact CG-CD1 4.12Å
160	S	90.4	Very high	89.2	Confident	2 Å²	2	15.5 Å²	15.5	1%	0.014	9%	0.094	C	C	.	.	H	α-helix	trans	-65.6	-42.2	176.9	-58	0	0	0	0	112.6	P156 E157 I158 L162 N163 G164 V165	P156-S160 WeakPolarHBondContact O-CB 3.4Å; P156-S160 PolarHBondContact O-N 3.3Å; P156-S160 PolarHBondContact O-OG 2.86Å; E157-S160 PolarHBondContact O-N 3.38Å; I158-S160 VanDerWaalsContact C-N 3.29Å; I158-S160 PolarHBondContact O-N 3.05Å; S160-L162 VanDerWaalsContact C-N 3.35Å; S160-L162 PolarHBondContact O-N 3.05Å; S160-N163 PolarHBondContact O-N 3.4Å; S160-G164 PolarHBondContact O-N 3.35Å; S160-V165 PolarHBondContact O-N 3.36Å
161	Y	90.9	Very high	89.2	Confident	6 Å²	6	17.1 Å²	17.1	2%	0.024	10%	0.103	C	C	.	.	H	α-helix	trans	-61.2	-45.1	176.6	-172.7	-94.3	0	0	0	112.1	L47 E157 I158 G164 V165 I170 K234 R235 V238	L47-Y161 HydrophobicContact CD1-CD1 4.34Å; L47-Y161 HydrophobicContact CD1-CD2 4.1Å; L47-Y161 HydrophobicContact CD1-CE1 4.05Å; L47-Y161 HydrophobicContact CD1-CE2 3.78Å; L47-Y161 HydrophobicContact CD1-CG 4.37Å; L47-Y161 WeakPolarHBondContact CD1-O 3.26Å; L47-Y161 HydrophobicContact CD2-CE2 4Å; L47-Y161 HydrophobicContact CG-CE2 4.41Å; E157-Y161 WeakPolarHBondContact O-CB 3.22Å; E157-Y161 PolarHBondContact O-N 3.28Å; I158-Y161 WeakPolarHBondContact O-CB 3.46Å; I158-Y161 PolarHBondContact O-N 2.89Å; I158-Y161 VanDerWaalsContact O-N 3.16Å; Y161-G164 WeakPolarHBondContact O-CA 3.47Å; Y161-G164 PolarHBondContact O-N 3.42Å; Y161-V165 VanDerWaalsContact CA-O 3.27Å; Y161-V165 WeakPolarHBondContact CA-O 3.24Å; Y161-I170 HydrophobicContact CD2-CG2 4.17Å; Y161-K234 WeakPolarHBondContact OH-CD 3.36Å; Y161-R235 HydrophobicContact CE1-CG 4.39Å; Y161-V238 HydrophobicContact CD1-CG1 3.89Å; Y161-V238 HydrophobicContact CE1-CB 4.2Å; Y161-V238 HydrophobicContact CE1-CG1 4.03Å; Y161-V238 HydrophobicContact CE1-CG2 3.92Å
162	L	89.4	Confident	89.1	Confident	3 Å²	3	21.1 Å²	21.1	2%	0.016	11%	0.112	C	C	.	.	H	α-helix	trans	-68.4	-34.1	178.6	-81.5	-173.1	0	0	0	113.2	I158 K159 S160 G164 R235 V238 S239 G264	I158-L162 HydrophobicContact CG2-CD1 3.73Å; I158-L162 HydrophobicContact CG2-CG 4.11Å; I158-L162 WeakPolarHBondContact O-CB 3.37Å; I158-L162 VanDerWaalsContact O-CG 3.3Å; I158-L162 WeakPolarHBondContact O-CG 3.47Å; I158-L162 PolarHBondContact O-N 2.85Å; K159-L162 PolarHBondContact O-N 3.05Å; S160-L162 VanDerWaalsContact C-N 3.35Å; S160-L162 PolarHBondContact O-N 3.05Å; L162-G164 PolarHBondContact O-N 2.96Å; L162-R235 HydrophobicContact CD2-CG 3.94Å; L162-R235 PolarHBondContact O-NH1 3.05Å; L162-V238 HydrophobicContact CD2-CG1 4.02Å; L162-S239 VanDerWaalsContact CD2-OG 3.27Å; L162-S239 WeakPolarHBondContact CD2-OG 3.09Å; L162-G264 WeakPolarHBondContact CB-O 3.18Å; L162-G264 WeakPolarHBondContact CD2-O 3.12Å; L162-G264 WeakPolarHBondContact CG-O 3.41Å
163	N	88.8	Confident	89	Confident	15 Å²	15	23.7 Å²	23.7	8%	0.08	12%	0.122	C	C	.	.	H	α-helix	trans	-66.1	-15.3	169.2	-167.6	-98.4	0	0	0	113	K159 S160 L585 L586 R827 R849	K159-N163 WeakPolarHBondContact O-CB 3.4Å; K159-N163 PolarHBondContact O-N 2.94Å; S160-N163 PolarHBondContact O-N 3.4Å; N163-L585 HydrophobicContact CB-CD1 3.55Å; N163-L585 VanDerWaalsContact CG-CD1 3.44Å; N163-L586 PolarHBondContact ND2-O 2.92Å; N163-L586 PolarHBondContact OD1-N 3.03Å; N163-L586 VanDerWaalsContact OD1-N 3.13Å; N163-R827 PolarHBondContact ND2-NH1 2.78Å; N163-R849 PolarHBondContact O-NH1 3.04Å; N163-R849 PolarHBondContact O-NH2 3.21Å; N163-R849 PolarHBondContact OD1-NH1 3.01Å
164	G	88.2	Confident	88.9	Confident	7 Å²	7	30.1 Å²	30.1	7%	0.072	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	109.2	13.6	175.6	0	0	0	0	0	115	S46 L47 S160 Y161 L162	S46-G164 CarbonylContact C-O 3.53Å; S46-G164 VanDerWaalsContact CA-O 3.31Å; S46-G164 WeakPolarHBondContact CA-O 3.32Å; L47-G164 PolarHBondContact N-O 3.14Å; S160-G164 PolarHBondContact O-N 3.35Å; Y161-G164 WeakPolarHBondContact O-CA 3.47Å; Y161-G164 PolarHBondContact O-N 3.42Å; L162-G164 PolarHBondContact O-N 2.96Å
165	V	89.4	Confident	89	Confident	0 Å²	0	30.1 Å²	30.1	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	123.2	177.3	-173.4	0	0	0	0	110.9	Y44 S160 Y161 I167 V583 P584	Y44-V165 HydrophobicContact CD1-CG1 4.24Å; Y44-V165 HydrophobicContact CG-CG1 4.18Å; S160-V165 PolarHBondContact O-N 3.36Å; Y161-V165 VanDerWaalsContact CA-O 3.27Å; Y161-V165 WeakPolarHBondContact CA-O 3.24Å; V165-I167 PolarHBondContact O-N 3.18Å; V165-V583 HydrophobicContact CB-CG1 4.28Å; V165-V583 HydrophobicContact CG1-CG1 3.99Å; V165-V583 HydrophobicContact CG2-CG1 4.34Å; V165-P584 HydrophobicContact CG2-CG 4.41Å; V165-P584 WeakPolarHBondContact CG2-O 3.28Å
166	K	87.9	Confident	89.1	Confident	81 Å²	81	31.7 Å²	31.7	35%	0.352	15%	0.153	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	99	-178.4	-175.1	179.9	167.5	-161.8	0	110.7	E45 L47	E45-K166 HydrophobicContact CB-CB 4.21Å; E45-K166 HydrophobicContact CB-CD 4.33Å; E45-K166 WeakPolarHBondContact O-CB 3.17Å; E45-K166 PolarHBondContact O-N 3.21Å; E45-K166 IonicContact OE2-NZ 3.03Å; E45-K166 PolarHBondContact OE2-NZ 3.23Å; L47-K166 HydrophobicContact CD2-CB 4Å; L47-K166 HydrophobicContact CD2-CD 4.27Å; L47-K166 HydrophobicContact CD2-CG 4.16Å; L47-K166 HydrophobicContact CG-CB 4.25Å
167	I	86.4	Confident	89.2	Confident	19 Å²	19	36.4 Å²	36.4	10%	0.097	18%	0.177	C	C	.	.			trans	-80.9	127.1	173.6	-61.5	176.2	0	0	0	109.9	Y44 E157 V165 G169 I170	Y44-I167 HydrophobicContact CD1-CG1 4.36Å; Y44-I167 HydrophobicContact CE1-CG1 4.14Å; E157-I167 HydrophobicContact CB-CD1 3.99Å; E157-I167 HydrophobicContact CG-CD1 4.2Å; V165-I167 PolarHBondContact O-N 3.18Å; I167-G169 PolarHBondContact O-N 2.92Å; I167-I170 HydrophobicContact CB-CB 4.37Å; I167-I170 HydrophobicContact CB-CG2 4.36Å; I167-I170 HydrophobicContact CG2-CB 4.42Å; I167-I170 WeakPolarHBondContact O-CG2 3.4Å
168	P	83.3	Confident	89.3	Confident	88 Å²	88	36.1 Å²	36.1	57%	0.571	18%	0.177	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.1	135.5	179.8	27.2	-34.3	0	0	0	111.3	I170	P168-I170 VanDerWaalsContact C-N 3.31Å; P168-I170 PolarHBondContact O-N 3.24Å
169	G	81.6	Confident	89.4	Confident	9 Å²	9	36 Å²	36	9%	0.093	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	82.8	-4.1	172.8	0	0	0	0	0	116.2	I167 T175	I167-G169 PolarHBondContact O-N 2.92Å; G169-T175 PolarHBondContact O-OG1 3.25Å
170	I	87.4	Confident	89.6	Confident	2 Å²	2	35.3 Å²	35.3	1%	0.01	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-52.6	-176.3	-168.2	-179.3	0	0	0	113.1	E157 I158 Y161 I167 P168 R172 H201	E157-I170 VanDerWaalsContact C-CD1 3.48Å; E157-I170 HydrophobicContact CB-CD1 3.47Å; E157-I170 VanDerWaalsContact CB-CD1 3.47Å; E157-I170 HydrophobicContact CB-CG1 4.11Å; E157-I170 WeakPolarHBondContact O-CD1 3.34Å; I158-I170 HydrophobicContact CD1-CD1 3.77Å; I158-I170 HydrophobicContact CD1-CG1 4.29Å; Y161-I170 HydrophobicContact CD2-CG2 4.17Å; I167-I170 HydrophobicContact CB-CB 4.37Å; I167-I170 HydrophobicContact CB-CG2 4.36Å; I167-I170 HydrophobicContact CG2-CB 4.42Å; I167-I170 WeakPolarHBondContact O-CG2 3.4Å; P168-I170 VanDerWaalsContact C-N 3.31Å; P168-I170 PolarHBondContact O-N 3.24Å; I170-R172 PolarHBondContact O-N 3.12Å; I170-H201 VanDerWaalsContact CG1-NE2 3.35Å; I170-H201 WeakPolarHBondContact CG1-NE2 3.3Å; I170-H201 PolarHBondContact O-NE2 3.11Å
171	V	87.8	Confident	89.8	Confident	34 Å²	34	36.6 Å²	36.6	21%	0.206	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.2	26.8	-175.3	-71.3	0	0	0	0	114.1	A208	V171-A208 HydrophobicContact CB-CB 3.63Å; V171-A208 HydrophobicContact CG1-CB 3.43Å; V171-A208 VanDerWaalsContact CG1-CB 3.43Å; V171-A208 HydrophobicContact CG2-CB 4.35Å
172	R	88.3	Confident	89.9	Confident	111 Å²	111	36.3 Å²	36.3	42%	0.419	19%	0.185	S	C	.	.			trans	-86.1	146.3	179.2	-67.1	-178	-179.2	177.4	-0.1	111.3	I170 R174 T175 F176	I170-R172 PolarHBondContact O-N 3.12Å; R172-R174 VanDerWaalsContact C-N 3.26Å; R172-R174 PolarHBondContact O-N 3.02Å; R172-T175 WeakPolarHBondContact O-CB 3.44Å; R172-T175 PolarHBondContact O-N 3.04Å; R172-T175 VanDerWaalsContact O-N 3.08Å; R172-F176 PolarHBondContact O-N 3.21Å; R172-F176 VanDerWaalsContact O-N 3.08Å
173	L	88.7	Confident	90.2	Very high	70 Å²	70	36.4 Å²	36.4	37%	0.366	19%	0.185	S	C	.	.	H	α-helix	trans	-59.8	-35.6	174.7	-176.9	63.5	0	0	0	112.5	T175 F176 L177 F218	L173-T175 VanDerWaalsContact C-N 3.32Å; L173-T175 PolarHBondContact O-N 3.41Å; L173-F176 HydrophobicContact CD1-CD1 3.96Å; L173-F176 WeakPolarHBondContact O-CB 3.47Å; L173-F176 PolarHBondContact O-N 3.44Å; L173-L177 PolarHBondContact O-N 2.91Å; L173-F218 HydrophobicContact CD2-CE2 4.42Å
174	R	90.2	Very high	90.5	Very high	138 Å²	138	36.1 Å²	36.1	52%	0.521	18%	0.183	S	C	.	.	H	α-helix	trans	-60.7	-42.6	175	-170.6	-178.1	-172.1	-176.1	7.1	111.7	I146 R172 F176 L177 C178	I146-R174 VanDerWaalsContact CG2-NE 3.33Å; R172-R174 VanDerWaalsContact C-N 3.26Å; R172-R174 PolarHBondContact O-N 3.02Å; R174-F176 VanDerWaalsContact C-N 3.35Å; R174-L177 PolarHBondContact O-N 2.99Å; R174-C178 PolarHBondContact O-N 3.33Å; R174-C178 PolarHBondContact O-SG 3.24Å
175	T	92.4	Very high	90.8	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-63.2	-42.4	176.1	-47	0	0	0	0	110.8	E147 A150 G169 R172 L173 C178 K179 I205	E147-T175 HydrophobicContact CG-CG2 4.31Å; A150-T175 HydrophobicContact CB-CG2 4.41Å; G169-T175 PolarHBondContact O-OG1 3.25Å; R172-T175 WeakPolarHBondContact O-CB 3.44Å; R172-T175 PolarHBondContact O-N 3.04Å; R172-T175 VanDerWaalsContact O-N 3.08Å; L173-T175 VanDerWaalsContact C-N 3.32Å; L173-T175 PolarHBondContact O-N 3.41Å; T175-C178 PolarHBondContact O-N 3.05Å; T175-K179 WeakPolarHBondContact O-CB 3.41Å; T175-K179 PolarHBondContact O-N 2.86Å; T175-I205 HydrophobicContact CG2-CD1 4.44Å
176	F	93.8	Very high	91.1	Very high	35 Å²	35	37.6 Å²	37.6	15%	0.154	19%	0.188	C	C	.	.	H	α-helix	trans	-56.8	-51.1	174.3	169.6	-99.7	0	0	0	112.1	V90 R172 L173 R174 K179 A180 I205 V206	V90-F176 HydrophobicContact CG1-CE2 4.08Å; V90-F176 HydrophobicContact CG1-CZ 4.24Å; V90-F176 HydrophobicContact CG2-CE2 4.08Å; V90-F176 HydrophobicContact CG2-CZ 3.75Å; R172-F176 PolarHBondContact O-N 3.21Å; R172-F176 VanDerWaalsContact O-N 3.08Å; L173-F176 HydrophobicContact CD1-CD1 3.96Å; L173-F176 WeakPolarHBondContact O-CB 3.47Å; L173-F176 PolarHBondContact O-N 3.44Å; R174-F176 VanDerWaalsContact C-N 3.35Å; F176-K179 PolarHBondContact O-N 3.06Å; F176-A180 VanDerWaalsContact O-CB 3.24Å; F176-A180 WeakPolarHBondContact O-CB 3.47Å; F176-A180 PolarHBondContact O-N 3.46Å; F176-I205 HydrophobicContact CB-CB 4.39Å; F176-I205 HydrophobicContact CB-CD1 4.01Å; F176-I205 HydrophobicContact CB-CG2 3.8Å; F176-V206 HydrophobicContact CD2-CG2 4.35Å; F176-V206 HydrophobicContact CE2-CG2 3.87Å; F176-V206 HydrophobicContact CZ-CG2 4.48Å
177	L	93.6	Very high	91.3	Very high	104 Å²	104	34.9 Å²	34.9	55%	0.545	18%	0.178	S	C	.	.	H	α-helix	trans	-63.9	-45.3	-179.9	-66.5	176.4	0	0	0	112.2	L173 R174 K179 A181	L173-L177 PolarHBondContact O-N 2.91Å; R174-L177 PolarHBondContact O-N 2.99Å; L177-K179 VanDerWaalsContact C-N 3.31Å; L177-K179 PolarHBondContact O-N 2.91Å; L177-A181 VanDerWaalsContact O-CB 3.24Å; L177-A181 WeakPolarHBondContact O-CB 3.38Å; L177-A181 PolarHBondContact O-N 3.28Å
178	C	94.1	Very high	91.6	Very high	9 Å²	9	34 Å²	34	6%	0.061	17%	0.174	C	C	.	.	H	α-helix	trans	-64.3	-37.5	179.1	-62.3	0	0	0	0	111.7	E147 A150 R174 T175 G182	E147-C178 HydrophobicContact CB-CB 4.35Å; A150-C178 HydrophobicContact CB-CB 4.19Å; R174-C178 PolarHBondContact O-N 3.33Å; R174-C178 PolarHBondContact O-SG 3.24Å; T175-C178 PolarHBondContact O-N 3.05Å; C178-G182 WeakPolarHBondContact O-CA 3.48Å; C178-G182 PolarHBondContact O-N 3.14Å
179	K	94.7	Very high	92	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-75.6	-46.8	-179.2	-159.3	176.1	-169.8	80.8	0	112.1	A150 G152 S153 T175 F176 L177 G182 V183 P198 H201 P484	A150-K179 HydrophobicContact CB-CB 4.18Å; A150-K179 PolarHBondContact O-NZ 2.88Å; G152-K179 PolarHBondContact O-NZ 3.29Å; S153-K179 VanDerWaalsContact O-CE 3.23Å; S153-K179 WeakPolarHBondContact O-CE 2.97Å; S153-K179 PolarHBondContact O-NZ 3.05Å; T175-K179 WeakPolarHBondContact O-CB 3.41Å; T175-K179 PolarHBondContact O-N 2.86Å; F176-K179 PolarHBondContact O-N 3.06Å; L177-K179 VanDerWaalsContact C-N 3.31Å; L177-K179 PolarHBondContact O-N 2.91Å; K179-G182 PolarHBondContact O-N 3.07Å; K179-V183 WeakPolarHBondContact O-CB 3.36Å; K179-V183 WeakPolarHBondContact O-CG1 3.37Å; K179-V183 PolarHBondContact O-N 2.98Å; K179-P198 HydrophobicContact CG-CB 4.36Å; K179-H201 HydrophobicContact CD-CB 4.02Å; K179-H201 WeakPolarHBondContact CD-ND1 3.42Å; K179-H201 VanDerWaalsContact CE-ND1 3.26Å; K179-H201 WeakPolarHBondContact CE-ND1 3.49Å; K179-P484 HydrophobicContact CG-CB 4.26Å
180	A	93.9	Very high	92.2	Very high	8 Å²	8	30.4 Å²	30.4	7%	0.066	15%	0.152	C	C	.	.	H	α-helix	trans	-65.2	-37.3	178.5	0	0	0	0	0	112.5	F176 V183 L184	F176-A180 VanDerWaalsContact O-CB 3.24Å; F176-A180 WeakPolarHBondContact O-CB 3.47Å; F176-A180 PolarHBondContact O-N 3.46Å; A180-V183 VanDerWaalsContact O-CG1 3.31Å; A180-V183 WeakPolarHBondContact O-CG1 3.41Å; A180-L184 VanDerWaalsContact O-CG 3.31Å; A180-L184 WeakPolarHBondContact O-CG 3.25Å
181	A	94.5	Very high	92.4	Very high	30 Å²	30	30.3 Å²	30.3	25%	0.248	15%	0.152	C	C	.	.	H	α-helix	trans	-78.5	-40.9	175	0	0	0	0	0	112.5	L143 L177 V183 L184 F185	L143-A181 HydrophobicContact CD1-CB 3.78Å; L177-A181 VanDerWaalsContact O-CB 3.24Å; L177-A181 WeakPolarHBondContact O-CB 3.38Å; L177-A181 PolarHBondContact O-N 3.28Å; A181-V183 VanDerWaalsContact C-N 3.33Å; A181-V183 PolarHBondContact O-N 2.96Å; A181-L184 WeakPolarHBondContact O-CB 3.44Å; A181-L184 WeakPolarHBondContact O-CG 3.44Å; A181-L184 PolarHBondContact O-N 3.06Å; A181-F185 VanDerWaalsContact O-CD2 3.25Å; A181-F185 WeakPolarHBondContact O-CD2 3.49Å
182	G	94.6	Very high	92.6	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-66.9	-32.4	-178.5	0	0	0	0	0	113.3	C178 K179 L184 F185 S186	C178-G182 WeakPolarHBondContact O-CA 3.48Å; C178-G182 PolarHBondContact O-N 3.14Å; K179-G182 PolarHBondContact O-N 3.07Å; G182-L184 VanDerWaalsContact C-N 3.31Å; G182-L184 PolarHBondContact O-N 3.46Å; G182-F185 PolarHBondContact O-N 2.91Å; G182-S186 WeakPolarHBondContact O-CB 3.16Å; G182-S186 PolarHBondContact O-N 2.77Å; G182-S186 PolarHBondContact O-OG 3.36Å
183	V	94.6	Very high	92.9	Very high	4 Å²	4	24.2 Å²	24.2	2%	0.024	13%	0.126	C	C	.	.	H	α-helix	trans	-64.2	-36.5	175.3	70.9	0	0	0	0	111.9	V94 K179 A180 A181 F185 S186 V187 K195 P198 P484	V94-V183 HydrophobicContact CG1-CG1 4.03Å; V94-V183 HydrophobicContact CG2-CG1 4.35Å; K179-V183 WeakPolarHBondContact O-CB 3.36Å; K179-V183 WeakPolarHBondContact O-CG1 3.37Å; K179-V183 PolarHBondContact O-N 2.98Å; A180-V183 VanDerWaalsContact O-CG1 3.31Å; A180-V183 WeakPolarHBondContact O-CG1 3.41Å; A181-V183 VanDerWaalsContact C-N 3.33Å; A181-V183 PolarHBondContact O-N 2.96Å; V183-F185 VanDerWaalsContact C-N 3.34Å; V183-F185 PolarHBondContact O-N 3.3Å; V183-S186 WeakPolarHBondContact CA-OG 3.37Å; V183-S186 PolarHBondContact O-N 3.25Å; V183-S186 PolarHBondContact O-OG 3.01Å; V183-V187 HydrophobicContact CG2-CG2 4.13Å; V183-V187 WeakPolarHBondContact O-CG2 3.21Å; V183-V187 PolarHBondContact O-N 3.15Å; V183-K195 HydrophobicContact CG2-CB 3.82Å; V183-P198 HydrophobicContact CB-CB 4.25Å; V183-P198 HydrophobicContact CB-CG 4.44Å; V183-P198 HydrophobicContact CG2-CB 4.05Å; V183-P198 HydrophobicContact CG2-CG 3.9Å; V183-P484 HydrophobicContact CB-CB 4.38Å
184	L	94.9	Very high	93	Very high	9 Å²	9	21.1 Å²	21.1	5%	0.047	11%	0.111	C	C	.	.	H	α-helix	trans	-54.8	-52.1	177.9	-49	178.3	0	0	0	110.9	F93 V94 F97 V98 F101 A180 A181 G182 A188	F93-L184 HydrophobicContact CE1-CD1 4.06Å; V94-L184 HydrophobicContact CB-CD2 4.07Å; V94-L184 HydrophobicContact CG1-CD2 3.94Å; V94-L184 HydrophobicContact CG2-CD2 4.06Å; F97-L184 HydrophobicContact CB-CD1 4.09Å; F97-L184 HydrophobicContact CB-CD2 4.2Å; V98-L184 HydrophobicContact CG2-CB 4.41Å; V98-L184 HydrophobicContact CG2-CD2 3.98Å; F101-L184 HydrophobicContact CE2-CB 4.42Å; A180-L184 VanDerWaalsContact O-CG 3.31Å; A180-L184 WeakPolarHBondContact O-CG 3.25Å; A181-L184 WeakPolarHBondContact O-CB 3.44Å; A181-L184 WeakPolarHBondContact O-CG 3.44Å; A181-L184 PolarHBondContact O-N 3.06Å; G182-L184 VanDerWaalsContact C-N 3.31Å; G182-L184 PolarHBondContact O-N 3.46Å; L184-A188 WeakPolarHBondContact O-CB 3.48Å; L184-A188 PolarHBondContact O-N 3.32Å
185	F	95.3	Very high	93.1	Very high	38 Å²	38	14.8 Å²	14.8	17%	0.167	9%	0.087	C	C	.	.	H	α-helix	trans	-75.9	-32.1	-176.7	-62	-65.9	0	0	0	112.4	F101 F136 I139 A140 L143 A181 G182 V183 G189	F101-F185 HydrophobicContact CD2-CE1 4.4Å; F101-F185 HydrophobicContact CE2-CD1 4.34Å; F101-F185 AromaticContact CE2-CE1 3.81Å; F101-F185 HydrophobicContact CE2-CE1 3.81Å; F101-F185 HydrophobicContact CE2-CZ 4.27Å; F101-F185 HydrophobicContact CZ-CE1 4.19Å; F136-F185 HydrophobicContact CB-CB 4.32Å; F136-F185 WeakPolarHBondContact CB-O 3.47Å; F136-F185 AromaticContact CD1-CD1 3.79Å; F136-F185 HydrophobicContact CD1-CD1 3.79Å; F136-F185 HydrophobicContact CD1-CE1 4.34Å; F136-F185 HydrophobicContact CE1-CD1 4.39Å; F136-F185 HydrophobicContact CG-CD1 4.41Å; F136-F185 WeakPolarHBondContact O-CB 3.35Å; I139-F185 HydrophobicContact CB-CD2 4.35Å; I139-F185 HydrophobicContact CB-CG 4.34Å; I139-F185 HydrophobicContact CD1-CE1 4.43Å; I139-F185 HydrophobicContact CG2-CD1 4.5Å; I139-F185 HydrophobicContact CG2-CD2 3.58Å; I139-F185 HydrophobicContact CG2-CE2 3.63Å; I139-F185 HydrophobicContact CG2-CG 4.04Å; I139-F185 HydrophobicContact CG2-CZ 4.13Å; A140-F185 HydrophobicContact CB-CB 3.96Å; L143-F185 HydrophobicContact CD1-CD2 4.47Å; A181-F185 VanDerWaalsContact O-CD2 3.25Å; A181-F185 WeakPolarHBondContact O-CD2 3.49Å; G182-F185 PolarHBondContact O-N 2.91Å; V183-F185 VanDerWaalsContact C-N 3.34Å; V183-F185 PolarHBondContact O-N 3.3Å; F185-G189 WeakPolarHBondContact O-CA 3.29Å; F185-G189 PolarHBondContact O-N 3.27Å
186	S	94.7	Very high	93	Very high	0 Å²	0	14.9 Å²	14.9	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-64.4	-41.8	176.1	71.9	0	0	0	0	112.6	G182 V183 P484	G182-S186 WeakPolarHBondContact O-CB 3.16Å; G182-S186 PolarHBondContact O-N 2.77Å; G182-S186 PolarHBondContact O-OG 3.36Å; V183-S186 WeakPolarHBondContact CA-OG 3.37Å; V183-S186 PolarHBondContact O-N 3.25Å; V183-S186 PolarHBondContact O-OG 3.01Å; S186-P484 WeakPolarHBondContact CB-O 3.2Å; S186-P484 PolarHBondContact OG-O 3.01Å
187	V	93.1	Very high	92.9	Very high	25 Å²	25	13.2 Å²	13.2	15%	0.152	8%	0.08	C	C	.	.	H	α-helix	trans	-76.7	-45.4	179.2	177.7	0	0	0	0	110.1	V98 V183 G189 G190 V193 K195	V98-V187 HydrophobicContact CG1-CB 4.26Å; V98-V187 HydrophobicContact CG1-CG1 3.67Å; V98-V187 HydrophobicContact CG2-CB 4.45Å; V183-V187 HydrophobicContact CG2-CG2 4.13Å; V183-V187 WeakPolarHBondContact O-CG2 3.21Å; V183-V187 PolarHBondContact O-N 3.15Å; V187-G189 PolarHBondContact O-N 3.45Å; V187-G190 PolarHBondContact O-N 3.36Å; V187-G190 VanDerWaalsContact O-N 3.1Å; V187-V193 HydrophobicContact CG2-CG2 4.05Å; V187-K195 HydrophobicContact CG2-CB 4.21Å
188	A	92.3	Very high	92.9	Very high	0 Å²	0	8.3 Å²	8.3	0%	0	6%	0.055	C	C	.	.	H	α-helix	trans	-62	-30.5	175.5	0	0	0	0	0	112.4	F101 K105 F136 L184 G190	F101-A188 HydrophobicContact CB-CB 3.76Å; F101-A188 HydrophobicContact CD2-CB 4.44Å; K105-A188 PolarHBondContact NZ-O 3.08Å; F136-A188 HydrophobicContact CD2-CB 3.98Å; F136-A188 HydrophobicContact CE2-CB 4.15Å; L184-A188 WeakPolarHBondContact O-CB 3.48Å; L184-A188 PolarHBondContact O-N 3.32Å; A188-G190 PolarHBondContact O-N 2.84Å; A188-G190 VanDerWaalsContact O-N 3.16Å
189	G	90.9	Very high	92.9	Very high	0 Å²	0	8.2 Å²	8.2	0%	0	5%	0.053	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.2	0.1	175.3	0	0	0	0	0	115.2	N133 F185 V187 L191	N133-G189 VanDerWaalsContact CB-O 3.24Å; N133-G189 WeakPolarHBondContact CB-O 3.47Å; N133-G189 VanDerWaalsContact OD1-C 3.27Å; N133-G189 PolarHBondContact OD1-O 3.12Å; F185-G189 WeakPolarHBondContact O-CA 3.29Å; F185-G189 PolarHBondContact O-N 3.27Å; V187-G189 PolarHBondContact O-N 3.45Å; G189-L191 PolarHBondContact O-N 3.06Å
190	G	87.5	Confident	92.9	Very high	21 Å²	21	8.2 Å²	8.2	22%	0.216	5%	0.053	C	C	.	.	T	Hydrogen-bonded Turn	trans	73.3	12.6	173.7	0	0	0	0	0	114.7	V187 A188	V187-G190 PolarHBondContact O-N 3.36Å; V187-G190 VanDerWaalsContact O-N 3.1Å; A188-G190 PolarHBondContact O-N 2.84Å; A188-G190 VanDerWaalsContact O-N 3.16Å
191	L	91.8	Very high	93	Very high	1 Å²	1	7.9 Å²	7.9	1%	0.005	5%	0.05	C	C	.	.			trans	-66.1	150.4	169	-67.8	177.8	0	0	0	109.9	V137 G189 V193 V377 A378 Q445 T478 V483	V137-L191 HydrophobicContact CG1-CD1 4.17Å; V137-L191 HydrophobicContact CG2-CD1 3.69Å; V137-L191 HydrophobicContact CG2-CD2 4.34Å; V137-L191 HydrophobicContact CG2-CG 3.77Å; G189-L191 PolarHBondContact O-N 3.06Å; L191-V193 HydrophobicContact CB-CG1 4Å; L191-V193 HydrophobicContact CB-CG2 4.03Å; L191-V193 PolarHBondContact O-N 3.31Å; L191-V377 HydrophobicContact CD2-CG1 4.24Å; L191-A378 HydrophobicContact CD2-CB 4.04Å; L191-Q445 PolarHBondContact O-NE2 3.23Å; L191-Q445 VanDerWaalsContact O-NE2 3.14Å; L191-T478 HydrophobicContact CB-CG2 4.03Å; L191-T478 HydrophobicContact CD2-CG2 4.3Å; L191-V483 HydrophobicContact CD1-CG2 3.98Å
192	F	92	Very high	93	Very high	15 Å²	15	6.6 Å²	6.6	7%	0.066	4%	0.04	C	C	.	.	S	Bend	trans	-77.6	68.7	175.4	-61.1	-30.8	0	0	0	111.2	I385 F441 Y471 L474 A475 P490	F192-I385 HydrophobicContact CE1-CD1 3.76Å; F192-I385 HydrophobicContact CE2-CD1 4.49Å; F192-I385 HydrophobicContact CZ-CD1 3.48Å; F192-I385 VanDerWaalsContact CZ-CD1 3.48Å; F192-I385 HydrophobicContact CZ-CG1 3.93Å; F192-F441 HydrophobicContact CE1-CD1 4.48Å; F192-F441 HydrophobicContact CZ-CD1 4.09Å; F192-F441 AromaticContact CZ-CE1 3.86Å; F192-F441 HydrophobicContact CZ-CE1 3.86Å; F192-Y471 HydrophobicContact CB-CE2 4.41Å; F192-Y471 HydrophobicContact CD1-CD2 4.24Å; F192-Y471 AromaticContact CD1-CE2 3.49Å; F192-Y471 HydrophobicContact CD1-CE2 3.49Å; F192-Y471 VanDerWaalsContact CD1-CE2 3.49Å; F192-Y471 HydrophobicContact CD2-CD2 4.2Å; F192-Y471 HydrophobicContact CD2-CE2 4.07Å; F192-Y471 HydrophobicContact CE1-CD2 4.01Å; F192-Y471 AromaticContact CE1-CE2 3.6Å; F192-Y471 HydrophobicContact CE1-CE2 3.6Å; F192-Y471 AromaticContact CE2-CD2 3.95Å; F192-Y471 HydrophobicContact CE2-CD2 3.95Å; F192-Y471 HydrophobicContact CE2-CE2 4.14Å; F192-Y471 HydrophobicContact CG-CD2 4.33Å; F192-Y471 AromaticContact CG-CE2 3.74Å; F192-Y471 HydrophobicContact CG-CE2 3.74Å; F192-Y471 AromaticContact CG-CZ 3.98Å; F192-Y471 AromaticContact CZ-CD2 3.85Å; F192-Y471 HydrophobicContact CZ-CD2 3.85Å; F192-Y471 AromaticContact CZ-CE2 3.93Å; F192-Y471 HydrophobicContact CZ-CE2 3.93Å; F192-L474 HydrophobicContact CD2-CB 3.51Å; F192-L474 HydrophobicContact CE2-CB 3.41Å; F192-L474 VanDerWaalsContact CE2-CB 3.41Å; F192-L474 HydrophobicContact CE2-CD1 3.6Å; F192-L474 HydrophobicContact CE2-CG 4.15Å; F192-L474 HydrophobicContact CZ-CD1 4.34Å; F192-A475 HydrophobicContact CB-CB 4.31Å; F192-P490 WeakPolarHBondContact O-CG 3.44Å
193	V	93	Very high	93	Very high	2 Å²	2	6.6 Å²	6.6	1%	0.012	4%	0.04	C	C	.	.			trans	-133.4	148.9	-178.2	-56.8	0	0	0	0	109.9	V187 L191 Q445 T478	V187-V193 HydrophobicContact CG2-CG2 4.05Å; L191-V193 HydrophobicContact CB-CG1 4Å; L191-V193 HydrophobicContact CB-CG2 4.03Å; L191-V193 PolarHBondContact O-N 3.31Å; V193-Q445 PolarHBondContact O-NE2 2.92Å; V193-T478 HydrophobicContact CG1-CG2 3.54Å
194	G	91.2	Very high	93	Very high	4 Å²	4	6.4 Å²	6.4	4%	0.041	4%	0.039	C	C	.	.	B	Isolated β-bridge	trans	-104.9	152.5	173.4	0	0	0	0	0	113.1	G486	G194-G486 PolarHBondContact N-O 3.05Å; G194-G486 VanDerWaalsContact O-CA 3.25Å; G194-G486 WeakPolarHBondContact O-CA 3.33Å; G194-G486 PolarHBondContact O-N 2.02Å
195	K	92.1	Very high	93	Very high	6 Å²	6	6.3 Å²	6.3	3%	0.026	4%	0.038	C	C	.	.	S	Bend	trans	-81.5	-18.4	173.8	62.1	-168.7	178.3	-163.4	0	114.1	V94 D95 V183 V187 G197 P198 M199 E446	V94-K195 HydrophobicContact CG1-CB 4.17Å; V94-K195 HydrophobicContact CG1-CD 4.19Å; D95-K195 IonicContact OD1-NZ 3.88Å; D95-K195 PolarHBondContact OD1-NZ 3.29Å; V183-K195 HydrophobicContact CG2-CB 3.82Å; V187-K195 HydrophobicContact CG2-CB 4.21Å; K195-G197 PolarHBondContact O-N 3.44Å; K195-P198 WeakPolarHBondContact O-CD 3.13Å; K195-M199 PolarHBondContact O-N 2.8Å; K195-M199 VanDerWaalsContact O-N 3.15Å; K195-E446 WeakPolarHBondContact CE-OE1 3.38Å; K195-E446 IonicContact NZ-OE1 3.07Å; K195-E446 PolarHBondContact NZ-OE1 2.95Å; K195-E446 IonicContact NZ-OE2 3.31Å
196	E	90.8	Very high	93	Very high	1 Å²	1	5.4 Å²	5.4	1%	0.005	4%	0.036	C	C	.	.	H	α-helix	trans	-63.6	-43.2	-173.3	-50.1	-41.6	141.6	0	0	114.1	M199 I200 A249 F250 L307 V489	E196-M199 VanDerWaalsContact O-CB 3.27Å; E196-M199 WeakPolarHBondContact O-CB 3.37Å; E196-M199 PolarHBondContact O-N 2.66Å; E196-I200 PolarHBondContact O-N 2.66Å; E196-A249 HydrophobicContact CB-CB 3.9Å; E196-A249 HydrophobicContact CG-CB 4.29Å; E196-A249 WeakPolarHBondContact OE2-CA 3.46Å; E196-A249 WeakPolarHBondContact OE2-CB 3.37Å; E196-F250 HydrophobicContact CB-CE1 4.44Å; E196-F250 HydrophobicContact CB-CE2 4.39Å; E196-F250 HydrophobicContact CB-CZ 3.95Å; E196-F250 HydrophobicContact CG-CE1 4.27Å; E196-F250 HydrophobicContact CG-CZ 4.28Å; E196-L307 VanDerWaalsContact OE2-CD1 3.27Å; E196-L307 WeakPolarHBondContact OE2-CD1 3.38Å; E196-V489 HydrophobicContact CG-CG2 3.9Å
197	G	91.1	Very high	92.9	Very high	0 Å²	0	5.4 Å²	5.4	0%	0	4%	0.036	C	C	.	.	H	α-helix	trans	-62.5	-51.9	178.9	0	0	0	0	0	113	S153 K195 M199 I200	S153-G197 CarbonylContact O-C 3.07Å; S153-G197 WeakPolarHBondContact OG-CA 3.48Å; K195-G197 PolarHBondContact O-N 3.44Å; G197-M199 PolarHBondContact O-N 3.38Å; G197-I200 WeakPolarHBondContact O-CB 3.41Å; G197-I200 PolarHBondContact O-N 2.78Å
198	P	94.4	Very high	92.8	Very high	2 Å²	2	4.3 Å²	4.3	1%	0.013	3%	0.029	C	C	.	.	H	α-helix	trans	-55.1	-31.2	171.1	-30.5	37.2	0	0	0	114.5	S153 K179 V183 K195 I200 H201 S202	S153-P198 WeakPolarHBondContact O-CA 3.07Å; K179-P198 HydrophobicContact CG-CB 4.36Å; V183-P198 HydrophobicContact CB-CB 4.25Å; V183-P198 HydrophobicContact CB-CG 4.44Å; V183-P198 HydrophobicContact CG2-CB 4.05Å; V183-P198 HydrophobicContact CG2-CG 3.9Å; K195-P198 WeakPolarHBondContact O-CD 3.13Å; P198-I200 VanDerWaalsContact C-N 3.35Å; P198-I200 PolarHBondContact O-N 2.9Å; P198-H201 PolarHBondContact O-N 3.27Å; P198-S202 PolarHBondContact O-N 3.29Å; P198-S202 PolarHBondContact O-OG 3.27Å
199	M	94.3	Very high	92.6	Very high	6 Å²	6	6 Å²	6	3%	0.03	5%	0.047	C	C	.	.	H	α-helix	trans	-62.7	-39.4	177.2	-171.7	56.7	-166	0	0	112.4	V87 V90 K195 E196 G197 H201 S202 G203 A248 L307	V87-M199 HydrophobicContact CG1-CE 3.5Å; V87-M199 WeakPolarHBondContact O-CE 3.29Å; V90-M199 HydrophobicContact CB-CE 4.49Å; V90-M199 HydrophobicContact CG1-SD 4.33Å; K195-M199 PolarHBondContact O-N 2.8Å; K195-M199 VanDerWaalsContact O-N 3.15Å; E196-M199 VanDerWaalsContact O-CB 3.27Å; E196-M199 WeakPolarHBondContact O-CB 3.37Å; E196-M199 PolarHBondContact O-N 2.66Å; G197-M199 PolarHBondContact O-N 3.38Å; M199-H201 PolarHBondContact O-N 3.12Å; M199-S202 PolarHBondContact O-N 2.88Å; M199-G203 PolarHBondContact O-N 2.89Å; M199-A248 HydrophobicContact CE-CB 3.9Å; M199-L307 HydrophobicContact CG-CD1 4.36Å
200	I	94.6	Very high	92.4	Very high	1 Å²	1	7.4 Å²	7.4	1%	0.005	5%	0.054	C	C	.	.	H	α-helix	trans	-61	-45.2	175.9	-57.8	170	0	0	0	110.8	I155 E196 G197 P198 G203 A204 A242 V246 F259	I155-I200 HydrophobicContact CD1-CD1 3.8Å; I155-I200 HydrophobicContact CG1-CB 4.48Å; I155-I200 HydrophobicContact CG1-CD1 4.09Å; E196-I200 PolarHBondContact O-N 2.66Å; G197-I200 WeakPolarHBondContact O-CB 3.41Å; G197-I200 PolarHBondContact O-N 2.78Å; P198-I200 VanDerWaalsContact C-N 3.35Å; P198-I200 PolarHBondContact O-N 2.9Å; I200-G203 PolarHBondContact O-N 3.43Å; I200-A204 PolarHBondContact O-N 3.26Å; I200-A242 HydrophobicContact CG2-CB 4.17Å; I200-V246 HydrophobicContact CD1-CG2 3.6Å; I200-V246 HydrophobicContact CG1-CB 4.49Å; I200-V246 HydrophobicContact CG1-CG2 3.61Å; I200-V246 HydrophobicContact CG2-CG2 4.23Å; I200-F259 HydrophobicContact CD1-CE1 4.4Å; I200-F259 HydrophobicContact CD1-CZ 4.21Å; I200-F259 HydrophobicContact CG2-CE1 4.03Å
201	H	95.2	Very high	92.2	Very high	0 Å²	0	6.6 Å²	6.6	0%	0	5%	0.045	C	C	.	.	H	α-helix	trans	-67	-43.8	177.2	-172.1	-179.7	0	0	0	111.2	G154 I158 I170 K179 P198 M199 G203 A204 I205	G154-H201 VanDerWaalsContact CA-ND1 3.33Å; G154-H201 WeakPolarHBondContact CA-ND1 3.17Å; I158-H201 HydrophobicContact CG1-CB 4.32Å; I170-H201 VanDerWaalsContact CG1-NE2 3.35Å; I170-H201 WeakPolarHBondContact CG1-NE2 3.3Å; I170-H201 PolarHBondContact O-NE2 3.11Å; K179-H201 HydrophobicContact CD-CB 4.02Å; K179-H201 WeakPolarHBondContact CD-ND1 3.42Å; K179-H201 VanDerWaalsContact CE-ND1 3.26Å; K179-H201 WeakPolarHBondContact CE-ND1 3.49Å; P198-H201 PolarHBondContact O-N 3.27Å; M199-H201 PolarHBondContact O-N 3.12Å; H201-G203 VanDerWaalsContact C-N 3.29Å; H201-G203 PolarHBondContact O-N 3.13Å; H201-A204 WeakPolarHBondContact O-CB 3.39Å; H201-A204 PolarHBondContact O-N 3.36Å; H201-A204 VanDerWaalsContact O-N 3.17Å; H201-I205 WeakPolarHBondContact O-CG1 3.26Å; H201-I205 PolarHBondContact O-N 3.36Å
202	S	95.1	Very high	91.5	Very high	3 Å²	3	8 Å²	8	2%	0.021	5%	0.051	C	C	.	.	H	α-helix	trans	-57.1	-43.3	174.7	-65.8	0	0	0	0	111.7	P198 M199 I205 V206	P198-S202 PolarHBondContact O-N 3.29Å; P198-S202 PolarHBondContact O-OG 3.27Å; M199-S202 PolarHBondContact O-N 2.88Å; S202-I205 PolarHBondContact O-N 3.47Å; S202-V206 WeakPolarHBondContact O-CG2 3.46Å; S202-V206 PolarHBondContact O-N 3.08Å
203	G	95.3	Very high	90.3	Very high	1 Å²	1	11.2 Å²	11.2	1%	0.01	7%	0.066	C	C	.	.	H	α-helix	trans	-61	-43.5	175	0	0	0	0	0	113.2	M199 I200 H201 I205 V206 G207 G241	M199-G203 PolarHBondContact O-N 2.89Å; I200-G203 PolarHBondContact O-N 3.43Å; H201-G203 VanDerWaalsContact C-N 3.29Å; H201-G203 PolarHBondContact O-N 3.13Å; G203-I205 PolarHBondContact O-N 3.25Å; G203-V206 PolarHBondContact O-N 2.8Å; G203-G207 PolarHBondContact O-N 3.12Å; G203-G241 VanDerWaalsContact C-C 3.41Å; G203-G241 CarbonylContact C-O 3.16Å; G203-G241 WeakPolarHBondContact CA-O 2.96Å; G203-G241 CarbonylContact O-C 3.33Å; G203-G241 WeakPolarHBondContact O-CA 3.22Å
204	A	94.6	Very high	88.5	Confident	0 Å²	0	14.7 Å²	14.7	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-62.3	-39	174	0	0	0	0	0	113.3	I158 I200 H201 G207 A208 V238 A242	I158-A204 HydrophobicContact CD1-CB 3.3Å; I158-A204 HydrophobicContact CG1-CB 3.83Å; I158-A204 HydrophobicContact CG2-CB 4.3Å; I200-A204 PolarHBondContact O-N 3.26Å; H201-A204 WeakPolarHBondContact O-CB 3.39Å; H201-A204 PolarHBondContact O-N 3.36Å; H201-A204 VanDerWaalsContact O-N 3.17Å; A204-G207 PolarHBondContact O-N 3.12Å; A204-A208 PolarHBondContact O-N 3.31Å; A204-V238 HydrophobicContact CB-CG1 3.95Å; A204-A242 HydrophobicContact CB-CB 4.32Å
205	I	94.8	Very high	86.6	Confident	7 Å²	7	16.4 Å²	16.4	4%	0.036	9%	0.093	C	C	.	.	H	α-helix	trans	-66.3	-41.3	176.4	-59.2	163.9	0	0	0	110.7	T175 F176 H201 S202 G203 A208 G209	T175-I205 HydrophobicContact CG2-CD1 4.44Å; F176-I205 HydrophobicContact CB-CB 4.39Å; F176-I205 HydrophobicContact CB-CD1 4.01Å; F176-I205 HydrophobicContact CB-CG2 3.8Å; H201-I205 WeakPolarHBondContact O-CG1 3.26Å; H201-I205 PolarHBondContact O-N 3.36Å; S202-I205 PolarHBondContact O-N 3.47Å; G203-I205 PolarHBondContact O-N 3.25Å; I205-A208 PolarHBondContact O-N 2.96Å; I205-G209 PolarHBondContact O-N 3.33Å
206	V	94.4	Very high	84.7	Confident	19 Å²	19	21.3 Å²	21.3	12%	0.115	12%	0.119	C	C	.	.	H	α-helix	trans	-61.7	-44.5	175	172.2	0	0	0	0	110.7	I83 T86 V87 F176 S202 G203 A208 G209 L210	I83-V206 HydrophobicContact CG2-CG1 4.47Å; T86-V206 VanDerWaalsContact OG1-CG1 3.25Å; T86-V206 WeakPolarHBondContact OG1-CG1 3.43Å; V87-V206 HydrophobicContact CG2-CB 4Å; V87-V206 HydrophobicContact CG2-CG1 3.85Å; F176-V206 HydrophobicContact CD2-CG2 4.35Å; F176-V206 HydrophobicContact CE2-CG2 3.87Å; F176-V206 HydrophobicContact CZ-CG2 4.48Å; S202-V206 WeakPolarHBondContact O-CG2 3.46Å; S202-V206 PolarHBondContact O-N 3.08Å; G203-V206 PolarHBondContact O-N 2.8Å; V206-A208 VanDerWaalsContact C-N 3.33Å; V206-A208 PolarHBondContact O-N 3.48Å; V206-G209 PolarHBondContact O-N 3.12Å; V206-L210 HydrophobicContact CG1-CD1 3.39Å; V206-L210 HydrophobicContact CG1-CG 3.96Å; V206-L210 WeakPolarHBondContact O-CB 3.31Å; V206-L210 WeakPolarHBondContact O-CG 3.48Å; V206-L210 PolarHBondContact O-N 3.5Å
207	G	93.1	Very high	82.7	Confident	0 Å²	0	26.2 Å²	26.2	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-62.4	-34.2	174.6	0	0	0	0	0	114	G203 A204 P211 F237	G203-G207 PolarHBondContact O-N 3.12Å; A204-G207 PolarHBondContact O-N 3.12Å; G207-P211 WeakPolarHBondContact O-CD 3.43Å; G207-P211 VanDerWaalsContact O-CG 3.25Å; G207-P211 WeakPolarHBondContact O-CG 3.4Å; G207-F237 VanDerWaalsContact O-CB 3.22Å; G207-F237 WeakPolarHBondContact O-CB 3.42Å
208	A	90.9	Very high	80.7	Confident	1 Å²	1	32.8 Å²	32.8	1%	0.008	18%	0.177	C	C	.	.	H	α-helix	trans	-76	-34.9	173.9	0	0	0	0	0	113.6	V171 A204 I205 V206 Q212 V238	V171-A208 HydrophobicContact CB-CB 3.63Å; V171-A208 HydrophobicContact CG1-CB 3.43Å; V171-A208 VanDerWaalsContact CG1-CB 3.43Å; V171-A208 HydrophobicContact CG2-CB 4.35Å; A204-A208 PolarHBondContact O-N 3.31Å; I205-A208 PolarHBondContact O-N 2.96Å; V206-A208 VanDerWaalsContact C-N 3.33Å; V206-A208 PolarHBondContact O-N 3.48Å; A208-Q212 WeakPolarHBondContact O-CG 2.86Å; A208-V238 HydrophobicContact CB-CG2 3.58Å
209	G	88.1	Confident	78.8	Confident	36 Å²	36	41.5 Å²	41.5	37%	0.371	22%	0.215	S	C	.	.	H	α-helix	trans	-87.3	-43.6	-169.2	0	0	0	0	0	113.8	I205 V206 Q212 F213	I205-G209 PolarHBondContact O-N 3.33Å; V206-G209 PolarHBondContact O-N 3.12Å; G209-Q212 PolarHBondContact O-N 2.93Å; G209-F213 PolarHBondContact O-N 3.26Å; G209-F213 VanDerWaalsContact O-N 3.15Å
210	L	86.8	Confident	76.4	Confident	29 Å²	29	52.8 Å²	52.8	15%	0.152	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62	-51.4	-176.7	-69.3	174.4	0	0	0	112.3	V82 I83 T86 V206 Q212 F213	V82-L210 HydrophobicContact CG1-CD1 4.33Å; I83-L210 HydrophobicContact CB-CD1 4.45Å; I83-L210 HydrophobicContact CG1-CB 4.29Å; I83-L210 HydrophobicContact CG1-CD1 3.87Å; T86-L210 HydrophobicContact CG2-CD1 4.08Å; T86-L210 VanDerWaalsContact OG1-CD1 3.25Å; T86-L210 WeakPolarHBondContact OG1-CD1 3.37Å; V206-L210 HydrophobicContact CG1-CD1 3.39Å; V206-L210 HydrophobicContact CG1-CG 3.96Å; V206-L210 WeakPolarHBondContact O-CB 3.31Å; V206-L210 WeakPolarHBondContact O-CG 3.48Å; V206-L210 PolarHBondContact O-N 3.5Å; L210-Q212 PolarHBondContact O-N 3.39Å; L210-F213 HydrophobicContact CB-CE2 4.17Å; L210-F213 HydrophobicContact CB-CZ 4.38Å; L210-F213 HydrophobicContact CD2-CE1 3.87Å; L210-F213 HydrophobicContact CD2-CE2 4Å; L210-F213 HydrophobicContact CD2-CZ 3.35Å; L210-F213 HydrophobicContact CG-CZ 4.45Å; L210-F213 WeakPolarHBondContact O-CD2 3.35Å; L210-F213 VanDerWaalsContact O-CE2 3.22Å; L210-F213 WeakPolarHBondContact O-CE2 3.31Å; L210-F213 WeakPolarHBondContact O-CG 3.42Å; L210-F213 PolarHBondContact O-N 3.25Å; L210-F213 VanDerWaalsContact O-N 3.12Å
211	P	82.1	Confident	74.3	Confident	4 Å²	4	56.6 Å²	56.6	3%	0.026	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-22.6	-178	-22.4	34.6	0	0	0	114	I83 G207 F228 F237	I83-P211 HydrophobicContact CD1-CG 4.03Å; G207-P211 WeakPolarHBondContact O-CD 3.43Å; G207-P211 VanDerWaalsContact O-CG 3.25Å; G207-P211 WeakPolarHBondContact O-CG 3.4Å; P211-F228 HydrophobicContact CB-CB 4.31Å; P211-F237 HydrophobicContact CB-CD2 3.65Å; P211-F237 HydrophobicContact CB-CE2 3.78Å; P211-F237 HydrophobicContact CB-CG 4.24Å; P211-F237 HydrophobicContact CB-CZ 4.41Å; P211-F237 HydrophobicContact CG-CB 3.79Å; P211-F237 HydrophobicContact CG-CD1 4.04Å; P211-F237 HydrophobicContact CG-CD2 3.42Å; P211-F237 VanDerWaalsContact CG-CD2 3.42Å; P211-F237 HydrophobicContact CG-CE1 4.46Å; P211-F237 HydrophobicContact CG-CE2 3.94Å; P211-F237 HydrophobicContact CG-CG 3.5Å; P211-F237 VanDerWaalsContact CG-CG 3.5Å; P211-F237 HydrophobicContact CG-CZ 4.43Å
212	Q	77	Confident	72.1	Confident	30 Å²	30	64.3 Å²	64.3	14%	0.14	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-35.2	179.7	-60.3	-165.1	-32.5	0	0	112.1	A208 G209 L210 Q214 K234 Y780	A208-Q212 WeakPolarHBondContact O-CG 2.86Å; G209-Q212 PolarHBondContact O-N 2.93Å; L210-Q212 PolarHBondContact O-N 3.39Å; Q212-Q214 PolarHBondContact O-N 3.35Å; Q212-K234 VanDerWaalsContact NE2-CD 3.3Å; Q212-Y780 VanDerWaalsContact NE2-CE1 3.35Å
213	F	66.7	Low	70	Confident	83 Å²	83	70.3 Å²	70.3	36%	0.364	34%	0.34	S	S	.	.			trans	40.1	11	-178.7	-93	-60.9	0	0	0	117.7	G209 L210 S215	G209-F213 PolarHBondContact O-N 3.26Å; G209-F213 VanDerWaalsContact O-N 3.15Å; L210-F213 HydrophobicContact CB-CE2 4.17Å; L210-F213 HydrophobicContact CB-CZ 4.38Å; L210-F213 HydrophobicContact CD2-CE1 3.87Å; L210-F213 HydrophobicContact CD2-CE2 4Å; L210-F213 HydrophobicContact CD2-CZ 3.35Å; L210-F213 HydrophobicContact CG-CZ 4.45Å; L210-F213 WeakPolarHBondContact O-CD2 3.35Å; L210-F213 VanDerWaalsContact O-CE2 3.22Å; L210-F213 WeakPolarHBondContact O-CE2 3.31Å; L210-F213 WeakPolarHBondContact O-CG 3.42Å; L210-F213 PolarHBondContact O-N 3.25Å; L210-F213 VanDerWaalsContact O-N 3.12Å; F213-S215 PolarHBondContact O-N 2.72Å
214	Q	56.6	Low	68	Low	75 Å²	75	75.2 Å²	75.2	35%	0.35	37%	0.366	S	S	.	.			trans	-93.7	85.8	164.5	-77.4	-175.7	-20.2	0	0	107.7	Q212 I216 R229	Q212-Q214 PolarHBondContact O-N 3.35Å; Q214-I216 PolarHBondContact O-N 2.92Å; Q214-I216 VanDerWaalsContact O-N 3.1Å; Q214-R229 VanDerWaalsContact NE2-NH2 3.15Å
215	S	50.7	Low	66.2	Low	40 Å²	40	78.7 Å²	78.7	28%	0.28	38%	0.381	S	S	.	.			trans	-69.3	109.9	166.5	-176.6	0	0	0	0	108.2	F213 T217 F218 K219	F213-S215 PolarHBondContact O-N 2.72Å; S215-T217 PolarHBondContact O-N 3.35Å; S215-T217 VanDerWaalsContact O-N 3.12Å; S215-T217 WeakPolarHBondContact OG-CB 3.04Å; S215-T217 PolarHBondContact OG-N 3.04Å; S215-F218 CarbonylContact O-C 3.1Å; S215-F218 PolarHBondContact O-N 2.69Å; S215-F218 PolarHBondContact OG-N 3.42Å; S215-K219 PolarHBondContact O-N 3.31Å
216	I	51.7	Low	64.5	Low	110 Å²	110	80.3 Å²	80.3	56%	0.564	39%	0.392	S	S	*	.	S	Bend	trans	-55.2	-27.9	170.2	-58.1	166.2	0	0	0	110.1	Q214	Q214-I216 PolarHBondContact O-N 2.92Å; Q214-I216 VanDerWaalsContact O-N 3.1Å
217	T	49	Very low	63.1	Low	103 Å²	103	85.8 Å²	85.8	63%	0.632	41%	0.412	S	S	*	.	S	Bend	trans	-76.2	-34.3	176.7	-50.3	0	0	0	0	112.8	S215	S215-T217 PolarHBondContact O-N 3.35Å; S215-T217 VanDerWaalsContact O-N 3.12Å; S215-T217 WeakPolarHBondContact OG-CB 3.04Å; S215-T217 PolarHBondContact OG-N 3.04Å
218	F	50.5	Low	62.3	Low	138 Å²	138	86.3 Å²	86.3	61%	0.605	41%	0.414	S	S	*	.			trans	-115	74.6	174.6	-66.6	-81.7	0	0	0	109.8	L173 S215 R220	L173-F218 HydrophobicContact CD2-CE2 4.42Å; S215-F218 CarbonylContact O-C 3.1Å; S215-F218 PolarHBondContact O-N 2.69Å; S215-F218 PolarHBondContact OG-N 3.42Å; F218-R220 PolarHBondContact O-N 2.86Å
219	K	53.1	Low	61.6	Low	185 Å²	185	87.5 Å²	87.5	80%	0.804	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55	-1	178.6	-71	-173.5	175.9	-176.7	0	115.5	S215	S215-K219 PolarHBondContact O-N 3.31Å
220	R	44.2	Very low	61.4	Low	243 Å²	243	87.3 Å²	87.3	92%	0.917	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.1	-12.9	-164.8	-135.2	173.8	-174.3	165.1	0.8	115.3	F218	F218-R220 PolarHBondContact O-N 2.86Å
221	V	49.5	Very low	61.3	Low	82 Å²	82	87 Å²	87	50%	0.497	41%	0.41	S	S	.	.			trans	-112.3	96.2	178.4	-170.2	0	0	0	0	109	F223	V221-F223 HydrophobicContact CG1-CD2 3.52Å; V221-F223 HydrophobicContact CG1-CE2 3.47Å; V221-F223 VanDerWaalsContact CG1-CE2 3.47Å
222	K	49.3	Very low	61.5	Low	162 Å²	162	90.4 Å²	90.4	70%	0.704	42%	0.423	S	S	*	.			trans	-97.6	90.7	173.7	-73	-171.9	177.5	-172.7	0	109.4
223	F	52.5	Low	62	Low	129 Å²	129	89.4 Å²	89.4	57%	0.566	42%	0.418	S	S	*	.			trans	-88.1	99.3	158.1	-75	-76	0	0	0	107.2	V221 F225	V221-F223 HydrophobicContact CG1-CD2 3.52Å; V221-F223 HydrophobicContact CG1-CE2 3.47Å; V221-F223 VanDerWaalsContact CG1-CE2 3.47Å; F223-F225 HydrophobicContact CB-CD2 4.35Å; F223-F225 HydrophobicContact CB-CE2 4.18Å; F223-F225 PolarHBondContact O-N 3.28Å
224	D	51.8	Low	63	Low	103 Å²	103	86.2 Å²	86.2	55%	0.551	40%	0.404	S	S	*	.			trans	-76.7	93.2	-179.3	-108.4	-21.9	0	0	0	110.5	P226 R229	D224-P226 WeakPolarHBondContact O-CD 3.46Å; D224-R229 IonicContact OD1-CZ 2.68Å; D224-R229 IonicContact OD1-NH1 3.19Å; D224-R229 IonicContact OD1-NH2 2.65Å; D224-R229 PolarHBondContact OD1-NH2 3.11Å
225	F	57.4	Low	64.5	Low	73 Å²	73	82.9 Å²	82.9	32%	0.32	39%	0.388	S	S	.	.			trans	-101.1	81.9	156.1	-63	-74.9	0	0	0	108.3	M79 F223 Y227	M79-F225 HydrophobicContact CE-CD2 3.89Å; M79-F225 HydrophobicContact CE-CE2 3.77Å; M79-F225 HydrophobicContact CE-CG 4.33Å; M79-F225 HydrophobicContact CE-CZ 4.11Å; F223-F225 HydrophobicContact CB-CD2 4.35Å; F223-F225 HydrophobicContact CB-CE2 4.18Å; F223-F225 PolarHBondContact O-N 3.28Å; F225-Y227 PolarHBondContact O-N 3.39Å; F225-Y227 VanDerWaalsContact O-N 3.09Å
226	P	59.3	Low	66.4	Low	42 Å²	42	81.5 Å²	81.5	27%	0.273	38%	0.378	S	S	.	.	G	3₁₀ helix	trans	-64.8	-14	-178.6	26.3	-34.6	0	0	0	113.1	D224 F228	D224-P226 WeakPolarHBondContact O-CD 3.46Å; P226-F228 PolarHBondContact O-N 2.87Å
227	Y	65.8	Low	68.4	Low	134 Å²	134	76.4 Å²	76.4	53%	0.525	35%	0.351	S	S	.	.	G	3₁₀ helix	trans	-74.1	-23.6	-167.5	-58.6	-67.9	0	0	0	116.2	Y72 F225	Y72-Y227 HydrophobicContact CD1-CD1 4.08Å; Y72-Y227 HydrophobicContact CD1-CD2 4.27Å; Y72-Y227 AromaticContact CD1-CG 3.91Å; Y72-Y227 HydrophobicContact CD1-CG 3.91Å; Y72-Y227 AromaticContact CE1-CD1 3.15Å; Y72-Y227 HydrophobicContact CE1-CD1 3.15Å; Y72-Y227 AromaticContact CE1-CD2 3.57Å; Y72-Y227 HydrophobicContact CE1-CD2 3.57Å; Y72-Y227 AromaticContact CE1-CE1 3.31Å; Y72-Y227 HydrophobicContact CE1-CE1 3.31Å; Y72-Y227 AromaticContact CE1-CE2 3.69Å; Y72-Y227 HydrophobicContact CE1-CE2 3.69Å; Y72-Y227 AromaticContact CE1-CG 3.27Å; Y72-Y227 HydrophobicContact CE1-CG 3.27Å; Y72-Y227 AromaticContact CE1-CZ 3.54Å; Y72-Y227 AromaticContact CZ-CD1 3.63Å; Y72-Y227 AromaticContact CZ-CE1 3.4Å; Y72-Y227 VanDerWaalsContact CZ-CE1 3.4Å; Y72-Y227 AromaticContact CZ-CZ 3.76Å; Y72-Y227 WeakPolarHBondContact OH-CE1 3.29Å; Y72-Y227 PolarHBondContact OH-OH 3.33Å; F225-Y227 PolarHBondContact O-N 3.39Å; F225-Y227 VanDerWaalsContact O-N 3.09Å
228	F	75.1	Confident	70.5	Confident	11 Å²	11	71.5 Å²	71.5	5%	0.048	32%	0.321	C	S	.	.	G	3₁₀ helix	trans	-104.7	18.8	-176.8	-57.4	-61.9	0	0	0	113.4	V75 R76 M79 P211 P226 S230 F237	V75-F228 HydrophobicContact CB-CE2 4.5Å; V75-F228 HydrophobicContact CB-CZ 4.34Å; V75-F228 HydrophobicContact CG1-CE2 3.65Å; V75-F228 HydrophobicContact CG1-CZ 3.96Å; R76-F228 HydrophobicContact CB-CE1 4.02Å; R76-F228 HydrophobicContact CB-CZ 4.04Å; R76-F228 HydrophobicContact CG-CE1 4.28Å; M79-F228 HydrophobicContact CG-CE2 4.28Å; P211-F228 HydrophobicContact CB-CB 4.31Å; P226-F228 PolarHBondContact O-N 2.87Å; F228-S230 VanDerWaalsContact C-N 3.3Å; F228-S230 PolarHBondContact O-N 3.43Å; F228-S230 VanDerWaalsContact O-N 3.14Å; F228-F237 HydrophobicContact CB-CE2 4.01Å; F228-F237 AromaticContact CD1-CE2 3.82Å; F228-F237 HydrophobicContact CD1-CE2 3.82Å; F228-F237 AromaticContact CD1-CZ 3.87Å; F228-F237 HydrophobicContact CD1-CZ 3.87Å; F228-F237 HydrophobicContact CE1-CZ 4.14Å; F228-F237 AromaticContact CG-CE2 3.94Å; F228-F237 HydrophobicContact CG-CE2 3.94Å; F228-F237 HydrophobicContact CG-CZ 4.16Å
229	R	77.3	Confident	72.5	Confident	25 Å²	25	64.9 Å²	64.9	9%	0.094	29%	0.292	C	S	.	.			trans	-88.3	62.1	-179.6	-65.2	-169.6	-175.9	156.6	13	112	Q214 D224 Y780	Q214-R229 VanDerWaalsContact NE2-NH2 3.15Å; D224-R229 IonicContact OD1-CZ 2.68Å; D224-R229 IonicContact OD1-NH1 3.19Å; D224-R229 IonicContact OD1-NH2 2.65Å; D224-R229 PolarHBondContact OD1-NH2 3.11Å; R229-Y780 HydrophobicContact CB-CD1 3.83Å; R229-Y780 HydrophobicContact CB-CE1 4.44Å; R229-Y780 HydrophobicContact CG-CD1 4.46Å
230	S	83.4	Confident	74.5	Confident	33 Å²	33	56.2 Å²	56.2	23%	0.231	26%	0.255	C	S	.	.	S	Bend	trans	-139.1	145.4	174	177.1	0	0	0	0	109.7	F228 R232 D233 K234	F228-S230 VanDerWaalsContact C-N 3.3Å; F228-S230 PolarHBondContact O-N 3.43Å; F228-S230 VanDerWaalsContact O-N 3.14Å; S230-R232 PolarHBondContact O-N 3.49Å; S230-R232 PolarHBondContact OG-N 2.93Å; S230-D233 PolarHBondContact O-N 2.73Å; S230-K234 VanDerWaalsContact O-CB 3.25Å; S230-K234 WeakPolarHBondContact O-CB 3.38Å; S230-K234 PolarHBondContact O-N 3.06Å
231	D	85.1	Confident	77	Confident	23 Å²	23	44.6 Å²	44.6	12%	0.123	21%	0.211	C	C	.	.	H	α-helix	trans	-57.5	-33.7	174.6	-82.1	-14.5	0	0	0	111.9	D48 R235 Y780	D48-D231 PolarHBondContact N-OD2 3.07Å; D48-D231 VanDerWaalsContact N-OD2 3.14Å; D48-D231 WeakPolarHBondContact O-CB 3.38Å; D231-R235 VanDerWaalsContact O-CB 3.28Å; D231-R235 WeakPolarHBondContact O-CB 3.27Å; D231-R235 PolarHBondContact O-N 2.68Å; D231-Y780 WeakPolarHBondContact OD1-CE2 3.32Å; D231-Y780 PolarHBondContact OD1-OH 3.29Å
232	R	85.3	Confident	79.1	Confident	75 Å²	75	40.7 Å²	40.7	28%	0.283	19%	0.188	S	C	.	.	H	α-helix	trans	-60.9	-57.1	174.9	168.3	157.3	-168.8	149.1	6.5	112.6	Y49 S230 K234 R235 D236	Y49-R232 HydrophobicContact CD2-CB 3.76Å; Y49-R232 HydrophobicContact CD2-CG 4.03Å; Y49-R232 HydrophobicContact CE2-CB 3.62Å; Y49-R232 HydrophobicContact CE2-CG 3.36Å; Y49-R232 PolarHBondContact OH-NE 2.82Å; Y49-R232 PolarHBondContact OH-NH2 3.19Å; S230-R232 PolarHBondContact O-N 3.49Å; S230-R232 PolarHBondContact OG-N 2.93Å; R232-K234 VanDerWaalsContact C-N 3.34Å; R232-R235 PolarHBondContact O-N 3.17Å; R232-D236 PolarHBondContact O-N 3.47Å; R232-D236 VanDerWaalsContact O-N 3.07Å
233	D	87.1	Confident	81.3	Confident	8 Å²	8	33 Å²	33	4%	0.043	15%	0.154	C	C	.	.	H	α-helix	trans	-66.8	-39.6	-178.6	-67	-61.9	0	0	0	110.5	R51 R76 S230 R235 D236 F237	R51-D233 IonicContact NH2-OD1 2.7Å; R51-D233 IonicContact NH2-OD2 3.7Å; R51-D233 PolarHBondContact NH2-OD2 3.43Å; R76-D233 IonicContact CZ-OD1 2.88Å; R76-D233 IonicContact NH1-OD1 3.22Å; R76-D233 PolarHBondContact NH1-OD1 2.85Å; R76-D233 IonicContact NH2-OD1 3.66Å; S230-D233 PolarHBondContact O-N 2.73Å; D233-R235 VanDerWaalsContact C-N 3.32Å; D233-R235 PolarHBondContact O-N 3.34Å; D233-D236 WeakPolarHBondContact O-CB 3.5Å; D233-D236 PolarHBondContact O-N 3.48Å; D233-F237 HydrophobicContact CB-CE2 4.23Å; D233-F237 WeakPolarHBondContact O-CD2 3.4Å; D233-F237 PolarHBondContact O-N 2.89Å
234	K	88.9	Confident	83.5	Confident	17 Å²	17	26.9 Å²	26.9	7%	0.074	13%	0.127	C	C	.	.	H	α-helix	trans	-55.5	-46.4	173.9	-173.7	179.6	-170.2	149.3	0	111.7	Y161 Q212 S230 R232 F237 V238 Y780	Y161-K234 WeakPolarHBondContact OH-CD 3.36Å; Q212-K234 VanDerWaalsContact NE2-CD 3.3Å; S230-K234 VanDerWaalsContact O-CB 3.25Å; S230-K234 WeakPolarHBondContact O-CB 3.38Å; S230-K234 PolarHBondContact O-N 3.06Å; R232-K234 VanDerWaalsContact C-N 3.34Å; K234-F237 PolarHBondContact O-N 3.03Å; K234-V238 VanDerWaalsContact O-CG2 3.25Å; K234-V238 WeakPolarHBondContact O-CG2 3.46Å; K234-V238 PolarHBondContact O-N 2.92Å; K234-Y780 WeakPolarHBondContact CD-OH 3.34Å
235	R	88.3	Confident	85.5	Confident	5 Å²	5	22 Å²	22	2%	0.019	10%	0.101	C	C	.	.	H	α-helix	trans	-68.2	-37.1	-180	-158.5	-169	78	145.8	20.2	112.5	Y161 L162 D231 R232 D233 F237 V238 S239 F267	Y161-R235 HydrophobicContact CE1-CG 4.39Å; L162-R235 HydrophobicContact CD2-CG 3.94Å; L162-R235 PolarHBondContact O-NH1 3.05Å; D231-R235 VanDerWaalsContact O-CB 3.28Å; D231-R235 WeakPolarHBondContact O-CB 3.27Å; D231-R235 PolarHBondContact O-N 2.68Å; R232-R235 PolarHBondContact O-N 3.17Å; D233-R235 VanDerWaalsContact C-N 3.32Å; D233-R235 PolarHBondContact O-N 3.34Å; R235-F237 VanDerWaalsContact C-N 3.33Å; R235-F237 PolarHBondContact O-N 2.93Å; R235-V238 PolarHBondContact O-N 2.98Å; R235-S239 WeakPolarHBondContact O-CB 3.46Å; R235-S239 PolarHBondContact O-N 3.15Å; R235-S239 PolarHBondContact O-OG 3.29Å; R235-F267 VanDerWaalsContact CZ-CE1 3.5Å
236	D	90.6	Very high	87.3	Confident	11 Å²	11	18.5 Å²	18.5	6%	0.059	9%	0.086	C	C	.	.	H	α-helix	trans	-60.6	-42.6	174	-72	-3.4	0	0	0	111	R76 R232 D233 S239 A240 L272	R76-D236 IonicContact CZ-OD2 3.15Å; R76-D236 IonicContact NH2-OD2 2.58Å; R76-D236 PolarHBondContact NH2-OD2 2.92Å; R232-D236 PolarHBondContact O-N 3.47Å; R232-D236 VanDerWaalsContact O-N 3.07Å; D233-D236 WeakPolarHBondContact O-CB 3.5Å; D233-D236 PolarHBondContact O-N 3.48Å; D236-S239 WeakPolarHBondContact O-CB 3.17Å; D236-S239 PolarHBondContact O-N 3.43Å; D236-A240 PolarHBondContact O-N 3.36Å; D236-A240 VanDerWaalsContact O-N 3.08Å; D236-L272 HydrophobicContact CB-CD1 3.73Å; D236-L272 HydrophobicContact CB-CD2 4.38Å
237	F	93.1	Very high	89	Confident	2 Å²	2	16.5 Å²	16.5	1%	0.009	7%	0.073	C	C	.	.	H	α-helix	trans	-71.2	-34.7	174.9	-65.4	-63.3	0	0	0	113.4	R76 M79 V80 I83 G207 P211 F228 D233 K234 R235 S239 A240 G241	R76-F237 HydrophobicContact CG-CE1 4.15Å; R76-F237 HydrophobicContact CG-CZ 4.03Å; M79-F237 HydrophobicContact CB-CE1 4.11Å; M79-F237 HydrophobicContact CB-CZ 4.44Å; V80-F237 HydrophobicContact CG2-CD1 4.08Å; V80-F237 HydrophobicContact CG2-CE1 3.87Å; I83-F237 HydrophobicContact CD1-CB 4.05Å; I83-F237 HydrophobicContact CD1-CD1 3.67Å; I83-F237 HydrophobicContact CD1-CE1 4.48Å; I83-F237 HydrophobicContact CD1-CG 4.16Å; G207-F237 VanDerWaalsContact O-CB 3.22Å; G207-F237 WeakPolarHBondContact O-CB 3.42Å; P211-F237 HydrophobicContact CB-CD2 3.65Å; P211-F237 HydrophobicContact CB-CE2 3.78Å; P211-F237 HydrophobicContact CB-CG 4.24Å; P211-F237 HydrophobicContact CB-CZ 4.41Å; P211-F237 HydrophobicContact CG-CB 3.79Å; P211-F237 HydrophobicContact CG-CD1 4.04Å; P211-F237 HydrophobicContact CG-CD2 3.42Å; P211-F237 VanDerWaalsContact CG-CD2 3.42Å; P211-F237 HydrophobicContact CG-CE1 4.46Å; P211-F237 HydrophobicContact CG-CE2 3.94Å; P211-F237 HydrophobicContact CG-CG 3.5Å; P211-F237 VanDerWaalsContact CG-CG 3.5Å; P211-F237 HydrophobicContact CG-CZ 4.43Å; F228-F237 HydrophobicContact CB-CE2 4.01Å; F228-F237 AromaticContact CD1-CE2 3.82Å; F228-F237 HydrophobicContact CD1-CE2 3.82Å; F228-F237 AromaticContact CD1-CZ 3.87Å; F228-F237 HydrophobicContact CD1-CZ 3.87Å; F228-F237 HydrophobicContact CE1-CZ 4.14Å; F228-F237 AromaticContact CG-CE2 3.94Å; F228-F237 HydrophobicContact CG-CE2 3.94Å; F228-F237 HydrophobicContact CG-CZ 4.16Å; D233-F237 HydrophobicContact CB-CE2 4.23Å; D233-F237 WeakPolarHBondContact O-CD2 3.4Å; D233-F237 PolarHBondContact O-N 2.89Å; K234-F237 PolarHBondContact O-N 3.03Å; R235-F237 VanDerWaalsContact C-N 3.33Å; R235-F237 PolarHBondContact O-N 2.93Å; F237-S239 VanDerWaalsContact C-N 3.31Å; F237-A240 PolarHBondContact O-N 3.29Å; F237-G241 PolarHBondContact O-N 3.33Å
238	V	93.1	Very high	90.4	Very high	0 Å²	0	10.1 Å²	10.1	0%	0	5%	0.048	C	C	.	.	H	α-helix	trans	-62.8	-40.5	172.2	168.5	0	0	0	0	111.1	Y161 L162 A204 A208 K234 R235 G241 A242	Y161-V238 HydrophobicContact CD1-CG1 3.89Å; Y161-V238 HydrophobicContact CE1-CB 4.2Å; Y161-V238 HydrophobicContact CE1-CG1 4.03Å; Y161-V238 HydrophobicContact CE1-CG2 3.92Å; L162-V238 HydrophobicContact CD2-CG1 4.02Å; A204-V238 HydrophobicContact CB-CG1 3.95Å; A208-V238 HydrophobicContact CB-CG2 3.58Å; K234-V238 VanDerWaalsContact O-CG2 3.25Å; K234-V238 WeakPolarHBondContact O-CG2 3.46Å; K234-V238 PolarHBondContact O-N 2.92Å; R235-V238 PolarHBondContact O-N 2.98Å; V238-G241 PolarHBondContact O-N 3.05Å; V238-A242 WeakPolarHBondContact O-CB 2.81Å; V238-A242 PolarHBondContact O-N 2.98Å
239	S	93	Very high	91.2	Very high	0 Å²	0	9.6 Å²	9.6	0%	0	5%	0.046	C	C	.	.	H	α-helix	trans	-61.6	-45.7	174.9	-53.6	0	0	0	0	110.7	L162 R235 D236 F237 G241 A242 A243 S260	L162-S239 VanDerWaalsContact CD2-OG 3.27Å; L162-S239 WeakPolarHBondContact CD2-OG 3.09Å; R235-S239 WeakPolarHBondContact O-CB 3.46Å; R235-S239 PolarHBondContact O-N 3.15Å; R235-S239 PolarHBondContact O-OG 3.29Å; D236-S239 WeakPolarHBondContact O-CB 3.17Å; D236-S239 PolarHBondContact O-N 3.43Å; F237-S239 VanDerWaalsContact C-N 3.31Å; S239-G241 PolarHBondContact O-N 3.23Å; S239-A242 PolarHBondContact O-N 3.33Å; S239-A243 WeakPolarHBondContact O-CB 3.29Å; S239-A243 PolarHBondContact O-N 3.43Å; S239-S260 WeakPolarHBondContact CB-OG 3.37Å; S239-S260 PolarHBondContact O-OG 3.17Å
240	A	94.9	Very high	91.9	Very high	2 Å²	2	8.7 Å²	8.7	2%	0.017	4%	0.042	C	C	.	.	H	α-helix	trans	-62.4	-40.3	175	0	0	0	0	0	113.1	D236 F237 A244 V276 C279	D236-A240 PolarHBondContact O-N 3.36Å; D236-A240 VanDerWaalsContact O-N 3.08Å; F237-A240 PolarHBondContact O-N 3.29Å; A240-A244 VanDerWaalsContact O-CB 3.29Å; A240-A244 WeakPolarHBondContact O-CB 3.46Å; A240-A244 PolarHBondContact O-N 3.46Å; A240-V276 HydrophobicContact CB-CG2 3.98Å; A240-C279 HydrophobicContact CB-CB 4.11Å; A240-C279 PolarHBondContact O-SG 2.93Å
241	G	95.7	Very high	92.3	Very high	0 Å²	0	7.5 Å²	7.5	0%	0	4%	0.035	C	C	.	.	H	α-helix	trans	-69	-39.7	176.9	0	0	0	0	0	113.2	G203 F237 V238 S239 A244 G245	G203-G241 VanDerWaalsContact C-C 3.41Å; G203-G241 CarbonylContact C-O 3.16Å; G203-G241 WeakPolarHBondContact CA-O 2.96Å; G203-G241 CarbonylContact O-C 3.33Å; G203-G241 WeakPolarHBondContact O-CA 3.22Å; F237-G241 PolarHBondContact O-N 3.33Å; V238-G241 PolarHBondContact O-N 3.05Å; S239-G241 PolarHBondContact O-N 3.23Å; G241-A244 PolarHBondContact O-N 3.31Å; G241-G245 PolarHBondContact O-N 2.65Å
242	A	94.9	Very high	92.7	Very high	0 Å²	0	6.4 Å²	6.4	0%	0	3%	0.029	C	C	.	.	H	α-helix	trans	-63.5	-47.2	174.7	0	0	0	0	0	111	I158 I200 A204 V238 S239 A244 G245 V246	I158-A242 HydrophobicContact CG2-CB 4.22Å; I200-A242 HydrophobicContact CG2-CB 4.17Å; A204-A242 HydrophobicContact CB-CB 4.32Å; V238-A242 WeakPolarHBondContact O-CB 2.81Å; V238-A242 PolarHBondContact O-N 2.98Å; S239-A242 PolarHBondContact O-N 3.33Å; A242-A244 PolarHBondContact O-N 3.32Å; A242-G245 PolarHBondContact O-N 3.49Å; A242-G245 VanDerWaalsContact O-N 3.15Å; A242-V246 WeakPolarHBondContact O-CG2 3.08Å; A242-V246 PolarHBondContact O-N 2.85Å
243	A	95.7	Very high	93.2	Very high	0 Å²	0	3.8 Å²	3.8	0%	0	2%	0.022	C	C	.	.	H	α-helix	trans	-60	-44.4	175.2	0	0	0	0	0	112.3	S239 G245 V246 A247 G256 V276 S280	S239-A243 WeakPolarHBondContact O-CB 3.29Å; S239-A243 PolarHBondContact O-N 3.43Å; A243-G245 VanDerWaalsContact C-N 3.27Å; A243-G245 PolarHBondContact O-N 2.98Å; A243-V246 PolarHBondContact O-N 3.22Å; A243-A247 WeakPolarHBondContact O-CB 3.2Å; A243-A247 PolarHBondContact O-N 2.95Å; A243-G256 WeakPolarHBondContact CA-O 3.47Å; A243-G256 WeakPolarHBondContact CB-O 3.22Å; A243-V276 HydrophobicContact CB-CG1 3.38Å; A243-S280 WeakPolarHBondContact CB-OG 3.39Å
244	A	96.7	Very high	93.6	Very high	0 Å²	0	7.2 Å²	7.2	0%	0	4%	0.04	C	C	.	.	H	α-helix	trans	-61.7	-34.6	174.8	0	0	0	0	0	112.7	V87 A240 G241 A242 A247 A248 A283	V87-A244 HydrophobicContact CB-CB 4.3Å; V87-A244 HydrophobicContact CG1-CB 4.07Å; A240-A244 VanDerWaalsContact O-CB 3.29Å; A240-A244 WeakPolarHBondContact O-CB 3.46Å; A240-A244 PolarHBondContact O-N 3.46Å; G241-A244 PolarHBondContact O-N 3.31Å; A242-A244 PolarHBondContact O-N 3.32Å; A244-A247 PolarHBondContact O-N 2.88Å; A244-A248 WeakPolarHBondContact O-CB 3.33Å; A244-A248 PolarHBondContact O-N 2.87Å; A244-A283 HydrophobicContact CB-CB 3.84Å
245	G	95.6	Very high	93.8	Very high	0 Å²	0	6.4 Å²	6.4	0%	0	4%	0.036	C	C	.	.	H	α-helix	trans	-65.7	-43	173.7	0	0	0	0	0	112.7	G241 A242 A243 A249	G241-G245 PolarHBondContact O-N 2.65Å; A242-G245 PolarHBondContact O-N 3.49Å; A242-G245 VanDerWaalsContact O-N 3.15Å; A243-G245 VanDerWaalsContact C-N 3.27Å; A243-G245 PolarHBondContact O-N 2.98Å; G245-A249 VanDerWaalsContact O-CB 3.26Å; G245-A249 WeakPolarHBondContact O-CB 3.15Å; G245-A249 PolarHBondContact O-N 3.19Å
246	V	94.6	Very high	94	Very high	1 Å²	1	6.2 Å²	6.2	1%	0.006	4%	0.035	C	C	.	.	H	α-helix	trans	-63.6	-43.5	173.1	-179.4	0	0	0	0	110.8	I200 A242 A243 A249 F250 F259 I541	I200-V246 HydrophobicContact CD1-CG2 3.6Å; I200-V246 HydrophobicContact CG1-CB 4.49Å; I200-V246 HydrophobicContact CG1-CG2 3.61Å; I200-V246 HydrophobicContact CG2-CG2 4.23Å; A242-V246 WeakPolarHBondContact O-CG2 3.08Å; A242-V246 PolarHBondContact O-N 2.85Å; A243-V246 PolarHBondContact O-N 3.22Å; V246-A249 WeakPolarHBondContact O-CB 3.43Å; V246-A249 PolarHBondContact O-N 3.23Å; V246-F250 HydrophobicContact CG1-CD2 3.81Å; V246-F250 HydrophobicContact CG1-CE2 4.26Å; V246-F250 WeakPolarHBondContact O-CD2 3.46Å; V246-F250 PolarHBondContact O-N 2.95Å; V246-F259 HydrophobicContact CG1-CB 4.45Å; V246-F259 HydrophobicContact CG2-CB 4.24Å; V246-F259 HydrophobicContact CG2-CD1 3.46Å; V246-F259 VanDerWaalsContact CG2-CD1 3.46Å; V246-F259 HydrophobicContact CG2-CE1 3.87Å; V246-F259 HydrophobicContact CG2-CG 3.82Å; V246-I541 HydrophobicContact CG1-CD1 3.86Å; V246-I541 HydrophobicContact CG1-CG1 4.45Å
247	A	95.4	Very high	94.2	Very high	0 Å²	0	6 Å²	6	0%	0	3%	0.034	C	C	.	.	H	α-helix	trans	-62.5	-46.3	179.5	0	0	0	0	0	111.1	A243 A244 A249 G251 A252 P253 T284	A243-A247 WeakPolarHBondContact O-CB 3.2Å; A243-A247 PolarHBondContact O-N 2.95Å; A244-A247 PolarHBondContact O-N 2.88Å; A247-A249 VanDerWaalsContact C-N 3.29Å; A247-A249 PolarHBondContact O-N 2.64Å; A247-G251 WeakPolarHBondContact O-CA 3.31Å; A247-G251 PolarHBondContact O-N 3.41Å; A247-A252 PolarHBondContact O-N 2.95Å; A247-P253 HydrophobicContact CB-CB 4.36Å; A247-T284 VanDerWaalsContact C-CG2 3.47Å; A247-T284 HydrophobicContact CB-CG2 3.65Å; A247-T284 WeakPolarHBondContact O-CG2 3.18Å
248	A	94.7	Very high	94.2	Very high	0 Å²	0	8.1 Å²	8.1	0%	0	5%	0.046	C	C	.	.	H	α-helix	trans	-62.7	-35.7	174.2	0	0	0	0	0	112.5	M199 A244 L287 L307	M199-A248 HydrophobicContact CE-CB 3.9Å; A244-A248 WeakPolarHBondContact O-CB 3.33Å; A244-A248 PolarHBondContact O-N 2.87Å; A248-L287 HydrophobicContact CB-CD2 4.33Å; A248-L287 WeakPolarHBondContact O-CD2 3.46Å; A248-L307 PolarHBondContact O-N 3.07Å
249	A	92.8	Very high	94.1	Very high	0 Å²	0	8.5 Å²	8.5	0%	0	5%	0.047	C	C	.	.	H	α-helix	trans	-66.1	-54.4	178.7	0	0	0	0	0	113.5	E196 G245 V246 A247 L307 L308	E196-A249 HydrophobicContact CB-CB 3.9Å; E196-A249 HydrophobicContact CG-CB 4.29Å; E196-A249 WeakPolarHBondContact OE2-CA 3.46Å; E196-A249 WeakPolarHBondContact OE2-CB 3.37Å; G245-A249 VanDerWaalsContact O-CB 3.26Å; G245-A249 WeakPolarHBondContact O-CB 3.15Å; G245-A249 PolarHBondContact O-N 3.19Å; V246-A249 WeakPolarHBondContact O-CB 3.43Å; V246-A249 PolarHBondContact O-N 3.23Å; A247-A249 VanDerWaalsContact C-N 3.29Å; A247-A249 PolarHBondContact O-N 2.64Å; A249-L307 WeakPolarHBondContact O-CB 3.37Å; A249-L307 PolarHBondContact O-N 2.96Å; A249-L307 VanDerWaalsContact O-N 3.08Å; A249-L308 PolarHBondContact O-N 3.27Å
250	F	91.8	Very high	94	Very high	5 Å²	5	8.5 Å²	8.5	2%	0.022	5%	0.047	C	C	.	.	H	α-helix	trans	-103.7	-6.3	-171.4	-59.7	-76.6	0	0	0	114	E196 V246 A252 L308 F488 I541 S545	E196-F250 HydrophobicContact CB-CE1 4.44Å; E196-F250 HydrophobicContact CB-CE2 4.39Å; E196-F250 HydrophobicContact CB-CZ 3.95Å; E196-F250 HydrophobicContact CG-CE1 4.27Å; E196-F250 HydrophobicContact CG-CZ 4.28Å; V246-F250 HydrophobicContact CG1-CD2 3.81Å; V246-F250 HydrophobicContact CG1-CE2 4.26Å; V246-F250 WeakPolarHBondContact O-CD2 3.46Å; V246-F250 PolarHBondContact O-N 2.95Å; F250-A252 HydrophobicContact CB-CB 4.12Å; F250-A252 PolarHBondContact O-N 3.41Å; F250-L308 HydrophobicContact CD1-CD2 4.09Å; F250-L308 HydrophobicContact CE1-CD2 4.14Å; F250-F488 HydrophobicContact CE1-CB 4.42Å; F250-F488 HydrophobicContact CE1-CD1 4.25Å; F250-F488 HydrophobicContact CE2-CD1 4.42Å; F250-F488 HydrophobicContact CZ-CB 3.99Å; F250-F488 AromaticContact CZ-CD1 3.59Å; F250-F488 HydrophobicContact CZ-CD1 3.59Å; F250-F488 HydrophobicContact CZ-CD2 4.4Å; F250-F488 HydrophobicContact CZ-CE1 4.14Å; F250-F488 AromaticContact CZ-CG 3.74Å; F250-F488 HydrophobicContact CZ-CG 3.74Å; F250-I541 HydrophobicContact CB-CG2 3.67Å; F250-I541 HydrophobicContact CD1-CG2 4.07Å; F250-I541 HydrophobicContact CD2-CG2 4.14Å; F250-I541 HydrophobicContact CG-CG2 3.69Å; F250-S545 PolarHBondContact O-OG 3.48Å
251	G	91.6	Very high	93.6	Very high	8 Å²	8	10.8 Å²	10.8	8%	0.082	6%	0.059	C	C	.	.	S	Bend	trans	71.4	19.8	-172.8	0	0	0	0	0	113	A247 P253 P305 G306	A247-G251 WeakPolarHBondContact O-CA 3.31Å; A247-G251 PolarHBondContact O-N 3.41Å; G251-P253 WeakPolarHBondContact O-CD 3.38Å; G251-P305 VanDerWaalsContact CA-C 3.49Å; G251-P305 WeakPolarHBondContact CA-O 3.32Å; G251-G306 VanDerWaalsContact CA-CA 3.49Å
252	A	93.6	Very high	93.1	Very high	0 Å²	0	12.3 Å²	12.3	0%	0	7%	0.066	C	C	.	.			trans	-117.4	85.3	-170	0	0	0	0	0	110.6	A247 F250 G256 I541 E544	A247-A252 PolarHBondContact O-N 2.95Å; F250-A252 HydrophobicContact CB-CB 4.12Å; F250-A252 PolarHBondContact O-N 3.41Å; A252-G256 PolarHBondContact O-N 2.96Å; A252-I541 HydrophobicContact CB-CB 4.32Å; A252-I541 HydrophobicContact CB-CG1 4.18Å; A252-I541 HydrophobicContact CB-CG2 4.25Å; A252-E544 WeakPolarHBondContact CA-OE2 3.04Å; A252-E544 HydrophobicContact CB-CB 3.78Å; A252-E544 HydrophobicContact CB-CG 4.49Å; A252-E544 WeakPolarHBondContact CB-OE2 3.33Å
253	P	95.4	Very high	92	Very high	20 Å²	20	13.2 Å²	13.2	13%	0.13	7%	0.07	C	C	.	.	H	α-helix	trans	-68.6	-39	-176.5	27.7	-33.4	0	0	0	112.9	A247 G251 G256 T257 M281 T284	A247-P253 HydrophobicContact CB-CB 4.36Å; G251-P253 WeakPolarHBondContact O-CD 3.38Å; P253-G256 PolarHBondContact O-N 3.41Å; P253-T257 VanDerWaalsContact O-CG2 3.31Å; P253-T257 WeakPolarHBondContact O-CG2 3.46Å; P253-T257 PolarHBondContact O-N 3.49Å; P253-T257 VanDerWaalsContact O-N 3.14Å; P253-M281 HydrophobicContact CB-CG 4.05Å; P253-M281 HydrophobicContact CG-CG 4.46Å; P253-T284 HydrophobicContact CB-CG2 4.45Å
254	I	95.1	Very high	90.4	Very high	81 Å²	81	13.3 Å²	13.3	42%	0.415	7%	0.071	S	C	.	.	H	α-helix	trans	-70	-43.9	177.2	-56.7	172.1	0	0	0	108.8	G256 T257 L258 L277 V540 E544	I254-G256 VanDerWaalsContact C-N 3.29Å; I254-G256 PolarHBondContact O-N 3.19Å; I254-T257 PolarHBondContact O-N 3Å; I254-T257 VanDerWaalsContact O-N 3.14Å; I254-T257 PolarHBondContact O-OG1 2.99Å; I254-L258 HydrophobicContact CG2-CD1 4.15Å; I254-L258 PolarHBondContact O-N 3.36Å; I254-L277 HydrophobicContact CG1-CD1 4.21Å; I254-V540 HydrophobicContact CB-CG1 4.08Å; I254-V540 HydrophobicContact CG2-CG1 3.95Å; I254-E544 WeakPolarHBondContact CB-OE1 3.39Å; I254-E544 WeakPolarHBondContact CD1-OE1 3.37Å; I254-E544 WeakPolarHBondContact CG1-OE1 3.42Å; I254-E544 PolarHBondContact N-OE1 3.37Å; I254-E544 PolarHBondContact N-OE2 3.18Å; I254-E544 VanDerWaalsContact N-OE2 3.09Å
255	G	93.1	Very high	88.9	Confident	0 Å²	0	14.1 Å²	14.1	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-55.7	-42.4	174.5	0	0	0	0	0	112.8	L258 F259 E544	G255-L258 PolarHBondContact O-N 2.86Å; G255-F259 WeakPolarHBondContact O-CB 3.31Å; G255-F259 PolarHBondContact O-N 3.13Å; G255-E544 PolarHBondContact N-OE2 3.38Å
256	G	93.1	Very high	87.4	Confident	0 Å²	0	15.1 Å²	15.1	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-64.5	-39.2	175.9	0	0	0	0	0	113.9	A243 A252 P253 I254 F259 S260	A243-G256 WeakPolarHBondContact CA-O 3.47Å; A243-G256 WeakPolarHBondContact CB-O 3.22Å; A252-G256 PolarHBondContact O-N 2.96Å; P253-G256 PolarHBondContact O-N 3.41Å; I254-G256 VanDerWaalsContact C-N 3.29Å; I254-G256 PolarHBondContact O-N 3.19Å; G256-F259 WeakPolarHBondContact O-CB 3.32Å; G256-F259 PolarHBondContact O-N 2.73Å; G256-S260 PolarHBondContact O-N 3.33Å; G256-S260 VanDerWaalsContact O-N 3.14Å
257	T	93.8	Very high	86.2	Confident	7 Å²	7	16.4 Å²	16.4	4%	0.043	9%	0.089	C	C	.	.	H	α-helix	trans	-66	-41.5	174.3	65	0	0	0	0	112.9	P253 I254 F259 S260 L261 V276 L277	P253-T257 VanDerWaalsContact O-CG2 3.31Å; P253-T257 WeakPolarHBondContact O-CG2 3.46Å; P253-T257 PolarHBondContact O-N 3.49Å; P253-T257 VanDerWaalsContact O-N 3.14Å; I254-T257 PolarHBondContact O-N 3Å; I254-T257 VanDerWaalsContact O-N 3.14Å; I254-T257 PolarHBondContact O-OG1 2.99Å; T257-F259 VanDerWaalsContact C-N 3.31Å; T257-S260 PolarHBondContact O-N 3.21Å; T257-L261 PolarHBondContact O-N 3.31Å; T257-V276 HydrophobicContact CG2-CG1 3.84Å; T257-L277 HydrophobicContact CG2-CB 3.83Å; T257-L277 HydrophobicContact CG2-CD1 3.66Å; T257-L277 HydrophobicContact CG2-CG 4.37Å
258	L	93.1	Very high	85.3	Confident	46 Å²	46	19.3 Å²	19.3	24%	0.241	10%	0.1	C	C	.	.	H	α-helix	trans	-67.6	-34.3	177.1	-71.3	173.5	0	0	0	111.4	I254 G255 L261 E262 I536 V540	I254-L258 HydrophobicContact CG2-CD1 4.15Å; I254-L258 PolarHBondContact O-N 3.36Å; G255-L258 PolarHBondContact O-N 2.86Å; L258-L261 HydrophobicContact CD2-CD1 4.06Å; L258-L261 WeakPolarHBondContact O-CB 3.31Å; L258-L261 PolarHBondContact O-N 3.43Å; L258-E262 VanDerWaalsContact O-CB 3.32Å; L258-E262 WeakPolarHBondContact O-CB 3.36Å; L258-E262 PolarHBondContact O-N 3.02Å; L258-I536 HydrophobicContact CD1-CG2 4.36Å; L258-V540 HydrophobicContact CD1-CB 3.98Å; L258-V540 HydrophobicContact CD1-CG1 4.14Å; L258-V540 HydrophobicContact CD1-CG2 3.61Å
259	F	91.1	Very high	84.6	Confident	8 Å²	8	23.8 Å²	23.8	4%	0.035	13%	0.125	C	C	.	.	H	α-helix	trans	-60.8	-46.4	172.5	174.8	-89.3	0	0	0	111.5	I155 I200 V246 G255 G256 T257 L261 E262 E263 M534	I155-F259 HydrophobicContact CG2-CZ 4.12Å; I200-F259 HydrophobicContact CD1-CE1 4.4Å; I200-F259 HydrophobicContact CD1-CZ 4.21Å; I200-F259 HydrophobicContact CG2-CE1 4.03Å; V246-F259 HydrophobicContact CG1-CB 4.45Å; V246-F259 HydrophobicContact CG2-CB 4.24Å; V246-F259 HydrophobicContact CG2-CD1 3.46Å; V246-F259 VanDerWaalsContact CG2-CD1 3.46Å; V246-F259 HydrophobicContact CG2-CE1 3.87Å; V246-F259 HydrophobicContact CG2-CG 3.82Å; G255-F259 WeakPolarHBondContact O-CB 3.31Å; G255-F259 PolarHBondContact O-N 3.13Å; G256-F259 WeakPolarHBondContact O-CB 3.32Å; G256-F259 PolarHBondContact O-N 2.73Å; T257-F259 VanDerWaalsContact C-N 3.31Å; F259-L261 PolarHBondContact O-N 2.73Å; F259-E262 PolarHBondContact O-N 2.9Å; F259-E263 HydrophobicContact CD2-CG 4.09Å; F259-E263 HydrophobicContact CE2-CB 4.44Å; F259-E263 HydrophobicContact CE2-CG 3.89Å; F259-E263 HydrophobicContact CZ-CB 4.38Å; F259-E263 HydrophobicContact CZ-CG 4.29Å; F259-E263 WeakPolarHBondContact O-CB 3.43Å; F259-E263 PolarHBondContact O-N 3.18Å; F259-M534 HydrophobicContact CD2-CE 4.35Å; F259-M534 HydrophobicContact CD2-SD 3.97Å; F259-M534 HydrophobicContact CE2-CE 3.56Å; F259-M534 HydrophobicContact CE2-SD 3.69Å; F259-M534 HydrophobicContact CZ-CE 4.4Å
260	S	91.1	Very high	84.3	Confident	0 Å²	0	30.3 Å²	30.3	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-66.3	-25.5	176.4	-174.5	0	0	0	0	112.9	S239 G256 T257 G264 S265	S239-S260 WeakPolarHBondContact CB-OG 3.37Å; S239-S260 PolarHBondContact O-OG 3.17Å; G256-S260 PolarHBondContact O-N 3.33Å; G256-S260 VanDerWaalsContact O-N 3.14Å; T257-S260 PolarHBondContact O-N 3.21Å; S260-G264 CarbonylContact O-C 3.58Å; S260-G264 WeakPolarHBondContact O-CA 3.45Å; S260-G264 PolarHBondContact O-N 3.28Å; S260-G264 VanDerWaalsContact O-N 3.15Å; S260-S265 PolarHBondContact O-N 3.47Å
261	L	87.6	Confident	84.1	Confident	50 Å²	50	32.2 Å²	32.2	26%	0.262	17%	0.171	S	C	.	.	H	α-helix	trans	-74.9	-52.3	174.6	-90.5	165.9	0	0	0	112	T257 L258 F259 W268 T273	T257-L261 PolarHBondContact O-N 3.31Å; L258-L261 HydrophobicContact CD2-CD1 4.06Å; L258-L261 WeakPolarHBondContact O-CB 3.31Å; L258-L261 PolarHBondContact O-N 3.43Å; F259-L261 PolarHBondContact O-N 2.73Å; L261-W268 HydrophobicContact CD1-CZ2 4.29Å; L261-W268 HydrophobicContact CD2-CB 3.69Å; L261-W268 HydrophobicContact CD2-CD2 3.24Å; L261-W268 HydrophobicContact CD2-CE3 3.9Å; L261-W268 HydrophobicContact CD2-CG 3.18Å; L261-W268 HydrophobicContact CD2-CZ2 4.05Å; L261-W268 HydrophobicContact CD2-CZ3 4.48Å; L261-W268 HydrophobicContact CG-CD2 3.91Å; L261-W268 HydrophobicContact CG-CE3 4.37Å; L261-W268 HydrophobicContact CG-CG 4.29Å; L261-W268 HydrophobicContact CG-CH2 4.16Å; L261-W268 HydrophobicContact CG-CZ2 3.77Å; L261-W268 HydrophobicContact CG-CZ3 4.48Å; L261-T273 HydrophobicContact CD1-CG2 4.42Å
262	E	85.4	Confident	83.9	Confident	33 Å²	33	32.3 Å²	32.3	15%	0.154	17%	0.17	C	C	.	.	H	α-helix	trans	-65.9	-53.7	-177.4	-171.4	173.2	-178.1	0	0	110.3	L258 F259 T535 S537 W588	L258-E262 VanDerWaalsContact O-CB 3.32Å; L258-E262 WeakPolarHBondContact O-CB 3.36Å; L258-E262 PolarHBondContact O-N 3.02Å; F259-E262 PolarHBondContact O-N 2.9Å; E262-T535 PolarHBondContact OE1-N 3.34Å; E262-T535 VanDerWaalsContact OE1-N 3.08Å; E262-T535 PolarHBondContact OE1-OG1 2.9Å; E262-S537 WeakPolarHBondContact OE2-CB 3.42Å; E262-S537 PolarHBondContact OE2-N 2.79Å; E262-S537 PolarHBondContact OE2-OG 3.5Å; E262-W588 HydrophobicContact CG-CZ2 4.34Å; E262-W588 VanDerWaalsContact O-CZ2 3.31Å; E262-W588 WeakPolarHBondContact O-CZ2 3.12Å
263	E	71.4	Confident	83.9	Confident	19 Å²	19	34.1 Å²	34.1	9%	0.089	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.2	-18.6	-172.9	-63.4	-65.9	140.5	0	0	113.7	K159 F259 M534	K159-E263 VanDerWaalsContact CD-OE2 3.26Å; K159-E263 WeakPolarHBondContact CD-OE2 3.32Å; K159-E263 WeakPolarHBondContact CE-OE2 3.07Å; K159-E263 IonicContact NZ-OE2 3.64Å; K159-E263 PolarHBondContact NZ-OE2 3.4Å; F259-E263 HydrophobicContact CD2-CG 4.09Å; F259-E263 HydrophobicContact CE2-CB 4.44Å; F259-E263 HydrophobicContact CE2-CG 3.89Å; F259-E263 HydrophobicContact CZ-CB 4.38Å; F259-E263 HydrophobicContact CZ-CG 4.29Å; F259-E263 WeakPolarHBondContact O-CB 3.43Å; F259-E263 PolarHBondContact O-N 3.18Å; E263-M534 HydrophobicContact CG-CE 3.73Å; E263-M534 HydrophobicContact CG-CG 4.44Å; E263-M534 HydrophobicContact CG-SD 4.43Å; E263-M534 WeakPolarHBondContact OE1-CG 3.3Å
264	G	62.2	Low	83.8	Confident	2 Å²	2	40.4 Å²	40.4	2%	0.021	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-122.2	0.6	-155	0	0	0	0	0	116.6	L162 S260	L162-G264 WeakPolarHBondContact CB-O 3.18Å; L162-G264 WeakPolarHBondContact CD2-O 3.12Å; L162-G264 WeakPolarHBondContact CG-O 3.41Å; S260-G264 CarbonylContact O-C 3.58Å; S260-G264 WeakPolarHBondContact O-CA 3.45Å; S260-G264 PolarHBondContact O-N 3.28Å; S260-G264 VanDerWaalsContact O-N 3.15Å
265	S	63.5	Low	83.7	Confident	17 Å²	17	37 Å²	37	12%	0.119	18%	0.184	C	C	.	.			trans	-155.4	122.6	176.2	69.1	0	0	0	0	113.2	S260 F267	S260-S265 PolarHBondContact O-N 3.47Å; S265-F267 VanDerWaalsContact CB-O 3.31Å; S265-F267 WeakPolarHBondContact CB-O 3.03Å; S265-F267 PolarHBondContact O-N 3.12Å; S265-F267 PolarHBondContact OG-O 3.41Å
266	S	64.5	Low	83.8	Confident	20 Å²	20	37 Å²	37	14%	0.14	18%	0.184	C	C	.	.	S	Bend	trans	-64.2	-21	168.2	-42.6	0	0	0	0	112.5	R827	S266-R827 WeakPolarHBondContact CB-O 3.42Å
267	F	69.3	Low	83.9	Confident	28 Å²	28	38.4 Å²	38.4	12%	0.123	19%	0.192	C	C	.	.	S	Bend	trans	-148.3	139.9	-177.6	55.9	-97.7	0	0	0	110.1	Y49 R235 S265 T828	Y49-F267 HydrophobicContact CD1-CD2 4.47Å; Y49-F267 AromaticContact CD1-CE1 3.69Å; Y49-F267 HydrophobicContact CD1-CE1 3.69Å; Y49-F267 AromaticContact CD1-CE2 3.69Å; Y49-F267 HydrophobicContact CD1-CE2 3.69Å; Y49-F267 AromaticContact CD1-CZ 3.16Å; Y49-F267 HydrophobicContact CD1-CZ 3.16Å; Y49-F267 HydrophobicContact CD2-CE1 4.29Å; Y49-F267 AromaticContact CD2-CE2 3.8Å; Y49-F267 HydrophobicContact CD2-CE2 3.8Å; Y49-F267 AromaticContact CD2-CZ 3.25Å; Y49-F267 HydrophobicContact CD2-CZ 3.25Å; Y49-F267 AromaticContact CE1-CD2 3.74Å; Y49-F267 HydrophobicContact CE1-CD2 3.74Å; Y49-F267 AromaticContact CE1-CE1 3.94Å; Y49-F267 HydrophobicContact CE1-CE1 3.94Å; Y49-F267 AromaticContact CE1-CE2 3.09Å; Y49-F267 HydrophobicContact CE1-CE2 3.09Å; Y49-F267 HydrophobicContact CE1-CG 4.42Å; Y49-F267 AromaticContact CE1-CZ 3.14Å; Y49-F267 HydrophobicContact CE1-CZ 3.14Å; Y49-F267 HydrophobicContact CE2-CD2 4.42Å; Y49-F267 HydrophobicContact CE2-CE1 4.47Å; Y49-F267 AromaticContact CE2-CE2 3.18Å; Y49-F267 HydrophobicContact CE2-CE2 3.18Å; Y49-F267 AromaticContact CE2-CZ 3.18Å; Y49-F267 HydrophobicContact CE2-CZ 3.18Å; Y49-F267 AromaticContact CG-CE1 3.89Å; Y49-F267 HydrophobicContact CG-CE1 3.89Å; Y49-F267 HydrophobicContact CG-CE2 4.01Å; Y49-F267 AromaticContact CG-CZ 3.22Å; Y49-F267 HydrophobicContact CG-CZ 3.22Å; Y49-F267 AromaticContact CZ-CD2 3.72Å; Y49-F267 AromaticContact CZ-CE2 2.81Å; Y49-F267 AromaticContact CZ-CZ 3.17Å; Y49-F267 WeakPolarHBondContact OH-CE2 3.49Å; R235-F267 VanDerWaalsContact CZ-CE1 3.5Å; S265-F267 VanDerWaalsContact CB-O 3.31Å; S265-F267 WeakPolarHBondContact CB-O 3.03Å; S265-F267 PolarHBondContact O-N 3.12Å; S265-F267 PolarHBondContact OG-O 3.41Å; F267-T828 WeakPolarHBondContact CB-O 3.32Å
268	W	78.1	Confident	84	Confident	61 Å²	61	41.7 Å²	41.7	23%	0.231	21%	0.206	C	C	.	.			trans	-141	134.4	-174.6	-166.6	-98.8	0	0	0	111.1	L261 L272 T273 V276	L261-W268 HydrophobicContact CD1-CZ2 4.29Å; L261-W268 HydrophobicContact CD2-CB 3.69Å; L261-W268 HydrophobicContact CD2-CD2 3.24Å; L261-W268 HydrophobicContact CD2-CE3 3.9Å; L261-W268 HydrophobicContact CD2-CG 3.18Å; L261-W268 HydrophobicContact CD2-CZ2 4.05Å; L261-W268 HydrophobicContact CD2-CZ3 4.48Å; L261-W268 HydrophobicContact CG-CD2 3.91Å; L261-W268 HydrophobicContact CG-CE3 4.37Å; L261-W268 HydrophobicContact CG-CG 4.29Å; L261-W268 HydrophobicContact CG-CH2 4.16Å; L261-W268 HydrophobicContact CG-CZ2 3.77Å; L261-W268 HydrophobicContact CG-CZ3 4.48Å; W268-L272 HydrophobicContact CD2-CD2 4.16Å; W268-L272 HydrophobicContact CE3-CD2 3.74Å; W268-L272 HydrophobicContact CE3-CG 4.42Å; W268-L272 HydrophobicContact CH2-CD2 4.38Å; W268-L272 HydrophobicContact CH2-CG 4.36Å; W268-L272 HydrophobicContact CZ2-CG 4.36Å; W268-L272 HydrophobicContact CZ3-CD2 3.89Å; W268-L272 HydrophobicContact CZ3-CG 4.36Å; W268-T273 HydrophobicContact CZ2-CG2 4.43Å; W268-T273 PolarHBondContact NE1-OG1 3.29Å; W268-V276 HydrophobicContact CH2-CB 4.12Å; W268-V276 HydrophobicContact CH2-CG1 4.05Å; W268-V276 HydrophobicContact CH2-CG2 3.68Å; W268-V276 HydrophobicContact CZ2-CB 4.11Å; W268-V276 HydrophobicContact CZ2-CG1 4.32Å; W268-V276 HydrophobicContact CZ2-CG2 3.96Å
269	N	79.4	Confident	84.2	Confident	95 Å²	95	39.5 Å²	39.5	51%	0.508	19%	0.194	S	C	.	.			trans	-100	138.7	175.4	-173.8	-11.6	0	0	0	109.3	A271 L272 T273	N269-A271 PolarHBondContact O-N 3.47Å; N269-A271 PolarHBondContact OD1-N 3.06Å; N269-L272 HydrophobicContact CB-CB 4.19Å; N269-L272 WeakPolarHBondContact O-CA 3.12Å; N269-L272 VanDerWaalsContact O-CB 3.3Å; N269-L272 WeakPolarHBondContact O-CB 3.49Å; N269-L272 PolarHBondContact O-N 3.37Å; N269-T273 PolarHBondContact O-N 3.31Å; N269-T273 VanDerWaalsContact O-N 3.12Å; N269-T273 PolarHBondContact O-OG1 3.02Å
270	Q	85.9	Confident	84.4	Confident	136 Å²	136	39.1 Å²	39.1	64%	0.636	19%	0.193	S	C	*	.	H	α-helix	trans	-52.9	-41.7	174.4	-169.7	178.4	9.1	0	0	112.1	L272 T273 W274	Q270-L272 VanDerWaalsContact C-N 3.27Å; Q270-L272 PolarHBondContact O-N 3.43Å; Q270-T273 WeakPolarHBondContact CA-OG1 3.27Å; Q270-T273 VanDerWaalsContact O-CB 3.24Å; Q270-T273 WeakPolarHBondContact O-CB 3.28Å; Q270-T273 PolarHBondContact O-N 3.47Å; Q270-T273 VanDerWaalsContact O-N 3.14Å; Q270-T273 PolarHBondContact O-OG1 3.34Å; Q270-W274 PolarHBondContact O-N 3.48Å
271	A	87.5	Confident	84.7	Confident	45 Å²	45	43.3 Å²	43.3	37%	0.372	21%	0.213	S	C	.	.	H	α-helix	trans	-65	-29.5	177	0	0	0	0	0	113.1	N269 K275	N269-A271 PolarHBondContact O-N 3.47Å; N269-A271 PolarHBondContact OD1-N 3.06Å; A271-K275 WeakPolarHBondContact O-CG 3.34Å
272	L	88.7	Confident	85.1	Confident	10 Å²	10	41.3 Å²	41.3	5%	0.052	20%	0.204	C	C	.	.	H	α-helix	trans	-70.6	-39.6	173.7	-178.5	61.7	0	0	0	110.5	D236 W268 N269 Q270 W274 K275 V276	D236-L272 HydrophobicContact CB-CD1 3.73Å; D236-L272 HydrophobicContact CB-CD2 4.38Å; W268-L272 HydrophobicContact CD2-CD2 4.16Å; W268-L272 HydrophobicContact CE3-CD2 3.74Å; W268-L272 HydrophobicContact CE3-CG 4.42Å; W268-L272 HydrophobicContact CH2-CD2 4.38Å; W268-L272 HydrophobicContact CH2-CG 4.36Å; W268-L272 HydrophobicContact CZ2-CG 4.36Å; W268-L272 HydrophobicContact CZ3-CD2 3.89Å; W268-L272 HydrophobicContact CZ3-CG 4.36Å; N269-L272 HydrophobicContact CB-CB 4.19Å; N269-L272 WeakPolarHBondContact O-CA 3.12Å; N269-L272 VanDerWaalsContact O-CB 3.3Å; N269-L272 WeakPolarHBondContact O-CB 3.49Å; N269-L272 PolarHBondContact O-N 3.37Å; Q270-L272 VanDerWaalsContact C-N 3.27Å; Q270-L272 PolarHBondContact O-N 3.43Å; L272-W274 VanDerWaalsContact C-N 3.31Å; L272-W274 PolarHBondContact O-N 2.91Å; L272-K275 PolarHBondContact O-N 2.92Å; L272-K275 VanDerWaalsContact O-N 3.11Å; L272-V276 HydrophobicContact CD1-CG2 3.89Å; L272-V276 HydrophobicContact CG-CG2 3.95Å; L272-V276 WeakPolarHBondContact O-CB 3.38Å; L272-V276 VanDerWaalsContact O-CG2 3.27Å; L272-V276 WeakPolarHBondContact O-CG2 3.45Å; L272-V276 PolarHBondContact O-N 2.97Å
273	T	91.8	Very high	85.6	Confident	38 Å²	38	39.8 Å²	39.8	23%	0.233	20%	0.196	C	C	.	.	H	α-helix	trans	-50.7	-50.6	175.4	-28.1	0	0	0	0	112.2	L261 W268 N269 Q270 K275 V276 L277	L261-T273 HydrophobicContact CD1-CG2 4.42Å; W268-T273 HydrophobicContact CZ2-CG2 4.43Å; W268-T273 PolarHBondContact NE1-OG1 3.29Å; N269-T273 PolarHBondContact O-N 3.31Å; N269-T273 VanDerWaalsContact O-N 3.12Å; N269-T273 PolarHBondContact O-OG1 3.02Å; Q270-T273 WeakPolarHBondContact CA-OG1 3.27Å; Q270-T273 VanDerWaalsContact O-CB 3.24Å; Q270-T273 WeakPolarHBondContact O-CB 3.28Å; Q270-T273 PolarHBondContact O-N 3.47Å; Q270-T273 VanDerWaalsContact O-N 3.14Å; Q270-T273 PolarHBondContact O-OG1 3.34Å; T273-K275 VanDerWaalsContact C-N 3.31Å; T273-K275 PolarHBondContact O-N 3.46Å; T273-V276 PolarHBondContact O-N 3.16Å; T273-L277 WeakPolarHBondContact O-CB 3.35Å; T273-L277 PolarHBondContact O-N 3.08Å
274	W	93.3	Very high	86.6	Confident	153 Å²	153	39.7 Å²	39.7	58%	0.58	20%	0.197	S	C	*	.	H	α-helix	trans	-63.1	-38.4	-178.5	-70	116.6	0	0	0	112.4	W77 Q270 L272 L277 F278	W77-W274 HydrophobicContact CH2-CB 4.06Å; Q270-W274 PolarHBondContact O-N 3.48Å; L272-W274 VanDerWaalsContact C-N 3.31Å; L272-W274 PolarHBondContact O-N 2.91Å; W274-L277 HydrophobicContact CE3-CD2 4.22Å; W274-L277 HydrophobicContact CZ3-CD2 4.15Å; W274-F278 VanDerWaalsContact O-CB 3.29Å; W274-F278 WeakPolarHBondContact O-CB 3.33Å; W274-F278 PolarHBondContact O-N 2.96Å
275	K	93.9	Very high	88	Confident	8 Å²	8	44.9 Å²	44.9	4%	0.035	22%	0.219	C	C	.	.	H	α-helix	trans	-67	-46.2	176	-66.1	173.2	-163.5	-173.8	0	111.2	E73 R76 W77 V80 A271 L272 T273 L277 F278 C279	E73-K275 VanDerWaalsContact CD-NZ 3.26Å; E73-K275 WeakPolarHBondContact OE1-CE 3.48Å; E73-K275 IonicContact OE1-NZ 3.53Å; E73-K275 PolarHBondContact OE1-NZ 2.95Å; E73-K275 IonicContact OE2-NZ 2.75Å; E73-K275 PolarHBondContact OE2-NZ 3.25Å; R76-K275 HydrophobicContact CG-CD 4.42Å; W77-K275 HydrophobicContact CD2-CG 4.34Å; W77-K275 HydrophobicContact CE3-CG 4.43Å; W77-K275 HydrophobicContact CH2-CG 3.96Å; W77-K275 HydrophobicContact CZ2-CG 3.82Å; W77-K275 HydrophobicContact CZ3-CG 4.26Å; V80-K275 HydrophobicContact CG1-CB 4.38Å; V80-K275 WeakPolarHBondContact CG1-O 3.43Å; V80-K275 HydrophobicContact CG2-CB 4.29Å; A271-K275 WeakPolarHBondContact O-CG 3.34Å; L272-K275 PolarHBondContact O-N 2.92Å; L272-K275 VanDerWaalsContact O-N 3.11Å; T273-K275 VanDerWaalsContact C-N 3.31Å; T273-K275 PolarHBondContact O-N 3.46Å; K275-L277 VanDerWaalsContact C-N 3.32Å; K275-L277 PolarHBondContact O-N 2.85Å; K275-F278 PolarHBondContact O-N 3.44Å; K275-C279 WeakPolarHBondContact O-CB 3.47Å; K275-C279 PolarHBondContact O-N 3.36Å
276	V	94.9	Very high	89.5	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-63.7	-39.8	179.6	173.9	0	0	0	0	110.9	A240 A243 T257 W268 L272 T273 C279 S280	A240-V276 HydrophobicContact CB-CG2 3.98Å; A243-V276 HydrophobicContact CB-CG1 3.38Å; T257-V276 HydrophobicContact CG2-CG1 3.84Å; W268-V276 HydrophobicContact CH2-CB 4.12Å; W268-V276 HydrophobicContact CH2-CG1 4.05Å; W268-V276 HydrophobicContact CH2-CG2 3.68Å; W268-V276 HydrophobicContact CZ2-CB 4.11Å; W268-V276 HydrophobicContact CZ2-CG1 4.32Å; W268-V276 HydrophobicContact CZ2-CG2 3.96Å; L272-V276 HydrophobicContact CD1-CG2 3.89Å; L272-V276 HydrophobicContact CG-CG2 3.95Å; L272-V276 WeakPolarHBondContact O-CB 3.38Å; L272-V276 VanDerWaalsContact O-CG2 3.27Å; L272-V276 WeakPolarHBondContact O-CG2 3.45Å; L272-V276 PolarHBondContact O-N 2.97Å; T273-V276 PolarHBondContact O-N 3.16Å; V276-C279 WeakPolarHBondContact O-CB 3.48Å; V276-C279 PolarHBondContact O-N 3.03Å; V276-S280 WeakPolarHBondContact O-CB 3.25Å; V276-S280 PolarHBondContact O-N 3.27Å; V276-S280 PolarHBondContact O-OG 2.95Å
277	L	95.6	Very high	90.7	Very high	31 Å²	31	43.7 Å²	43.7	16%	0.162	21%	0.21	C	C	.	.	H	α-helix	trans	-64.1	-47.7	175	-174.6	64.9	0	0	0	111.6	I254 T257 T273 W274 K275 C279 S280 M281	I254-L277 HydrophobicContact CG1-CD1 4.21Å; T257-L277 HydrophobicContact CG2-CB 3.83Å; T257-L277 HydrophobicContact CG2-CD1 3.66Å; T257-L277 HydrophobicContact CG2-CG 4.37Å; T273-L277 WeakPolarHBondContact O-CB 3.35Å; T273-L277 PolarHBondContact O-N 3.08Å; W274-L277 HydrophobicContact CE3-CD2 4.22Å; W274-L277 HydrophobicContact CZ3-CD2 4.15Å; K275-L277 VanDerWaalsContact C-N 3.32Å; K275-L277 PolarHBondContact O-N 2.85Å; L277-C279 VanDerWaalsContact C-N 3.33Å; L277-C279 PolarHBondContact O-N 2.93Å; L277-S280 PolarHBondContact O-N 3.14Å; L277-S280 VanDerWaalsContact O-N 3.13Å; L277-M281 HydrophobicContact CD1-CE 3.89Å; L277-M281 HydrophobicContact CD2-CE 3.99Å; L277-M281 HydrophobicContact CG-CE 3.78Å; L277-M281 HydrophobicContact CG-SD 4.2Å; L277-M281 WeakPolarHBondContact O-CG 2.94Å; L277-M281 PolarHBondContact O-N 3.38Å
278	F	96.7	Very high	91.7	Very high	76 Å²	76	42.9 Å²	42.9	33%	0.333	21%	0.208	S	C	.	.	H	α-helix	trans	-60.8	-40.8	176.5	177.9	-109.8	0	0	0	112.8	W77 V80 F81 W274 K275 S280 M281 S282	W77-F278 HydrophobicContact CE3-CB 4.46Å; W77-F278 AromaticContact CE3-CD1 3.66Å; W77-F278 HydrophobicContact CE3-CD1 3.66Å; W77-F278 HydrophobicContact CE3-CE1 4.07Å; W77-F278 HydrophobicContact CE3-CG 4.14Å; W77-F278 HydrophobicContact CZ3-CB 3.68Å; W77-F278 AromaticContact CZ3-CD1 3.73Å; W77-F278 HydrophobicContact CZ3-CD1 3.73Å; W77-F278 HydrophobicContact CZ3-CE1 4.49Å; W77-F278 AromaticContact CZ3-CG 3.74Å; W77-F278 HydrophobicContact CZ3-CG 3.74Å; V80-F278 HydrophobicContact CG1-CD1 4.26Å; F81-F278 HydrophobicContact CB-CE1 3.81Å; F81-F278 HydrophobicContact CB-CZ 4.3Å; F81-F278 HydrophobicContact CD2-CE1 4.04Å; F81-F278 AromaticContact CD2-CZ 3.77Å; F81-F278 HydrophobicContact CD2-CZ 3.77Å; F81-F278 HydrophobicContact CG-CE1 4.39Å; F81-F278 HydrophobicContact CG-CZ 4.42Å; W274-F278 VanDerWaalsContact O-CB 3.29Å; W274-F278 WeakPolarHBondContact O-CB 3.33Å; W274-F278 PolarHBondContact O-N 2.96Å; K275-F278 PolarHBondContact O-N 3.44Å; F278-S280 VanDerWaalsContact C-N 3.32Å; F278-S280 PolarHBondContact O-N 3.45Å; F278-M281 PolarHBondContact O-N 3.36Å; F278-S282 PolarHBondContact O-N 2.93Å; F278-S282 PolarHBondContact O-OG 3.19Å
279	C	96.5	Very high	92.3	Very high	0 Å²	0	43 Å²	43	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-58.3	-43.9	172.7	-161.7	0	0	0	0	112.2	V80 G84 A240 K275 V276 L277 S282 A283	V80-C279 HydrophobicContact CG1-CB 3.48Å; V80-C279 VanDerWaalsContact CG1-CB 3.48Å; V80-C279 PolarHBondContact O-SG 3.4Å; G84-C279 WeakPolarHBondContact CA-O 3.35Å; A240-C279 HydrophobicContact CB-CB 4.11Å; A240-C279 PolarHBondContact O-SG 2.93Å; K275-C279 WeakPolarHBondContact O-CB 3.47Å; K275-C279 PolarHBondContact O-N 3.36Å; V276-C279 WeakPolarHBondContact O-CB 3.48Å; V276-C279 PolarHBondContact O-N 3.03Å; L277-C279 VanDerWaalsContact C-N 3.33Å; L277-C279 PolarHBondContact O-N 2.93Å; C279-S282 PolarHBondContact O-N 3.49Å; C279-S282 PolarHBondContact O-OG 3.15Å; C279-A283 PolarHBondContact O-N 3.13Å; C279-A283 VanDerWaalsContact O-N 3.07Å
280	S	96.1	Very high	92.8	Very high	0 Å²	0	42 Å²	42	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-69.5	-42.3	-177.6	-58.3	0	0	0	0	111.3	A243 V276 L277 F278 A283 T284	A243-S280 WeakPolarHBondContact CB-OG 3.39Å; V276-S280 WeakPolarHBondContact O-CB 3.25Å; V276-S280 PolarHBondContact O-N 3.27Å; V276-S280 PolarHBondContact O-OG 2.95Å; L277-S280 PolarHBondContact O-N 3.14Å; L277-S280 VanDerWaalsContact O-N 3.13Å; F278-S280 VanDerWaalsContact C-N 3.32Å; F278-S280 PolarHBondContact O-N 3.45Å; S280-A283 PolarHBondContact O-N 3.35Å; S280-T284 PolarHBondContact O-N 2.72Å; S280-T284 VanDerWaalsContact O-N 3.09Å; S280-T284 PolarHBondContact O-OG1 2.86Å
281	M	95.8	Very high	92.7	Very high	88 Å²	88	37 Å²	37	43%	0.433	18%	0.176	S	C	.	.	H	α-helix	trans	-63.8	-39.9	173.9	-71	176.2	171.5	0	0	112.4	P253 L277 F278 A283 T284 F285	P253-M281 HydrophobicContact CB-CG 4.05Å; P253-M281 HydrophobicContact CG-CG 4.46Å; L277-M281 HydrophobicContact CD1-CE 3.89Å; L277-M281 HydrophobicContact CD2-CE 3.99Å; L277-M281 HydrophobicContact CG-CE 3.78Å; L277-M281 HydrophobicContact CG-SD 4.2Å; L277-M281 WeakPolarHBondContact O-CG 2.94Å; L277-M281 PolarHBondContact O-N 3.38Å; F278-M281 PolarHBondContact O-N 3.36Å; M281-A283 VanDerWaalsContact C-N 3.34Å; M281-T284 PolarHBondContact O-OG1 3.45Å; M281-F285 WeakPolarHBondContact O-CB 3.21Å; M281-F285 PolarHBondContact O-N 3.16Å
282	S	95.9	Very high	92.6	Very high	8 Å²	8	34.9 Å²	34.9	6%	0.056	16%	0.159	C	C	.	.	H	α-helix	trans	-68.7	-34.6	177.6	66.2	0	0	0	0	111.9	G84 F278 C279 T286	G84-S282 WeakPolarHBondContact CA-OG 3.33Å; F278-S282 PolarHBondContact O-N 2.93Å; F278-S282 PolarHBondContact O-OG 3.19Å; C279-S282 PolarHBondContact O-N 3.49Å; C279-S282 PolarHBondContact O-OG 3.15Å; S282-T286 VanDerWaalsContact O-CB 3.26Å; S282-T286 WeakPolarHBondContact O-CB 3.32Å; S282-T286 PolarHBondContact O-N 2.57Å; S282-T286 PolarHBondContact O-OG1 2.8Å
283	A	95.9	Very high	92.4	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-65.4	-48.4	174.5	0	0	0	0	0	113	G84 A244 C279 S280 M281 T286 L287	G84-A283 WeakPolarHBondContact O-CA 3.13Å; G84-A283 VanDerWaalsContact O-CB 3.31Å; G84-A283 WeakPolarHBondContact O-CB 3.18Å; A244-A283 HydrophobicContact CB-CB 3.84Å; C279-A283 PolarHBondContact O-N 3.13Å; C279-A283 VanDerWaalsContact O-N 3.07Å; S280-A283 PolarHBondContact O-N 3.35Å; M281-A283 VanDerWaalsContact C-N 3.34Å; A283-T286 PolarHBondContact O-N 2.91Å; A283-L287 WeakPolarHBondContact O-CB 3.43Å; A283-L287 PolarHBondContact O-N 3.46Å
284	T	93.2	Very high	92	Very high	17 Å²	17	36.7 Å²	36.7	10%	0.104	17%	0.168	C	C	.	.	H	α-helix	trans	-64.2	-43.7	177.7	50.5	0	0	0	0	111.7	A247 P253 S280 M281 T286 L287 N288	A247-T284 VanDerWaalsContact C-CG2 3.47Å; A247-T284 HydrophobicContact CB-CG2 3.65Å; A247-T284 WeakPolarHBondContact O-CG2 3.18Å; P253-T284 HydrophobicContact CB-CG2 4.45Å; S280-T284 PolarHBondContact O-N 2.72Å; S280-T284 VanDerWaalsContact O-N 3.09Å; S280-T284 PolarHBondContact O-OG1 2.86Å; M281-T284 PolarHBondContact O-OG1 3.45Å; T284-T286 PolarHBondContact O-N 3.32Å; T284-L287 PolarHBondContact O-N 3.06Å; T284-N288 VanDerWaalsContact O-CB 3.3Å; T284-N288 WeakPolarHBondContact O-CB 3.38Å; T284-N288 PolarHBondContact O-N 3.4Å
285	F	92.5	Very high	91.3	Very high	111 Å²	111	33.9 Å²	33.9	49%	0.487	16%	0.164	S	C	.	.	H	α-helix	trans	-60.7	-45.8	176.9	-178	-95	0	0	0	111.7	M281 N288 F289 F302	M281-F285 WeakPolarHBondContact O-CB 3.21Å; M281-F285 PolarHBondContact O-N 3.16Å; F285-N288 PolarHBondContact O-N 2.53Å; F285-F289 VanDerWaalsContact O-CB 3.22Å; F285-F289 WeakPolarHBondContact O-CB 3.31Å; F285-F289 PolarHBondContact O-N 3.14Å; F285-F302 AromaticContact CD2-CE1 3.89Å; F285-F302 HydrophobicContact CD2-CE1 3.89Å; F285-F302 HydrophobicContact CD2-CZ 4.33Å; F285-F302 HydrophobicContact CE2-CD1 4.43Å; F285-F302 AromaticContact CE2-CE1 3.4Å; F285-F302 HydrophobicContact CE2-CE1 3.4Å; F285-F302 AromaticContact CE2-CZ 3.45Å; F285-F302 HydrophobicContact CE2-CZ 3.45Å; F285-F302 VanDerWaalsContact CE2-CZ 3.45Å; F285-F302 HydrophobicContact CZ-CE1 4.06Å; F285-F302 HydrophobicContact CZ-CZ 4.01Å
286	T	93.4	Very high	90.5	Very high	11 Å²	11	38.1 Å²	38.1	7%	0.067	18%	0.183	C	C	.	.	H	α-helix	trans	-61.2	-48.8	178.7	-58.5	0	0	0	0	110.8	V85 L89 S282 A283 T284 N288 F289 F290	V85-T286 HydrophobicContact CG1-CG2 4.08Å; L89-T286 HydrophobicContact CD2-CG2 4.28Å; L89-T286 HydrophobicContact CG-CG2 4.17Å; S282-T286 VanDerWaalsContact O-CB 3.26Å; S282-T286 WeakPolarHBondContact O-CB 3.32Å; S282-T286 PolarHBondContact O-N 2.57Å; S282-T286 PolarHBondContact O-OG1 2.8Å; A283-T286 PolarHBondContact O-N 2.91Å; T284-T286 PolarHBondContact O-N 3.32Å; T286-N288 PolarHBondContact O-N 3.05Å; T286-F289 PolarHBondContact O-N 3.42Å; T286-F290 HydrophobicContact CG2-CD2 3.77Å; T286-F290 HydrophobicContact CG2-CE2 3.78Å; T286-F290 VanDerWaalsContact O-CD2 3.26Å; T286-F290 WeakPolarHBondContact O-CD2 3.26Å; T286-F290 PolarHBondContact O-N 3.24Å
287	L	91.2	Very high	89.9	Confident	1 Å²	1	44.7 Å²	44.7	1%	0.005	22%	0.218	C	C	.	.	H	α-helix	trans	-58.1	-50.2	178.4	180	65.7	0	0	0	111.4	L92 A248 A283 T284 R291 L307	L92-L287 HydrophobicContact CB-CD1 3.84Å; A248-L287 HydrophobicContact CB-CD2 4.33Å; A248-L287 WeakPolarHBondContact O-CD2 3.46Å; A283-L287 WeakPolarHBondContact O-CB 3.43Å; A283-L287 PolarHBondContact O-N 3.46Å; T284-L287 PolarHBondContact O-N 3.06Å; L287-R291 WeakPolarHBondContact O-CB 3.29Å; L287-R291 PolarHBondContact O-N 3.29Å; L287-L307 HydrophobicContact CD2-CG 4.37Å
288	N	88.8	Confident	89	Confident	12 Å²	12	50.3 Å²	50.3	6%	0.064	24%	0.241	C	C	.	.	H	α-helix	trans	-64.4	-43.2	-177.7	-165	-5.6	0	0	0	111.7	T284 F285 T286 F290 R291 S292 F302 L304	T284-N288 VanDerWaalsContact O-CB 3.3Å; T284-N288 WeakPolarHBondContact O-CB 3.38Å; T284-N288 PolarHBondContact O-N 3.4Å; F285-N288 PolarHBondContact O-N 2.53Å; T286-N288 PolarHBondContact O-N 3.05Å; N288-F290 PolarHBondContact O-N 3.42Å; N288-R291 PolarHBondContact O-N 3.04Å; N288-S292 VanDerWaalsContact O-CB 3.29Å; N288-S292 WeakPolarHBondContact O-CB 3.36Å; N288-S292 PolarHBondContact O-N 3.37Å; N288-F302 HydrophobicContact CB-CD1 4.45Å; N288-F302 WeakPolarHBondContact ND2-CA 3.17Å; N288-L304 PolarHBondContact OD1-N 2.77Å; N288-L304 PolarHBondContact OD1-O 3.08Å
289	F	90.4	Very high	88.2	Confident	63 Å²	63	55 Å²	55	28%	0.276	26%	0.256	S	S	.	.	H	α-helix	trans	-57.2	-51.3	178.3	178.7	-100	0	0	0	112.2	F285 T286 G293 W299	F285-F289 VanDerWaalsContact O-CB 3.22Å; F285-F289 WeakPolarHBondContact O-CB 3.31Å; F285-F289 PolarHBondContact O-N 3.14Å; T286-F289 PolarHBondContact O-N 3.42Å; F289-G293 PolarHBondContact O-N 2.96Å; F289-W299 AromaticContact CE1-CE3 3.69Å; F289-W299 HydrophobicContact CE1-CE3 3.69Å; F289-W299 AromaticContact CE1-CZ3 3.73Å; F289-W299 HydrophobicContact CE1-CZ3 3.73Å; F289-W299 HydrophobicContact CE2-CE3 4.26Å; F289-W299 AromaticContact CZ-CE3 3.51Å; F289-W299 HydrophobicContact CZ-CE3 3.51Å; F289-W299 AromaticContact CZ-CZ3 3.98Å; F289-W299 HydrophobicContact CZ-CZ3 3.98Å
290	F	89.9	Confident	86.8	Confident	74 Å²	74	56.7 Å²	56.7	33%	0.325	28%	0.275	S	S	.	.	H	α-helix	trans	-74.4	-36.8	-179.3	-76.8	-73	0	0	0	112.5	L89 L92 T286 N288 S292 G293 I294	L89-F290 HydrophobicContact CD2-CD2 3.77Å; L89-F290 HydrophobicContact CD2-CE2 3.61Å; L89-F290 HydrophobicContact CD2-CG 4.47Å; L89-F290 HydrophobicContact CD2-CZ 4.16Å; L92-F290 HydrophobicContact CD1-CB 3.23Å; L92-F290 HydrophobicContact CD1-CG 4.35Å; T286-F290 HydrophobicContact CG2-CD2 3.77Å; T286-F290 HydrophobicContact CG2-CE2 3.78Å; T286-F290 VanDerWaalsContact O-CD2 3.26Å; T286-F290 WeakPolarHBondContact O-CD2 3.26Å; T286-F290 PolarHBondContact O-N 3.24Å; N288-F290 PolarHBondContact O-N 3.42Å; F290-S292 PolarHBondContact O-N 3.11Å; F290-G293 PolarHBondContact O-N 3.11Å; F290-I294 WeakPolarHBondContact O-CG1 3.4Å; F290-I294 PolarHBondContact O-N 3.41Å
291	R	84.7	Confident	85.7	Confident	30 Å²	30	58.2 Å²	58.2	11%	0.113	29%	0.285	C	S	.	.	H	α-helix	trans	-63	-42.2	177.2	-171.3	175.3	-170.4	-179.4	8.2	111.7	D95 L287 N288 G293 I294 N295 G306 L307	D95-R291 IonicContact OD2-CZ 2.71Å; D95-R291 IonicContact OD2-NE 3.92Å; D95-R291 PolarHBondContact OD2-NE 3.07Å; D95-R291 IonicContact OD2-NH2 2.93Å; D95-R291 PolarHBondContact OD2-NH2 2.92Å; L287-R291 WeakPolarHBondContact O-CB 3.29Å; L287-R291 PolarHBondContact O-N 3.29Å; N288-R291 PolarHBondContact O-N 3.04Å; R291-G293 VanDerWaalsContact C-N 3.34Å; R291-I294 PolarHBondContact O-N 2.99Å; R291-N295 WeakPolarHBondContact O-CB 3.38Å; R291-N295 PolarHBondContact O-N 3.49Å; R291-G306 PolarHBondContact NH1-O 3.22Å; R291-L307 PolarHBondContact NH1-O 3.28Å
292	S	85.1	Confident	84.5	Confident	2 Å²	2	59.4 Å²	59.4	1%	0.014	29%	0.288	C	S	.	.	H	α-helix	trans	-62.8	-41	174.5	-175.9	0	0	0	0	112.1	N288 F290 F296 K298 S301	N288-S292 VanDerWaalsContact O-CB 3.29Å; N288-S292 WeakPolarHBondContact O-CB 3.36Å; N288-S292 PolarHBondContact O-N 3.37Å; F290-S292 PolarHBondContact O-N 3.11Å; S292-F296 PolarHBondContact O-N 2.86Å; S292-K298 CarbonylContact C-O 3.44Å; S292-K298 PolarHBondContact OG-O 3.14Å; S292-S301 VanDerWaalsContact CB-O 3.26Å; S292-S301 WeakPolarHBondContact CB-O 3.17Å; S292-S301 PolarHBondContact OG-O 3.34Å; S292-S301 PolarHBondContact OG-OG 2.71Å
293	G	85	Confident	83.2	Confident	6 Å²	6	65.4 Å²	65.4	6%	0.062	32%	0.315	C	S	.	.	H	α-helix	trans	-60.9	-44.1	175.9	0	0	0	0	0	112.9	F289 F290 R291 N297	F289-G293 PolarHBondContact O-N 2.96Å; F290-G293 PolarHBondContact O-N 3.11Å; R291-G293 VanDerWaalsContact C-N 3.34Å; G293-N297 WeakPolarHBondContact O-CA 3.41Å; G293-N297 PolarHBondContact O-N 3.41Å; G293-N297 PolarHBondContact O-OD1 3Å
294	I	83.9	Confident	81.8	Confident	80 Å²	80	66.8 Å²	66.8	41%	0.41	32%	0.323	S	S	.	.	H	α-helix	trans	-72.9	-42.9	-178.2	-65.4	168.9	0	0	0	112.1	L92 F96 F290 R291	L92-I294 HydrophobicContact CD1-CD1 4.07Å; L92-I294 HydrophobicContact CD2-CD1 3.97Å; L92-I294 HydrophobicContact CG-CD1 4.35Å; F96-I294 HydrophobicContact CD2-CG2 4.37Å; F96-I294 HydrophobicContact CE2-CG2 4.35Å; F290-I294 WeakPolarHBondContact O-CG1 3.4Å; F290-I294 PolarHBondContact O-N 3.41Å; R291-I294 PolarHBondContact O-N 2.99Å
295	N	78.7	Confident	80.7	Confident	94 Å²	94	68.1 Å²	68.1	50%	0.503	33%	0.332	S	S	.	.	H	α-helix	trans	-85.8	-40.3	-171.7	-71.9	-4.1	0	0	0	113.4	R291	R291-N295 WeakPolarHBondContact O-CB 3.38Å; R291-N295 PolarHBondContact O-N 3.49Å
296	F	77.3	Confident	80.1	Confident	96 Å²	96	62.9 Å²	62.9	42%	0.421	31%	0.308	S	S	.	.	H	α-helix	trans	-109.8	-2	-172	-60	-75.7	0	0	0	113.4	S292 K298 L304	S292-F296 PolarHBondContact O-N 2.86Å; F296-K298 HydrophobicContact CB-CB 4.29Å; F296-K298 PolarHBondContact O-N 3.36Å; F296-L304 HydrophobicContact CE2-CD1 3.56Å; F296-L304 HydrophobicContact CZ-CD1 4.17Å
297	N	80.4	Confident	79.4	Confident	138 Å²	138	62.4 Å²	62.4	74%	0.738	31%	0.306	S	S	*	.	S	Bend	trans	50.2	17.8	-169.3	-76.4	-29.3	0	0	0	113.6	G293	G293-N297 WeakPolarHBondContact O-CA 3.41Å; G293-N297 PolarHBondContact O-N 3.41Å; G293-N297 PolarHBondContact O-OD1 3Å
298	K	77.8	Confident	79	Confident	149 Å²	149	62.5 Å²	62.5	65%	0.648	31%	0.306	S	S	*	.			trans	-112.7	107.8	178.6	-73.5	178.7	-176.6	177.2	0	107.8	S292 F296 G300	S292-K298 CarbonylContact C-O 3.44Å; S292-K298 PolarHBondContact OG-O 3.14Å; F296-K298 HydrophobicContact CB-CB 4.29Å; F296-K298 PolarHBondContact O-N 3.36Å; K298-G300 PolarHBondContact O-N 3.14Å
299	W	79.9	Confident	78.7	Confident	174 Å²	174	64.4 Å²	64.4	66%	0.659	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.4	117.7	175.5	-59.6	69.9	0	0	0	107.3	F289	F289-W299 AromaticContact CE1-CE3 3.69Å; F289-W299 HydrophobicContact CE1-CE3 3.69Å; F289-W299 AromaticContact CE1-CZ3 3.73Å; F289-W299 HydrophobicContact CE1-CZ3 3.73Å; F289-W299 HydrophobicContact CE2-CE3 4.26Å; F289-W299 AromaticContact CZ-CE3 3.51Å; F289-W299 HydrophobicContact CZ-CE3 3.51Å; F289-W299 AromaticContact CZ-CZ3 3.98Å; F289-W299 HydrophobicContact CZ-CZ3 3.98Å
300	G	67.2	Low	78.3	Confident	37 Å²	37	61.5 Å²	61.5	38%	0.381	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	107.7	2.7	176.2	0	0	0	0	0	117.5	K298 F302	K298-G300 PolarHBondContact O-N 3.14Å; G300-F302 WeakPolarHBondContact O-CD2 3.39Å; G300-F302 WeakPolarHBondContact O-CE2 3.46Å
301	S	72.3	Confident	77.7	Confident	31 Å²	31	58.6 Å²	58.6	22%	0.217	29%	0.294	C	S	.	.			trans	-84.5	109.9	167.1	42.9	0	0	0	0	111.1	S292 Q303	S292-S301 VanDerWaalsContact CB-O 3.26Å; S292-S301 WeakPolarHBondContact CB-O 3.17Å; S292-S301 PolarHBondContact OG-O 3.34Å; S292-S301 PolarHBondContact OG-OG 2.71Å; S301-Q303 PolarHBondContact O-N 3.35Å
302	F	71.3	Confident	77.3	Confident	113 Å²	113	62.1 Å²	62.1	50%	0.496	31%	0.312	S	S	.	.			trans	-90.9	53.9	-173.1	-61	-69	0	0	0	113.8	F285 N288 G300	F285-F302 AromaticContact CD2-CE1 3.89Å; F285-F302 HydrophobicContact CD2-CE1 3.89Å; F285-F302 HydrophobicContact CD2-CZ 4.33Å; F285-F302 HydrophobicContact CE2-CD1 4.43Å; F285-F302 AromaticContact CE2-CE1 3.4Å; F285-F302 HydrophobicContact CE2-CE1 3.4Å; F285-F302 AromaticContact CE2-CZ 3.45Å; F285-F302 HydrophobicContact CE2-CZ 3.45Å; F285-F302 VanDerWaalsContact CE2-CZ 3.45Å; F285-F302 HydrophobicContact CZ-CE1 4.06Å; F285-F302 HydrophobicContact CZ-CZ 4.01Å; N288-F302 HydrophobicContact CB-CD1 4.45Å; N288-F302 WeakPolarHBondContact ND2-CA 3.17Å; G300-F302 WeakPolarHBondContact O-CD2 3.39Å; G300-F302 WeakPolarHBondContact O-CE2 3.46Å
303	Q	67.4	Low	77	Confident	134 Å²	134	62.2 Å²	62.2	63%	0.626	31%	0.312	S	S	*	.			trans	-91.8	-16.4	-173.8	-67.9	176.3	-13.7	0	0	114.6	S301 P305	S301-Q303 PolarHBondContact O-N 3.35Å; Q303-P305 WeakPolarHBondContact O-CD 3.27Å
304	L	68	Low	76.2	Confident	30 Å²	30	67.8 Å²	67.8	16%	0.157	34%	0.335	C	S	.	.			trans	-124.8	83.8	-174.6	-73.7	137.3	0	0	0	111.1	N288 F296 G306 N309	N288-L304 PolarHBondContact OD1-N 2.77Å; N288-L304 PolarHBondContact OD1-O 3.08Å; F296-L304 HydrophobicContact CE2-CD1 3.56Å; F296-L304 HydrophobicContact CZ-CD1 4.17Å; L304-G306 PolarHBondContact O-N 3.42Å; L304-N309 HydrophobicContact CD2-CB 4.35Å
305	P	70.2	Confident	75.3	Confident	45 Å²	45	65.6 Å²	65.6	29%	0.292	33%	0.326	S	S	.	.			trans	-72.6	-24.3	-170.8	27.4	-34.3	0	0	0	114.7	G251 Q303	G251-P305 VanDerWaalsContact CA-C 3.49Å; G251-P305 WeakPolarHBondContact CA-O 3.32Å; Q303-P305 WeakPolarHBondContact O-CD 3.27Å
306	G	79.4	Confident	74.2	Confident	0 Å²	0	66.1 Å²	66.1	0%	0	34%	0.337	C	S	.	.	S	Bend	trans	-139.4	174.3	-175.8	0	0	0	0	0	113.4	G251 R291 L304	G251-G306 VanDerWaalsContact CA-CA 3.49Å; R291-G306 PolarHBondContact NH1-O 3.22Å; L304-G306 PolarHBondContact O-N 3.42Å
307	L	79.1	Confident	72.9	Confident	2 Å²	2	70 Å²	70	1%	0.01	36%	0.362	C	S	.	.	S	Bend	trans	-59.7	-49.9	172.2	-70.7	170.4	0	0	0	110.6	D95 E196 M199 A248 A249 L287 R291	D95-L307 HydrophobicContact CB-CD2 3.44Å; D95-L307 VanDerWaalsContact CB-CD2 3.44Å; E196-L307 VanDerWaalsContact OE2-CD1 3.27Å; E196-L307 WeakPolarHBondContact OE2-CD1 3.38Å; M199-L307 HydrophobicContact CG-CD1 4.36Å; A248-L307 PolarHBondContact O-N 3.07Å; A249-L307 WeakPolarHBondContact O-CB 3.37Å; A249-L307 PolarHBondContact O-N 2.96Å; A249-L307 VanDerWaalsContact O-N 3.08Å; L287-L307 HydrophobicContact CD2-CG 4.37Å; R291-L307 PolarHBondContact NH1-O 3.28Å
308	L	81.9	Confident	71.4	Confident	2 Å²	2	66.7 Å²	66.7	1%	0.01	36%	0.361	C	S	.	.	S	Bend	trans	-92.6	122.3	173.8	-171.9	67.7	0	0	0	110.2	A249 F250 F310 E446 I449 V489 L492	A249-L308 PolarHBondContact O-N 3.27Å; F250-L308 HydrophobicContact CD1-CD2 4.09Å; F250-L308 HydrophobicContact CE1-CD2 4.14Å; L308-F310 HydrophobicContact CD1-CE1 4.19Å; L308-F310 HydrophobicContact CD2-CD1 4.39Å; L308-F310 HydrophobicContact CD2-CE1 3.37Å; L308-F310 HydrophobicContact CD2-CZ 3.44Å; L308-F310 VanDerWaalsContact CD2-CZ 3.44Å; L308-F310 HydrophobicContact CG-CD1 4.2Å; L308-F310 HydrophobicContact CG-CE1 3.63Å; L308-F310 HydrophobicContact CG-CZ 4.06Å; L308-E446 HydrophobicContact CD1-CB 4.08Å; L308-E446 HydrophobicContact CD1-CG 3.8Å; L308-I449 HydrophobicContact CD1-CD1 4.48Å; L308-V489 HydrophobicContact CD2-CG2 4.49Å; L308-L492 HydrophobicContact CD2-CD1 3.86Å
309	N	82.8	Confident	70.2	Confident	53 Å²	53	66.7 Å²	66.7	28%	0.283	36%	0.364	S	S	.	.			trans	-117.8	123.8	174.6	-172	-0.5	0	0	0	109.6	L304 G311	L304-N309 HydrophobicContact CD2-CB 4.35Å; N309-G311 PolarHBondContact OD1-N 3.49Å
310	F	81.6	Confident	68.8	Low	2 Å²	2	68.6 Å²	68.6	1%	0.009	38%	0.376	C	S	.	.			trans	-89.6	-2.9	178.9	-61.2	-42.6	0	0	0	114.1	L308 F313 I449 F453 H454 L492 L542 T546	L308-F310 HydrophobicContact CD1-CE1 4.19Å; L308-F310 HydrophobicContact CD2-CD1 4.39Å; L308-F310 HydrophobicContact CD2-CE1 3.37Å; L308-F310 HydrophobicContact CD2-CZ 3.44Å; L308-F310 VanDerWaalsContact CD2-CZ 3.44Å; L308-F310 HydrophobicContact CG-CD1 4.2Å; L308-F310 HydrophobicContact CG-CE1 3.63Å; L308-F310 HydrophobicContact CG-CZ 4.06Å; F310-F313 HydrophobicContact CB-CE2 4.18Å; F310-F313 WeakPolarHBondContact O-CE2 3.48Å; F310-I449 HydrophobicContact CD1-CG2 4.15Å; F310-I449 HydrophobicContact CE1-CG2 4.14Å; F310-F453 HydrophobicContact CB-CD2 4.26Å; F310-F453 HydrophobicContact CB-CE2 4.18Å; F310-F453 HydrophobicContact CD1-CD2 4.24Å; F310-F453 AromaticContact CD1-CE2 3.56Å; F310-F453 HydrophobicContact CD1-CE2 3.56Å; F310-F453 HydrophobicContact CE1-CE2 4.08Å; F310-F453 HydrophobicContact CG-CD2 4.5Å; F310-F453 AromaticContact CG-CE2 3.95Å; F310-F453 HydrophobicContact CG-CE2 3.95Å; F310-H454 PolarHBondContact O-CE1 2.93Å; F310-L492 HydrophobicContact CE1-CD1 4.28Å; F310-L492 HydrophobicContact CZ-CD1 3.86Å; F310-L542 HydrophobicContact CE2-CD2 3.84Å; F310-L542 HydrophobicContact CZ-CD2 4.33Å; F310-T546 HydrophobicContact CB-CG2 4.34Å; F310-T546 HydrophobicContact CD2-CG2 4.16Å
311	G	76.9	Confident	68.1	Low	13 Å²	13	76 Å²	76	13%	0.134	40%	0.398	C	S	.	.			trans	72.6	174.4	-176.6	0	0	0	0	0	113.7	N309	N309-G311 PolarHBondContact OD1-N 3.49Å
312	E	78	Confident	67.5	Low	103 Å²	103	77.2 Å²	77.2	48%	0.481	41%	0.406	S	S	.	.			trans	-89.5	118.4	-179.6	-63.9	-163.5	147.1	0	0	110.9	K314 N547	E312-K314 VanDerWaalsContact C-N 3.29Å; E312-K314 HydrophobicContact CB-CD 4.46Å; E312-K314 HydrophobicContact CB-CG 4.41Å; E312-K314 PolarHBondContact O-N 2.87Å; E312-K314 IonicContact OE1-NZ 3.61Å; E312-K314 PolarHBondContact OE1-NZ 3.37Å; E312-K314 VanDerWaalsContact OE1-NZ 3.15Å; E312-K314 WeakPolarHBondContact OE2-CE 3.49Å; E312-K314 IonicContact OE2-NZ 3.68Å; E312-K314 PolarHBondContact OE2-NZ 3.3Å; E312-N547 PolarHBondContact OE1-ND2 3.05Å
313	F	77.3	Confident	67.3	Low	4 Å²	4	79.2 Å²	79.2	2%	0.018	42%	0.417	C	S	.	.			trans	-84.7	71.3	173.7	-71	-99.7	0	0	0	110.5	F310 F453 Y515 L521 T546 Y551	F310-F313 HydrophobicContact CB-CE2 4.18Å; F310-F313 WeakPolarHBondContact O-CE2 3.48Å; F313-F453 HydrophobicContact CE1-CB 4.12Å; F313-F453 HydrophobicContact CE1-CG 4.41Å; F313-F453 HydrophobicContact CE2-CD2 4.32Å; F313-F453 HydrophobicContact CZ-CB 3.77Å; F313-F453 AromaticContact CZ-CD2 3.67Å; F313-F453 HydrophobicContact CZ-CD2 3.67Å; F313-F453 HydrophobicContact CZ-CE2 4.35Å; F313-F453 AromaticContact CZ-CG 3.78Å; F313-F453 HydrophobicContact CZ-CG 3.78Å; F313-Y515 HydrophobicContact CD1-CE1 4.39Å; F313-L521 HydrophobicContact CE1-CB 4.43Å; F313-L521 HydrophobicContact CE1-CD2 4.37Å; F313-L521 HydrophobicContact CE2-CD2 4.46Å; F313-L521 HydrophobicContact CZ-CB 4.38Å; F313-L521 HydrophobicContact CZ-CD1 4.49Å; F313-L521 HydrophobicContact CZ-CD2 4.21Å; F313-T546 HydrophobicContact CD2-CG2 3.89Å; F313-T546 HydrophobicContact CE2-CG2 3.66Å; F313-Y551 HydrophobicContact CB-CE2 3.59Å; F313-Y551 HydrophobicContact CD1-CE2 4.19Å; F313-Y551 AromaticContact CG-CE2 3.93Å; F313-Y551 HydrophobicContact CG-CE2 3.93Å
314	K	68.3	Low	67.5	Low	123 Å²	123	74.2 Å²	74.2	54%	0.535	39%	0.394	S	S	.	.			trans	-108.5	140.3	176.6	-70	177.4	-176.5	158.8	0	111.4	E312	E312-K314 VanDerWaalsContact C-N 3.29Å; E312-K314 HydrophobicContact CB-CD 4.46Å; E312-K314 HydrophobicContact CB-CG 4.41Å; E312-K314 PolarHBondContact O-N 2.87Å; E312-K314 IonicContact OE1-NZ 3.61Å; E312-K314 PolarHBondContact OE1-NZ 3.37Å; E312-K314 VanDerWaalsContact OE1-NZ 3.15Å; E312-K314 WeakPolarHBondContact OE2-CE 3.49Å; E312-K314 IonicContact OE2-NZ 3.68Å; E312-K314 PolarHBondContact OE2-NZ 3.3Å
315	C	65.2	Low	68.2	Low	35 Å²	35	76 Å²	76	24%	0.236	40%	0.399	C	S	.	.			trans	-68.5	137.3	163.2	-69.9	0	0	0	0	109.5	D317 C322 L324	C315-D317 PolarHBondContact O-N 2.94Å; C315-C322 HydrophobicContact CB-CB 3.37Å; C315-C322 WeakPolarHBondContact CB-SG 3.38Å; C315-C322 WeakPolarHBondContact SG-CB 3.41Å; C315-C322 PolarHBondContact SG-O 3.14Å; C315-C322 CovalentContact SG-SG 2.02Å; C315-C322 PolarHBondContact SG-SG 3.28Å; C315-L324 WeakPolarHBondContact SG-CD1 3.39Å
316	S	56.7	Low	68.9	Low	105 Å²	105	76.9 Å²	76.9	73%	0.734	40%	0.403	S	S	*	.			trans	-64.8	129.1	174.3	-163.8	0	0	0	0	109.7	G318 E319	S316-G318 PolarHBondContact O-N 2.89Å; S316-E319 PolarHBondContact O-N 3.02Å
317	D	48.8	Very low	69.2	Low	177 Å²	177	80.8 Å²	80.8	95%	0.947	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	0.1	-172.3	-78.2	-37.6	0	0	0	115.7	C315	C315-D317 PolarHBondContact O-N 2.94Å
318	G	50.2	Low	69.5	Low	69 Å²	69	85.5 Å²	85.5	71%	0.711	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.5	-20.1	177.8	0	0	0	0	0	115.8	S316	S316-G318 PolarHBondContact O-N 2.89Å
319	E	51.2	Low	69.8	Low	149 Å²	149	86.2 Å²	86.2	70%	0.696	47%	0.468	S	S	*	.			trans	-107.1	97.4	-176.3	-70.8	-172.3	177.2	0	0	111.6	S316 K321 C322	S316-E319 PolarHBondContact O-N 3.02Å; E319-K321 PolarHBondContact O-N 3.3Å; E319-C322 PolarHBondContact O-N 3.26Å
320	K	51.6	Low	70.2	Confident	213 Å²	213	85.7 Å²	85.7	93%	0.926	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	14.5	179.9	-69.1	-179.2	175.5	177.4	0	115.9
321	K	52.8	Low	70.7	Confident	193 Å²	193	87.9 Å²	87.9	84%	0.839	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	trans	-140.7	23.8	179.4	-72	-171	178.1	-179.7	0	114.1	E319 H323	E319-K321 PolarHBondContact O-N 3.3Å; K321-H323 PolarHBondContact O-N 3.45Å; K321-H323 VanDerWaalsContact O-N 3.15Å
322	C	59.6	Low	71.4	Confident	56 Å²	56	89.9 Å²	89.9	38%	0.378	49%	0.493	S	S	.	.			trans	-86.2	88	175.7	-173.7	0	0	0	0	110	C315 E319	C315-C322 HydrophobicContact CB-CB 3.37Å; C315-C322 WeakPolarHBondContact CB-SG 3.38Å; C315-C322 WeakPolarHBondContact SG-CB 3.41Å; C315-C322 PolarHBondContact SG-O 3.14Å; C315-C322 CovalentContact SG-SG 2.02Å; C315-C322 PolarHBondContact SG-SG 3.28Å; E319-C322 PolarHBondContact O-N 3.26Å
323	H	65.7	Low	72.2	Confident	156 Å²	156	85 Å²	85	72%	0.722	47%	0.47	S	S	*	.			trans	-84.4	118.1	162.4	-72.1	-75.2	0	0	0	107.8	K321 W325	K321-H323 PolarHBondContact O-N 3.45Å; K321-H323 VanDerWaalsContact O-N 3.15Å; H323-W325 PolarHBondContact O-N 3.35Å
324	L	73.2	Confident	73.1	Confident	29 Å²	29	87.4 Å²	87.4	15%	0.152	49%	0.486	C	S	.	.	S	Bend	trans	-55.2	-35	179.8	-117.6	61.8	0	0	0	112.7	C315 T518 E548 Y551	C315-L324 WeakPolarHBondContact SG-CD1 3.39Å; L324-T518 PolarHBondContact O-OG1 3.16Å; L324-E548 HydrophobicContact CD2-CG 3.95Å; L324-Y551 HydrophobicContact CB-CE1 4.19Å; L324-Y551 HydrophobicContact CD2-CD2 4.16Å; L324-Y551 HydrophobicContact CD2-CE1 3.72Å; L324-Y551 HydrophobicContact CD2-CE2 3.32Å; L324-Y551 WeakPolarHBondContact CD2-OH 3.17Å; L324-Y551 HydrophobicContact CG-CE1 4.06Å; L324-Y551 HydrophobicContact CG-CE2 4.31Å; L324-Y551 WeakPolarHBondContact CG-OH 3.2Å
325	W	82.2	Confident	74.5	Confident	67 Å²	67	86.6 Å²	86.6	25%	0.254	49%	0.486	S	S	.	.			trans	-152.3	154.2	175.5	62.8	-88	0	0	0	110.8	H323 F333 T550 L553 P554	H323-W325 PolarHBondContact O-N 3.35Å; W325-F333 HydrophobicContact CB-CE2 4.08Å; W325-F333 HydrophobicContact CB-CZ 4.27Å; W325-T550 PolarHBondContact NE1-O 2.9Å; W325-L553 HydrophobicContact CH2-CD2 3.97Å; W325-P554 HydrophobicContact CD2-CG 3.73Å; W325-P554 HydrophobicContact CE3-CG 4.15Å; W325-P554 HydrophobicContact CG-CG 4.12Å; W325-P554 HydrophobicContact CH2-CG 4.35Å; W325-P554 HydrophobicContact CZ2-CG 3.92Å; W325-P554 HydrophobicContact CZ3-CG 4.44Å
326	T	84.6	Confident	75.9	Confident	63 Å²	63	85.2 Å²	85.2	39%	0.387	48%	0.477	S	S	.	.			trans	-118.2	164.8	176.6	66.5	0	0	0	0	111.2	V328 D329 L330	T326-V328 PolarHBondContact O-N 3.43Å; T326-D329 WeakPolarHBondContact CB-OD2 3.35Å; T326-D329 PolarHBondContact N-OD2 3.42Å; T326-D329 WeakPolarHBondContact O-CB 3.48Å; T326-D329 PolarHBondContact O-N 3.17Å; T326-D329 VanDerWaalsContact OG1-CG 3.28Å; T326-D329 PolarHBondContact OG1-OD2 3.19Å; T326-L330 PolarHBondContact O-N 2.85Å
327	A	85	Confident	77.8	Confident	83 Å²	83	80.2 Å²	80.2	69%	0.686	44%	0.442	S	S	*	.	H	α-helix	trans	-60.9	-26.1	178.3	0	0	0	0	0	113.3	L330	A327-L330 WeakPolarHBondContact O-CB 3.49Å; A327-L330 PolarHBondContact O-N 2.73Å
328	V	86.6	Confident	80.2	Confident	100 Å²	100	74.2 Å²	74.2	61%	0.606	41%	0.411	S	S	*	.	H	α-helix	trans	-69.2	-38.5	174.6	-179.3	0	0	0	0	110.6	T326 L330 G331 F332	T326-V328 PolarHBondContact O-N 3.43Å; V328-L330 PolarHBondContact O-N 2.87Å; V328-G331 PolarHBondContact O-N 3.43Å; V328-G331 VanDerWaalsContact O-N 3.12Å; V328-F332 HydrophobicContact CG1-CE2 4.12Å
329	D	87.9	Confident	82.4	Confident	18 Å²	18	73.4 Å²	73.4	10%	0.096	39%	0.392	C	S	.	.	H	α-helix	trans	-62.5	-31	177	-56.5	-45.6	0	0	0	111.8	T326 G331 F332 F333 F519	T326-D329 WeakPolarHBondContact CB-OD2 3.35Å; T326-D329 PolarHBondContact N-OD2 3.42Å; T326-D329 WeakPolarHBondContact O-CB 3.48Å; T326-D329 PolarHBondContact O-N 3.17Å; T326-D329 VanDerWaalsContact OG1-CG 3.28Å; T326-D329 PolarHBondContact OG1-OD2 3.19Å; D329-G331 VanDerWaalsContact C-N 3.26Å; D329-G331 PolarHBondContact O-N 3.46Å; D329-F332 WeakPolarHBondContact O-CB 3.38Å; D329-F332 PolarHBondContact O-N 3.43Å; D329-F333 HydrophobicContact CB-CE1 4.2Å; D329-F333 HydrophobicContact CB-CE2 3.93Å; D329-F333 HydrophobicContact CB-CZ 3.71Å; D329-F333 WeakPolarHBondContact O-CD1 3.22Å; D329-F333 WeakPolarHBondContact O-CD2 3.4Å; D329-F333 WeakPolarHBondContact O-CG 3.44Å; D329-F333 PolarHBondContact O-N 3.07Å; D329-F519 HydrophobicContact CB-CE2 4.46Å; D329-F519 HydrophobicContact CB-CZ 4.29Å
330	L	90.8	Very high	84.6	Confident	41 Å²	41	66.3 Å²	66.3	22%	0.215	36%	0.359	C	S	.	.	H	α-helix	trans	-59.2	-35.7	175.8	-170.2	64.8	0	0	0	112.7	T326 A327 V328 F333 V334 L553 I557	T326-L330 PolarHBondContact O-N 2.85Å; A327-L330 WeakPolarHBondContact O-CB 3.49Å; A327-L330 PolarHBondContact O-N 2.73Å; V328-L330 PolarHBondContact O-N 2.87Å; L330-F333 HydrophobicContact CD1-CD2 4.27Å; L330-F333 WeakPolarHBondContact O-CB 3.24Å; L330-F333 PolarHBondContact O-N 3.08Å; L330-V334 WeakPolarHBondContact O-CG2 3.1Å; L330-V334 PolarHBondContact O-N 3.32Å; L330-L553 HydrophobicContact CD1-CD2 4.08Å; L330-L553 HydrophobicContact CD2-CD2 4.2Å; L330-I557 HydrophobicContact CD1-CD1 3.93Å; L330-I557 HydrophobicContact CD1-CG2 4.49Å; L330-I557 HydrophobicContact CD2-CD1 4.2Å
331	G	91.9	Very high	86.7	Confident	48 Å²	48	56.1 Å²	56.1	50%	0.495	32%	0.315	S	S	.	.	H	α-helix	trans	-63.5	-41.8	174	0	0	0	0	0	112.4	V328 D329 V334 L335	V328-G331 PolarHBondContact O-N 3.43Å; V328-G331 VanDerWaalsContact O-N 3.12Å; D329-G331 VanDerWaalsContact C-N 3.26Å; D329-G331 PolarHBondContact O-N 3.46Å; G331-V334 PolarHBondContact O-N 2.79Å; G331-L335 PolarHBondContact O-N 3Å
332	F	92.6	Very high	88.8	Confident	55 Å²	55	50.7 Å²	50.7	24%	0.241	29%	0.294	C	S	.	.	H	α-helix	trans	-68.1	-36	174.6	-66.8	-65.8	0	0	0	112.2	V328 D329 L335 M336 L506 L510 L512 F519	V328-F332 HydrophobicContact CG1-CE2 4.12Å; D329-F332 WeakPolarHBondContact O-CB 3.38Å; D329-F332 PolarHBondContact O-N 3.43Å; F332-L335 PolarHBondContact O-N 2.98Å; F332-M336 WeakPolarHBondContact O-CB 3.24Å; F332-M336 WeakPolarHBondContact O-CG 3.38Å; F332-M336 PolarHBondContact O-N 3.42Å; F332-L506 HydrophobicContact CD1-CD1 4.34Å; F332-L506 HydrophobicContact CD1-CD2 4.27Å; F332-L506 HydrophobicContact CE1-CD2 3.93Å; F332-L506 HydrophobicContact CG-CD1 4.35Å; F332-L506 HydrophobicContact CZ-CD2 4.34Å; F332-L510 HydrophobicContact CZ-CD1 4.5Å; F332-L512 HydrophobicContact CE2-CD1 4.48Å; F332-F519 HydrophobicContact CB-CE1 4Å; F332-F519 HydrophobicContact CB-CZ 4.37Å
333	F	95.2	Very high	90.6	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-62.3	-42.3	175.4	-64.2	-18.2	0	0	0	112	W325 D329 L330 M336 G337 T518 F519 I522 P554 T558	W325-F333 HydrophobicContact CB-CE2 4.08Å; W325-F333 HydrophobicContact CB-CZ 4.27Å; D329-F333 HydrophobicContact CB-CE1 4.2Å; D329-F333 HydrophobicContact CB-CE2 3.93Å; D329-F333 HydrophobicContact CB-CZ 3.71Å; D329-F333 WeakPolarHBondContact O-CD1 3.22Å; D329-F333 WeakPolarHBondContact O-CD2 3.4Å; D329-F333 WeakPolarHBondContact O-CG 3.44Å; D329-F333 PolarHBondContact O-N 3.07Å; L330-F333 HydrophobicContact CD1-CD2 4.27Å; L330-F333 WeakPolarHBondContact O-CB 3.24Å; L330-F333 PolarHBondContact O-N 3.08Å; F333-M336 PolarHBondContact O-N 2.88Å; F333-G337 PolarHBondContact O-N 3.44Å; F333-T518 HydrophobicContact CE1-CG2 4.41Å; F333-T518 HydrophobicContact CZ-CG2 3.8Å; F333-F519 HydrophobicContact CD1-CE1 4.36Å; F333-F519 HydrophobicContact CD1-CZ 4.41Å; F333-F519 HydrophobicContact CE1-CD1 4.24Å; F333-F519 HydrophobicContact CE1-CD2 4Å; F333-F519 AromaticContact CE1-CE1 4Å; F333-F519 HydrophobicContact CE1-CE1 4Å; F333-F519 AromaticContact CE1-CE2 3.7Å; F333-F519 HydrophobicContact CE1-CE2 3.7Å; F333-F519 HydrophobicContact CE1-CG 4.25Å; F333-F519 AromaticContact CE1-CZ 3.73Å; F333-F519 HydrophobicContact CE1-CZ 3.73Å; F333-F519 HydrophobicContact CZ-CE2 4.18Å; F333-F519 HydrophobicContact CZ-CZ 4.47Å; F333-I522 HydrophobicContact CB-CG2 4.15Å; F333-I522 HydrophobicContact CD1-CB 4.2Å; F333-I522 HydrophobicContact CD1-CG1 4.07Å; F333-I522 HydrophobicContact CD1-CG2 3.81Å; F333-I522 HydrophobicContact CE1-CB 4.38Å; F333-I522 HydrophobicContact CE1-CG1 3.97Å; F333-I522 HydrophobicContact CE1-CG2 4.47Å; F333-I522 HydrophobicContact CE2-CG1 4.44Å; F333-I522 HydrophobicContact CG-CG1 4.37Å; F333-I522 HydrophobicContact CG-CG2 4.05Å; F333-I522 HydrophobicContact CZ-CG1 4.17Å; F333-P554 HydrophobicContact CD2-CB 3.79Å; F333-P554 HydrophobicContact CD2-CG 4.41Å; F333-P554 HydrophobicContact CE2-CB 3.9Å; F333-P554 HydrophobicContact CE2-CG 4.24Å; F333-T558 HydrophobicContact CB-CG2 3.49Å; F333-T558 VanDerWaalsContact CB-CG2 3.49Å; F333-T558 HydrophobicContact CG-CG2 4.41Å; F333-T558 WeakPolarHBondContact O-CG2 3.22Å
334	V	96.2	Very high	92.1	Very high	56 Å²	56	42.2 Å²	42.2	34%	0.339	25%	0.25	S	S	.	.	H	α-helix	trans	-60.3	-46.5	173.2	170.6	0	0	0	0	111.2	L330 G331 M336 G337 V338 I557 V561	L330-V334 WeakPolarHBondContact O-CG2 3.1Å; L330-V334 PolarHBondContact O-N 3.32Å; G331-V334 PolarHBondContact O-N 2.79Å; V334-M336 VanDerWaalsContact C-N 3.33Å; V334-M336 PolarHBondContact O-N 3.04Å; V334-G337 WeakPolarHBondContact O-CA 3.39Å; V334-G337 PolarHBondContact O-N 3.38Å; V334-G337 VanDerWaalsContact O-N 3.09Å; V334-V338 PolarHBondContact O-N 3.09Å; V334-I557 HydrophobicContact CG2-CG2 3.73Å; V334-V561 HydrophobicContact CG1-CG1 4.4Å; V334-V561 HydrophobicContact CG1-CG2 4.26Å
335	L	95.8	Very high	93.2	Very high	106 Å²	106	41 Å²	41	56%	0.555	25%	0.245	S	C	*	.	H	α-helix	trans	-61.6	-42.1	177.7	-177.4	65	0	0	0	112	G331 F332 G337 V338 V339	G331-L335 PolarHBondContact O-N 3Å; F332-L335 PolarHBondContact O-N 2.98Å; L335-G337 VanDerWaalsContact C-N 3.29Å; L335-G337 PolarHBondContact O-N 3.32Å; L335-V338 WeakPolarHBondContact O-CB 3.28Å; L335-V338 PolarHBondContact O-N 2.9Å; L335-V339 WeakPolarHBondContact O-CG2 3.38Å; L335-V339 PolarHBondContact O-N 3.13Å
336	M	95.8	Very high	93.9	Very high	6 Å²	6	41.9 Å²	41.9	3%	0.03	25%	0.254	C	S	.	.	H	α-helix	trans	-63.1	-35.8	173.6	-76.9	179.2	48.6	0	0	112.3	F332 F333 V334 V339 G340 F498 V502 F519 I522 G523	F332-M336 WeakPolarHBondContact O-CB 3.24Å; F332-M336 WeakPolarHBondContact O-CG 3.38Å; F332-M336 PolarHBondContact O-N 3.42Å; F333-M336 PolarHBondContact O-N 2.88Å; V334-M336 VanDerWaalsContact C-N 3.33Å; V334-M336 PolarHBondContact O-N 3.04Å; M336-V339 PolarHBondContact O-N 3.24Å; M336-G340 PolarHBondContact O-N 3.1Å; M336-F498 HydrophobicContact CB-CE1 4.49Å; M336-F498 HydrophobicContact CE-CE1 4.48Å; M336-F498 HydrophobicContact CG-CE1 4.45Å; M336-V502 HydrophobicContact CG-CG1 4.28Å; M336-V502 HydrophobicContact SD-CB 4.41Å; M336-V502 HydrophobicContact SD-CG1 4Å; M336-F519 WeakPolarHBondContact CE-O 3.47Å; M336-F519 HydrophobicContact SD-CD1 3.7Å; M336-F519 HydrophobicContact SD-CE1 4.25Å; M336-I522 HydrophobicContact CE-CB 4.2Å; M336-I522 HydrophobicContact CE-CG2 3.98Å; M336-G523 VanDerWaalsContact CE-CA 3.42Å; M336-G523 VanDerWaalsContact CE-N 3.28Å
337	G	97.1	Very high	94.5	Very high	0 Å²	0	39 Å²	39	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-58.6	-45.3	171.4	0	0	0	0	0	111.9	F333 V334 L335 G340 G341 A562	F333-G337 PolarHBondContact O-N 3.44Å; V334-G337 WeakPolarHBondContact O-CA 3.39Å; V334-G337 PolarHBondContact O-N 3.38Å; V334-G337 VanDerWaalsContact O-N 3.09Å; L335-G337 VanDerWaalsContact C-N 3.29Å; L335-G337 PolarHBondContact O-N 3.32Å; G337-G340 PolarHBondContact O-N 3.36Å; G337-G341 PolarHBondContact O-N 2.7Å; G337-A562 VanDerWaalsContact O-CA 3.24Å; G337-A562 WeakPolarHBondContact O-CA 3.49Å; G337-A562 WeakPolarHBondContact O-CB 3.44Å
338	V	97.9	Very high	95	Very high	50 Å²	50	35 Å²	35	30%	0.303	20%	0.204	S	C	.	.	H	α-helix	trans	-60.5	-50.3	176.1	177.4	0	0	0	0	111.3	V334 L335 G341 L342 V561 T565	V334-V338 PolarHBondContact O-N 3.09Å; L335-V338 WeakPolarHBondContact O-CB 3.28Å; L335-V338 PolarHBondContact O-N 2.9Å; V338-G341 PolarHBondContact O-N 3.29Å; V338-L342 HydrophobicContact CG1-CD1 4.21Å; V338-L342 WeakPolarHBondContact O-CG 3.42Å; V338-L342 PolarHBondContact O-N 3Å; V338-V561 HydrophobicContact CG2-CG1 3.59Å; V338-T565 HydrophobicContact CB-CG2 4.19Å; V338-T565 HydrophobicContact CG1-CG2 4.11Å; V338-T565 HydrophobicContact CG2-CG2 3.94Å
339	V	97	Very high	95.4	Very high	52 Å²	52	33 Å²	33	32%	0.315	19%	0.193	S	C	.	.	H	α-helix	trans	-65.6	-41.8	-179.4	178.6	0	0	0	0	111.3	L335 M336 G341 L342 L343 F498	L335-V339 WeakPolarHBondContact O-CG2 3.38Å; L335-V339 PolarHBondContact O-N 3.13Å; M336-V339 PolarHBondContact O-N 3.24Å; V339-G341 VanDerWaalsContact C-N 3.35Å; V339-G341 PolarHBondContact O-N 3.38Å; V339-L342 PolarHBondContact O-N 2.87Å; V339-L343 HydrophobicContact CG1-CD1 3.86Å; V339-L343 HydrophobicContact CG1-CG 4.27Å; V339-L343 WeakPolarHBondContact O-CB 3.37Å; V339-L343 VanDerWaalsContact O-CG 3.3Å; V339-L343 WeakPolarHBondContact O-CG 3.12Å; V339-L343 PolarHBondContact O-N 2.86Å; V339-F498 HydrophobicContact CB-CZ 3.84Å; V339-F498 HydrophobicContact CG1-CE1 4.37Å; V339-F498 HydrophobicContact CG1-CE2 3.71Å; V339-F498 HydrophobicContact CG1-CZ 3.44Å; V339-F498 VanDerWaalsContact CG1-CZ 3.44Å
340	G	96.4	Very high	95.8	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-61.9	-39.9	176.8	0	0	0	0	0	112.8	M336 G337 G344	M336-G340 PolarHBondContact O-N 3.1Å; G337-G340 PolarHBondContact O-N 3.36Å; G340-G344 PolarHBondContact O-N 3.45Å
341	G	96.9	Very high	95.9	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-68.5	-38.2	174.9	0	0	0	0	0	113.8	G337 V338 V339 G344 A345 A562 T565	G337-G341 PolarHBondContact O-N 2.7Å; V338-G341 PolarHBondContact O-N 3.29Å; V339-G341 VanDerWaalsContact C-N 3.35Å; V339-G341 PolarHBondContact O-N 3.38Å; G341-G344 PolarHBondContact O-N 3.2Å; G341-A345 WeakPolarHBondContact O-CB 3.26Å; G341-A345 PolarHBondContact O-N 2.88Å; G341-A562 WeakPolarHBondContact CA-O 3.37Å; G341-T565 WeakPolarHBondContact CA-OG1 3.4Å
342	L	97.3	Very high	96	Very high	78 Å²	78	35 Å²	35	41%	0.408	19%	0.187	S	C	.	.	H	α-helix	trans	-64.8	-46.3	172.8	-71.7	171.8	0	0	0	111.9	V338 V339 G344 A345 L346 F569	V338-L342 HydrophobicContact CG1-CD1 4.21Å; V338-L342 WeakPolarHBondContact O-CG 3.42Å; V338-L342 PolarHBondContact O-N 3Å; V339-L342 PolarHBondContact O-N 2.87Å; L342-G344 VanDerWaalsContact C-N 3.32Å; L342-G344 PolarHBondContact O-N 3.04Å; L342-A345 PolarHBondContact O-N 3Å; L342-L346 PolarHBondContact O-N 3.01Å; L342-F569 HydrophobicContact CD2-CD2 4.24Å; L342-F569 HydrophobicContact CD2-CE2 3.4Å; L342-F569 HydrophobicContact CD2-CZ 3.84Å
343	L	96.8	Very high	96	Very high	34 Å²	34	36 Å²	36	18%	0.178	20%	0.201	C	C	.	.	H	α-helix	trans	-63.4	-38.4	176	-71.4	171.1	0	0	0	111.6	V339 L346 F347 F468 F498 F527	V339-L343 HydrophobicContact CG1-CD1 3.86Å; V339-L343 HydrophobicContact CG1-CG 4.27Å; V339-L343 WeakPolarHBondContact O-CB 3.37Å; V339-L343 VanDerWaalsContact O-CG 3.3Å; V339-L343 WeakPolarHBondContact O-CG 3.12Å; V339-L343 PolarHBondContact O-N 2.86Å; L343-L346 PolarHBondContact O-N 3.15Å; L343-F347 WeakPolarHBondContact O-CB 3.29Å; L343-F347 PolarHBondContact O-N 3.05Å; L343-F468 HydrophobicContact CD1-CZ 3.9Å; L343-F468 HydrophobicContact CD2-CZ 4.35Å; L343-F498 HydrophobicContact CD1-CD2 4.22Å; L343-F498 HydrophobicContact CD1-CE2 4.29Å; L343-F498 HydrophobicContact CD1-CG 4.47Å; L343-F527 HydrophobicContact CB-CD2 3.89Å; L343-F527 HydrophobicContact CB-CE2 3.85Å
344	G	96.7	Very high	95.9	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-66.2	-40.5	174.1	0	0	0	0	0	113.1	G340 G341 L342 F347 N348	G340-G344 PolarHBondContact O-N 3.45Å; G341-G344 PolarHBondContact O-N 3.2Å; L342-G344 VanDerWaalsContact C-N 3.32Å; L342-G344 PolarHBondContact O-N 3.04Å; G344-F347 WeakPolarHBondContact O-CB 3.35Å; G344-F347 PolarHBondContact O-N 3.37Å; G344-N348 WeakPolarHBondContact O-CB 3.12Å; G344-N348 VanDerWaalsContact O-CG 3.3Å; G344-N348 PolarHBondContact O-N 3.04Å; G344-N348 PolarHBondContact O-OD1 3.44Å
345	A	96.6	Very high	95.6	Very high	5 Å²	5	35.7 Å²	35.7	4%	0.041	20%	0.198	C	C	.	.	H	α-helix	trans	-63.5	-42.2	173.5	0	0	0	0	0	111.9	G341 L342 N348 C349 F569 N570	G341-A345 WeakPolarHBondContact O-CB 3.26Å; G341-A345 PolarHBondContact O-N 2.88Å; L342-A345 PolarHBondContact O-N 3Å; A345-N348 PolarHBondContact O-N 3.17Å; A345-C349 WeakPolarHBondContact O-CB 3.26Å; A345-C349 PolarHBondContact O-N 3.5Å; A345-F569 HydrophobicContact CB-CB 4.01Å; A345-F569 HydrophobicContact CB-CD2 4.4Å; A345-F569 HydrophobicContact CB-CG 4.45Å; A345-N570 PolarHBondContact O-ND2 2.97Å
346	L	96.5	Very high	95.3	Very high	85 Å²	85	35.5 Å²	35.5	45%	0.445	19%	0.193	S	C	.	.	H	α-helix	trans	-59.6	-47.3	173.5	178.6	65	0	0	0	111.2	L342 L343 N348 C349 M350 F472	L342-L346 PolarHBondContact O-N 3.01Å; L343-L346 PolarHBondContact O-N 3.15Å; L346-N348 VanDerWaalsContact C-N 3.34Å; L346-N348 PolarHBondContact O-N 3.15Å; L346-C349 PolarHBondContact O-N 3.2Å; L346-M350 HydrophobicContact CD1-CG 4.28Å; L346-M350 HydrophobicContact CD1-SD 4.27Å; L346-M350 HydrophobicContact CG-SD 4.17Å; L346-M350 WeakPolarHBondContact O-CG 3.38Å; L346-M350 PolarHBondContact O-N 3.37Å; L346-F472 HydrophobicContact CD2-CE1 4.34Å; L346-F472 HydrophobicContact CD2-CZ 4.11Å; L346-F472 HydrophobicContact CG-CZ 4.18Å
347	F	96.7	Very high	95.1	Very high	2 Å²	2	41.6 Å²	41.6	1%	0.009	22%	0.216	C	C	.	.	H	α-helix	trans	-56.2	-48.6	176.1	-173	-86.7	0	0	0	111.2	L343 G344 C349 M350 N351 F472 A475 C476 L487 F527 V531	L343-F347 WeakPolarHBondContact O-CB 3.29Å; L343-F347 PolarHBondContact O-N 3.05Å; G344-F347 WeakPolarHBondContact O-CB 3.35Å; G344-F347 PolarHBondContact O-N 3.37Å; F347-C349 PolarHBondContact O-N 2.94Å; F347-M350 PolarHBondContact O-N 3.31Å; F347-N351 VanDerWaalsContact O-CB 3.28Å; F347-N351 WeakPolarHBondContact O-CB 3.42Å; F347-N351 PolarHBondContact O-N 3.05Å; F347-F472 HydrophobicContact CB-CE2 3.81Å; F347-F472 HydrophobicContact CB-CZ 3.94Å; F347-F472 HydrophobicContact CD2-CD2 4.1Å; F347-F472 AromaticContact CD2-CE2 3.75Å; F347-F472 HydrophobicContact CD2-CE2 3.75Å; F347-F472 HydrophobicContact CD2-CZ 4.1Å; F347-F472 HydrophobicContact CG-CE2 4.28Å; F347-A475 HydrophobicContact CE2-CB 4.45Å; F347-C476 HydrophobicContact CD2-CB 3.94Å; F347-C476 VanDerWaalsContact CE2-CA 3.48Å; F347-C476 HydrophobicContact CE2-CB 3.51Å; F347-C476 HydrophobicContact CZ-CB 4.03Å; F347-L487 HydrophobicContact CE1-CD1 4.01Å; F347-L487 HydrophobicContact CE1-CD2 4.09Å; F347-L487 HydrophobicContact CZ-CD1 3.81Å; F347-F527 HydrophobicContact CB-CZ 4.33Å; F347-F527 HydrophobicContact CD2-CZ 4.13Å; F347-F527 HydrophobicContact CG-CZ 4.34Å; F347-V531 HydrophobicContact CB-CG2 4.17Å; F347-V531 HydrophobicContact CD1-CG1 3.98Å; F347-V531 HydrophobicContact CD1-CG2 4.05Å; F347-V531 HydrophobicContact CE1-CG1 4.24Å; F347-V531 HydrophobicContact CG-CG2 4.18Å
348	N	95.9	Very high	94.7	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-64.3	-38.6	179.4	-71.1	-4.3	0	0	0	112.3	G344 A345 L346 K352 V531 K571 I573 I576	G344-N348 WeakPolarHBondContact O-CB 3.12Å; G344-N348 VanDerWaalsContact O-CG 3.3Å; G344-N348 PolarHBondContact O-N 3.04Å; G344-N348 PolarHBondContact O-OD1 3.44Å; A345-N348 PolarHBondContact O-N 3.17Å; L346-N348 VanDerWaalsContact C-N 3.34Å; L346-N348 PolarHBondContact O-N 3.15Å; N348-K352 VanDerWaalsContact O-CB 3.28Å; N348-K352 WeakPolarHBondContact O-CB 3.48Å; N348-K352 PolarHBondContact O-N 3.27Å; N348-V531 PolarHBondContact ND2-O 2.89Å; N348-V531 PolarHBondContact OD1-O 3.38Å; N348-K571 PolarHBondContact ND2-O 2.96Å; N348-I573 PolarHBondContact ND2-N 3.31Å; N348-I573 WeakPolarHBondContact OD1-CB 3.49Å; N348-I576 HydrophobicContact CB-CD1 3.95Å
349	C	95.7	Very high	94.1	Very high	56 Å²	56	42.6 Å²	42.6	38%	0.378	22%	0.219	S	C	.	.	H	α-helix	trans	-63.2	-51.7	176.2	-169.5	0	0	0	0	111.4	A345 L346 F347 N351 K352 C353 N570	A345-C349 WeakPolarHBondContact O-CB 3.26Å; A345-C349 PolarHBondContact O-N 3.5Å; L346-C349 PolarHBondContact O-N 3.2Å; F347-C349 PolarHBondContact O-N 2.94Å; C349-N351 VanDerWaalsContact C-N 3.28Å; C349-N351 PolarHBondContact O-N 3.23Å; C349-K352 PolarHBondContact O-N 3.09Å; C349-C353 PolarHBondContact O-N 2.86Å; C349-C353 PolarHBondContact O-SG 3.17Å; C349-C353 VanDerWaalsContact O-SG 3.37Å; C349-N570 WeakPolarHBondContact CB-ND2 3.32Å; C349-N570 PolarHBondContact N-ND2 3.25Å
350	M	95.3	Very high	93.4	Very high	72 Å²	72	47.6 Å²	47.6	36%	0.355	23%	0.232	S	C	.	.	H	α-helix	trans	-58.6	-43.2	178	-70.5	-178.6	66.7	0	0	111	L346 F347 C353 L354 F472 L473	L346-M350 HydrophobicContact CD1-CG 4.28Å; L346-M350 HydrophobicContact CD1-SD 4.27Å; L346-M350 HydrophobicContact CG-SD 4.17Å; L346-M350 WeakPolarHBondContact O-CG 3.38Å; L346-M350 PolarHBondContact O-N 3.37Å; F347-M350 PolarHBondContact O-N 3.31Å; M350-C353 PolarHBondContact O-N 2.89Å; M350-L354 WeakPolarHBondContact O-CB 3.27Å; M350-L354 PolarHBondContact O-N 2.78Å; M350-F472 HydrophobicContact SD-CE1 3.94Å; M350-L473 HydrophobicContact CE-CD2 3.73Å
351	N	94.5	Very high	92.8	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-66.2	-42.4	178.9	-152.2	-65.3	0	0	0	112.5	F347 C349 C353 L354 A355 C476 Y479 I573 H577	F347-N351 VanDerWaalsContact O-CB 3.28Å; F347-N351 WeakPolarHBondContact O-CB 3.42Å; F347-N351 PolarHBondContact O-N 3.05Å; C349-N351 VanDerWaalsContact C-N 3.28Å; C349-N351 PolarHBondContact O-N 3.23Å; N351-C353 PolarHBondContact O-N 3.46Å; N351-L354 PolarHBondContact O-N 3.45Å; N351-A355 VanDerWaalsContact O-CB 3.32Å; N351-A355 WeakPolarHBondContact O-CB 3.34Å; N351-A355 PolarHBondContact O-N 3.44Å; N351-C476 PolarHBondContact ND2-O 3.33Å; N351-Y479 VanDerWaalsContact ND2-CD1 3.29Å; N351-Y479 WeakPolarHBondContact ND2-CD1 3.3Å; N351-Y479 WeakPolarHBondContact OD1-CD1 3.18Å; N351-I573 HydrophobicContact CB-CD1 3.84Å; N351-H577 PolarHBondContact OD1-CE1 2.86Å
352	K	93.6	Very high	91.9	Very high	77 Å²	77	52.7 Å²	52.7	34%	0.335	26%	0.256	S	S	.	.	H	α-helix	trans	-58.2	-46.8	175	-177.1	178.8	178.2	179.6	0	111.3	N348 C349 A355 K356 I576	N348-K352 VanDerWaalsContact O-CB 3.28Å; N348-K352 WeakPolarHBondContact O-CB 3.48Å; N348-K352 PolarHBondContact O-N 3.27Å; C349-K352 PolarHBondContact O-N 3.09Å; K352-A355 PolarHBondContact O-N 3.01Å; K352-K356 WeakPolarHBondContact O-CG 3.42Å; K352-K356 PolarHBondContact O-N 3.48Å; K352-I576 HydrophobicContact CB-CG2 4.02Å; K352-I576 HydrophobicContact CD-CG2 4.15Å; K352-I576 HydrophobicContact CG-CG2 3.91Å
353	C	93.3	Very high	90.8	Very high	78 Å²	78	52.7 Å²	52.7	53%	0.527	25%	0.253	S	S	.	.	H	α-helix	trans	-60.7	-45.2	176.3	-68.4	0	0	0	0	111.6	C349 M350 N351 K356 Y357	C349-C353 PolarHBondContact O-N 2.86Å; C349-C353 PolarHBondContact O-SG 3.17Å; C349-C353 VanDerWaalsContact O-SG 3.37Å; M350-C353 PolarHBondContact O-N 2.89Å; N351-C353 PolarHBondContact O-N 3.46Å; C353-K356 PolarHBondContact O-N 2.89Å; C353-Y357 WeakPolarHBondContact O-CB 3.37Å; C353-Y357 PolarHBondContact O-N 2.75Å
354	L	92.2	Very high	89.3	Confident	39 Å²	39	55.6 Å²	55.6	20%	0.204	28%	0.275	C	S	.	.	H	α-helix	trans	-64.6	-42.9	178.4	-176.2	61.6	0	0	0	112	M350 N351 Y357 R358	M350-L354 WeakPolarHBondContact O-CB 3.27Å; M350-L354 PolarHBondContact O-N 2.78Å; N351-L354 PolarHBondContact O-N 3.45Å; L354-Y357 WeakPolarHBondContact O-CB 3.45Å; L354-Y357 PolarHBondContact O-N 2.74Å; L354-R358 VanDerWaalsContact O-CG 3.32Å; L354-R358 WeakPolarHBondContact O-CG 3.36Å; L354-R358 PolarHBondContact O-N 2.95Å
355	A	90	Very high	88.1	Confident	9 Å²	9	61.3 Å²	61.3	7%	0.074	30%	0.299	C	S	.	.	H	α-helix	trans	-63.5	-44.5	177	0	0	0	0	0	111.7	N351 K352 Y357 R358 M359 L580	N351-A355 VanDerWaalsContact O-CB 3.32Å; N351-A355 WeakPolarHBondContact O-CB 3.34Å; N351-A355 PolarHBondContact O-N 3.44Å; K352-A355 PolarHBondContact O-N 3.01Å; A355-Y357 VanDerWaalsContact C-N 3.32Å; A355-Y357 PolarHBondContact O-N 2.76Å; A355-R358 PolarHBondContact O-N 2.86Å; A355-M359 WeakPolarHBondContact O-CB 3.21Å; A355-M359 WeakPolarHBondContact O-CG 3.49Å; A355-M359 PolarHBondContact O-N 3.37Å; A355-L580 HydrophobicContact CB-CD1 3.74Å
356	K	90.3	Very high	87	Confident	103 Å²	103	64.2 Å²	64.2	45%	0.448	32%	0.324	S	S	.	.	H	α-helix	trans	-58	-44.5	172.5	-77.1	-170.8	173.7	-164.9	0	111.3	K352 C353 R358 M359 R360 L580	K352-K356 WeakPolarHBondContact O-CG 3.42Å; K352-K356 PolarHBondContact O-N 3.48Å; C353-K356 PolarHBondContact O-N 2.89Å; K356-R358 PolarHBondContact O-N 3.43Å; K356-M359 PolarHBondContact O-N 2.74Å; K356-R360 PolarHBondContact O-N 2.99Å; K356-L580 HydrophobicContact CG-CD2 3.87Å
357	Y	90.1	Very high	86.2	Confident	133 Å²	133	68.9 Å²	68.9	52%	0.522	34%	0.335	S	S	.	.	H	α-helix	trans	-60.8	-45.4	177	179	-97.1	0	0	0	112.3	C353 L354 A355 M359 R360 H361	C353-Y357 WeakPolarHBondContact O-CB 3.37Å; C353-Y357 PolarHBondContact O-N 2.75Å; L354-Y357 WeakPolarHBondContact O-CB 3.45Å; L354-Y357 PolarHBondContact O-N 2.74Å; A355-Y357 VanDerWaalsContact C-N 3.32Å; A355-Y357 PolarHBondContact O-N 2.76Å; Y357-M359 PolarHBondContact O-N 3.48Å; Y357-R360 PolarHBondContact O-N 3.39Å; Y357-H361 AromaticContact CD2-CE1 3.86Å; Y357-H361 AromaticContact CD2-ND1 3.37Å; Y357-H361 WeakPolarHBondContact CD2-ND1 3.47Å; Y357-H361 AromaticContact CE2-CE1 3.74Å; Y357-H361 AromaticContact CE2-CG 3.99Å; Y357-H361 AromaticContact CE2-ND1 3.31Å; Y357-H361 VanDerWaalsContact CE2-ND1 3.31Å; Y357-H361 WeakPolarHBondContact CE2-ND1 3.33Å; Y357-H361 PolarHBondContact O-N 3.11Å; Y357-H361 PolarHBondContact O-ND1 3.46Å
358	R	89	Confident	85.5	Confident	4 Å²	4	75.4 Å²	75.4	2%	0.015	36%	0.364	C	S	.	.	H	α-helix	trans	-60.6	-43.8	175.3	-70.4	-180	167.7	146.1	-1.4	111.9	L354 A355 K356 R360 I362 H363 E373 W477 Y479	L354-R358 VanDerWaalsContact O-CG 3.32Å; L354-R358 WeakPolarHBondContact O-CG 3.36Å; L354-R358 PolarHBondContact O-N 2.95Å; A355-R358 PolarHBondContact O-N 2.86Å; K356-R358 PolarHBondContact O-N 3.43Å; R358-R360 VanDerWaalsContact C-N 3.33Å; R358-R360 PolarHBondContact O-N 3.46Å; R358-I362 HydrophobicContact CB-CD1 4.44Å; R358-I362 HydrophobicContact CG-CD1 3.96Å; R358-I362 WeakPolarHBondContact O-CA 3.28Å; R358-I362 WeakPolarHBondContact O-CB 3.42Å; R358-I362 PolarHBondContact O-N 3.01Å; R358-H363 PolarHBondContact O-CD2 2.85Å; R358-H363 PolarHBondContact O-N 2.96Å; R358-E373 IonicContact CZ-OE1 3.66Å; R358-E373 VanDerWaalsContact CZ-OE1 3.31Å; R358-E373 IonicContact NE-OE1 3.69Å; R358-E373 PolarHBondContact NE-OE1 3.38Å; R358-E373 IonicContact NE-OE2 3.53Å; R358-E373 IonicContact NH2-OE1 2.99Å; R358-E373 PolarHBondContact NH2-OE1 3.49Å; R358-W477 PolarHBondContact NH2-O 2.91Å; R358-Y479 PolarHBondContact NH1-O 3.47Å
359	M	84.6	Confident	85.1	Confident	68 Å²	68	78.2 Å²	78.2	34%	0.335	38%	0.378	S	S	.	.	H	α-helix	trans	-62.8	-39.2	178.4	-73.7	-177.3	176.3	0	0	112.1	A355 K356 Y357 P364 L580	A355-M359 WeakPolarHBondContact O-CB 3.21Å; A355-M359 WeakPolarHBondContact O-CG 3.49Å; A355-M359 PolarHBondContact O-N 3.37Å; K356-M359 PolarHBondContact O-N 2.74Å; Y357-M359 PolarHBondContact O-N 3.48Å; M359-P364 WeakPolarHBondContact O-CD 3.42Å; M359-L580 HydrophobicContact CE-CB 3.98Å; M359-L580 HydrophobicContact SD-CB 4.27Å
360	R	84.1	Confident	84.6	Confident	157 Å²	157	78.5 Å²	78.5	59%	0.592	37%	0.371	S	S	*	.	H	α-helix	trans	-76.9	-39.8	179.7	-173.6	172.6	-91.3	171.8	-8.4	113.6	I38 K356 Y357 R358 P364	I38-R360 VanDerWaalsContact CD1-NH2 3.32Å; K356-R360 PolarHBondContact O-N 2.99Å; Y357-R360 PolarHBondContact O-N 3.39Å; R358-R360 VanDerWaalsContact C-N 3.33Å; R358-R360 PolarHBondContact O-N 3.46Å; R360-P364 WeakPolarHBondContact O-CG 3.39Å
361	H	82.3	Confident	84.4	Confident	82 Å²	82	75.2 Å²	75.2	38%	0.38	36%	0.355	S	S	.	.	H	α-helix	trans	-111.9	-25	-169.2	-62.3	100.3	0	0	0	115.6	Y357 K365	Y357-H361 AromaticContact CD2-CE1 3.86Å; Y357-H361 AromaticContact CD2-ND1 3.37Å; Y357-H361 WeakPolarHBondContact CD2-ND1 3.47Å; Y357-H361 AromaticContact CE2-CE1 3.74Å; Y357-H361 AromaticContact CE2-CG 3.99Å; Y357-H361 AromaticContact CE2-ND1 3.31Å; Y357-H361 VanDerWaalsContact CE2-ND1 3.31Å; Y357-H361 WeakPolarHBondContact CE2-ND1 3.33Å; Y357-H361 PolarHBondContact O-N 3.11Å; Y357-H361 PolarHBondContact O-ND1 3.46Å; H361-K365 VanDerWaalsContact O-CD 3.27Å; H361-K365 WeakPolarHBondContact O-CD 3.12Å; H361-K365 WeakPolarHBondContact O-CE 3.26Å; H361-K365 WeakPolarHBondContact O-CG 3.18Å
362	I	79.3	Confident	84.2	Confident	24 Å²	24	79.9 Å²	79.9	12%	0.123	38%	0.38	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106	-48.3	-172.1	-55.7	-172.8	0	0	0	111.3	R358 P364 K365 I369 R370 E373	R358-I362 HydrophobicContact CB-CD1 4.44Å; R358-I362 HydrophobicContact CG-CD1 3.96Å; R358-I362 WeakPolarHBondContact O-CA 3.28Å; R358-I362 WeakPolarHBondContact O-CB 3.42Å; R358-I362 PolarHBondContact O-N 3.01Å; I362-P364 VanDerWaalsContact C-CD 3.49Å; I362-K365 PolarHBondContact O-N 2.85Å; I362-I369 HydrophobicContact CG2-CG2 4.2Å; I362-R370 HydrophobicContact CG2-CG 4.35Å; I362-E373 VanDerWaalsContact CD1-CD 3.49Å; I362-E373 HydrophobicContact CD1-CG 4.37Å; I362-E373 WeakPolarHBondContact CD1-OE2 3.13Å
363	H	72.9	Confident	84.2	Confident	78 Å²	78	77.5 Å²	77.5	36%	0.361	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-37.9	-179.5	-79.6	-72.1	0	0	0	116	R358 K365 R370	R358-H363 PolarHBondContact O-CD2 2.85Å; R358-H363 PolarHBondContact O-N 2.96Å; H363-K365 VanDerWaalsContact C-N 3.26Å; H363-K365 PolarHBondContact O-N 3.16Å; H363-R370 PolarHBondContact O-NH2 2.81Å
364	P	65.1	Low	84.2	Confident	96 Å²	96	73.8 Å²	73.8	62%	0.623	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75	-15.5	178.8	27.9	-34.4	0	0	0	113.2	M359 R360 I362	M359-P364 WeakPolarHBondContact O-CD 3.42Å; R360-P364 WeakPolarHBondContact O-CG 3.39Å; I362-P364 VanDerWaalsContact C-CD 3.49Å
365	K	72.5	Confident	84.3	Confident	120 Å²	120	73.3 Å²	73.3	52%	0.522	34%	0.342	S	S	.	.	S	Bend	trans	-81.4	171.4	177.8	-58.2	-174.2	178.6	176.8	0	111.8	H361 I362 H363 I369	H361-K365 VanDerWaalsContact O-CD 3.27Å; H361-K365 WeakPolarHBondContact O-CD 3.12Å; H361-K365 WeakPolarHBondContact O-CE 3.26Å; H361-K365 WeakPolarHBondContact O-CG 3.18Å; I362-K365 PolarHBondContact O-N 2.85Å; H363-K365 VanDerWaalsContact C-N 3.26Å; H363-K365 PolarHBondContact O-N 3.16Å; K365-I369 HydrophobicContact CB-CD1 3.47Å; K365-I369 VanDerWaalsContact CB-CD1 3.47Å; K365-I369 HydrophobicContact CD-CD1 3.84Å; K365-I369 HydrophobicContact CG-CD1 4.26Å
366	A	73.1	Confident	84.5	Confident	66 Å²	66	76.8 Å²	76.8	55%	0.545	36%	0.359	S	S	.	.			trans	-54.2	146.7	-177.8	0	0	0	0	0	113.2	F368 I369	A366-F368 PolarHBondContact O-N 3.23Å; A366-I369 WeakPolarHBondContact O-CB 3.37Å; A366-I369 PolarHBondContact O-N 2.91Å
367	R	79.6	Confident	84.7	Confident	183 Å²	183	71.9 Å²	71.9	69%	0.691	34%	0.338	S	S	*	.	H	α-helix	trans	-52.2	-32.5	-176.7	-65	-177	-170.8	170.2	4.5	113.6	L145 I369 R370	L145-R367 HydrophobicContact CD2-CB 4.1Å; R367-I369 VanDerWaalsContact C-N 3.3Å; R367-I369 PolarHBondContact O-N 2.81Å; R367-R370 PolarHBondContact O-N 3.37Å
368	F	82.1	Confident	84.9	Confident	139 Å²	139	65.5 Å²	65.5	61%	0.61	31%	0.313	S	S	*	.	H	α-helix	trans	-63.1	-31	178.9	-174	-101	0	0	0	113.7	A366 R370 V371 L372	A366-F368 PolarHBondContact O-N 3.23Å; F368-R370 PolarHBondContact O-N 2.96Å; F368-V371 WeakPolarHBondContact O-CB 3.36Å; F368-V371 PolarHBondContact O-N 3.5Å; F368-V371 VanDerWaalsContact O-N 3.15Å; F368-L372 PolarHBondContact O-N 3.02Å
369	I	86.9	Confident	85.2	Confident	58 Å²	58	68.7 Å²	68.7	30%	0.297	33%	0.329	S	S	.	.	H	α-helix	trans	-66.8	-29.4	-178.5	-70.2	160.7	0	0	0	111.5	I362 K365 A366 R367 L372 E373	I362-I369 HydrophobicContact CG2-CG2 4.2Å; K365-I369 HydrophobicContact CB-CD1 3.47Å; K365-I369 VanDerWaalsContact CB-CD1 3.47Å; K365-I369 HydrophobicContact CD-CD1 3.84Å; K365-I369 HydrophobicContact CG-CD1 4.26Å; A366-I369 WeakPolarHBondContact O-CB 3.37Å; A366-I369 PolarHBondContact O-N 2.91Å; R367-I369 VanDerWaalsContact C-N 3.3Å; R367-I369 PolarHBondContact O-N 2.81Å; I369-L372 PolarHBondContact O-N 3.28Å; I369-E373 PolarHBondContact O-N 3.16Å
370	R	86.6	Confident	85.7	Confident	62 Å²	62	67.5 Å²	67.5	23%	0.234	33%	0.325	C	S	.	.	H	α-helix	trans	-66.1	-39.7	175	-57.2	-177.1	-170.9	176.1	1.3	111.7	I362 H363 R367 F368 E373 S374 S482	I362-R370 HydrophobicContact CG2-CG 4.35Å; H363-R370 PolarHBondContact O-NH2 2.81Å; R367-R370 PolarHBondContact O-N 3.37Å; F368-R370 PolarHBondContact O-N 2.96Å; R370-E373 PolarHBondContact O-N 2.69Å; R370-S374 PolarHBondContact O-N 3Å; R370-S374 VanDerWaalsContact O-N 3.16Å; R370-S482 PolarHBondContact O-OG 2.93Å
371	V	90.8	Very high	86.2	Confident	4 Å²	4	60 Å²	60	2%	0.024	30%	0.297	C	S	.	.	H	α-helix	trans	-64.8	-46.1	173.7	-177.5	0	0	0	0	109.9	F138 L145 F368 E373 S374 L375	F138-V371 HydrophobicContact CD2-CG1 3.9Å; F138-V371 HydrophobicContact CE2-CG1 4.12Å; L145-V371 HydrophobicContact CD1-CG2 3.41Å; L145-V371 VanDerWaalsContact CD1-CG2 3.41Å; L145-V371 HydrophobicContact CD2-CG2 4.08Å; L145-V371 HydrophobicContact CG-CG2 3.78Å; F368-V371 WeakPolarHBondContact O-CB 3.36Å; F368-V371 PolarHBondContact O-N 3.5Å; F368-V371 VanDerWaalsContact O-N 3.15Å; V371-E373 VanDerWaalsContact C-N 3.29Å; V371-E373 PolarHBondContact O-N 2.79Å; V371-S374 PolarHBondContact O-N 2.89Å; V371-S374 VanDerWaalsContact O-N 3.08Å; V371-S374 PolarHBondContact O-OG 2.99Å; V371-L375 HydrophobicContact CG1-CD1 4.12Å; V371-L375 HydrophobicContact CG1-CG 4.34Å; V371-L375 WeakPolarHBondContact O-CG 3.47Å; V371-L375 PolarHBondContact O-N 3.22Å
372	L	91.1	Very high	86.7	Confident	98 Å²	98	56.3 Å²	56.3	51%	0.513	28%	0.28	S	S	.	.	H	α-helix	trans	-59.8	-39.2	179.5	-172.7	65.7	0	0	0	112.4	F368 I369 L375 L376	F368-L372 PolarHBondContact O-N 3.02Å; I369-L372 PolarHBondContact O-N 3.28Å; L372-L375 PolarHBondContact O-N 3.17Å; L372-L376 WeakPolarHBondContact O-CB 3.48Å; L372-L376 PolarHBondContact O-N 3.15Å
373	E	91.8	Very high	87.4	Confident	27 Å²	27	57.8 Å²	57.8	13%	0.126	29%	0.29	C	S	.	.	H	α-helix	trans	-60.6	-47.6	172.9	-175.3	-171.7	-174.7	0	0	111.3	R358 I362 I369 R370 V371 L375 L376 V377	R358-E373 IonicContact CZ-OE1 3.66Å; R358-E373 VanDerWaalsContact CZ-OE1 3.31Å; R358-E373 IonicContact NE-OE1 3.69Å; R358-E373 PolarHBondContact NE-OE1 3.38Å; R358-E373 IonicContact NE-OE2 3.53Å; R358-E373 IonicContact NH2-OE1 2.99Å; R358-E373 PolarHBondContact NH2-OE1 3.49Å; I362-E373 VanDerWaalsContact CD1-CD 3.49Å; I362-E373 HydrophobicContact CD1-CG 4.37Å; I362-E373 WeakPolarHBondContact CD1-OE2 3.13Å; I369-E373 PolarHBondContact O-N 3.16Å; R370-E373 PolarHBondContact O-N 2.69Å; V371-E373 VanDerWaalsContact C-N 3.29Å; V371-E373 PolarHBondContact O-N 2.79Å; E373-L375 VanDerWaalsContact C-N 3.26Å; E373-L375 PolarHBondContact O-N 2.98Å; E373-L376 WeakPolarHBondContact O-CB 3.49Å; E373-L376 PolarHBondContact O-N 3.47Å; E373-L376 VanDerWaalsContact O-N 3.14Å; E373-V377 WeakPolarHBondContact O-CG2 3.41Å; E373-V377 PolarHBondContact O-N 2.72Å
374	S	93.1	Very high	88.3	Confident	0 Å²	0	56 Å²	56	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-60.5	-37.5	179.6	72.5	0	0	0	0	112.9	S141 R370 V371 A378	S141-S374 WeakPolarHBondContact CB-OG 3.32Å; S141-S374 PolarHBondContact OG-OG 3.29Å; R370-S374 PolarHBondContact O-N 3Å; R370-S374 VanDerWaalsContact O-N 3.16Å; V371-S374 PolarHBondContact O-N 2.89Å; V371-S374 VanDerWaalsContact O-N 3.08Å; V371-S374 PolarHBondContact O-OG 2.99Å; S374-A378 WeakPolarHBondContact O-CB 3.45Å; S374-A378 PolarHBondContact O-N 3.01Å
375	L	94.8	Very high	89.5	Confident	28 Å²	28	52.2 Å²	52.2	15%	0.147	26%	0.259	C	S	.	.	H	α-helix	trans	-69.3	-40.4	175.3	-68.7	178.8	0	0	0	111.9	M134 V137 F138 V371 L372 E373 A378 M379	M134-L375 HydrophobicContact CE-CB 3.73Å; M134-L375 HydrophobicContact CE-CD2 4.02Å; M134-L375 HydrophobicContact CE-CG 4.3Å; M134-L375 HydrophobicContact SD-CB 4.19Å; M134-L375 HydrophobicContact SD-CD2 4.07Å; V137-L375 HydrophobicContact CG1-CD2 4.43Å; F138-L375 HydrophobicContact CB-CD2 3.98Å; F138-L375 HydrophobicContact CD2-CD1 4.18Å; V371-L375 HydrophobicContact CG1-CD1 4.12Å; V371-L375 HydrophobicContact CG1-CG 4.34Å; V371-L375 WeakPolarHBondContact O-CG 3.47Å; V371-L375 PolarHBondContact O-N 3.22Å; L372-L375 PolarHBondContact O-N 3.17Å; E373-L375 VanDerWaalsContact C-N 3.26Å; E373-L375 PolarHBondContact O-N 2.98Å; L375-A378 PolarHBondContact O-N 3.12Å; L375-M379 WeakPolarHBondContact O-CB 3.47Å; L375-M379 PolarHBondContact O-N 3.43Å
376	L	94.5	Very high	90.3	Very high	82 Å²	82	47.2 Å²	47.2	43%	0.429	24%	0.237	S	C	.	.	H	α-helix	trans	-61.6	-45	175	179.2	65.2	0	0	0	111.2	L372 E373 M379 V380	L372-L376 WeakPolarHBondContact O-CB 3.48Å; L372-L376 PolarHBondContact O-N 3.15Å; E373-L376 WeakPolarHBondContact O-CB 3.49Å; E373-L376 PolarHBondContact O-N 3.47Å; E373-L376 VanDerWaalsContact O-N 3.14Å; L376-M379 HydrophobicContact CD1-CE 3.81Å; L376-M379 PolarHBondContact O-N 3.43Å; L376-V380 HydrophobicContact CD1-CG2 4.21Å; L376-V380 WeakPolarHBondContact O-CG2 3.18Å; L376-V380 PolarHBondContact O-N 3.14Å
377	V	94.7	Very high	91.1	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-59.8	-48.4	176.7	174.3	0	0	0	0	110.1	L191 E373 M379 V380 T381 W477 V481	L191-V377 HydrophobicContact CD2-CG1 4.24Å; E373-V377 WeakPolarHBondContact O-CG2 3.41Å; E373-V377 PolarHBondContact O-N 2.72Å; V377-M379 VanDerWaalsContact C-N 3.34Å; V377-M379 PolarHBondContact O-N 3.47Å; V377-V380 PolarHBondContact O-N 3.28Å; V377-T381 HydrophobicContact CG1-CG2 4.17Å; V377-T381 WeakPolarHBondContact O-CB 3.03Å; V377-T381 VanDerWaalsContact O-CG2 3.27Å; V377-T381 WeakPolarHBondContact O-CG2 3.22Å; V377-T381 PolarHBondContact O-N 3.35Å; V377-T381 PolarHBondContact O-OG1 2.99Å; V377-W477 HydrophobicContact CG1-CE3 4.49Å; V377-W477 HydrophobicContact CG2-CD2 4.02Å; V377-W477 HydrophobicContact CG2-CE3 4.45Å; V377-W477 HydrophobicContact CG2-CH2 4.24Å; V377-W477 HydrophobicContact CG2-CZ2 3.78Å; V377-V481 HydrophobicContact CB-CG2 4.48Å; V377-V481 HydrophobicContact CG1-CG2 4.5Å; V377-V481 HydrophobicContact CG2-CG2 3.96Å
378	A	95	Very high	91.6	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-59.7	-42.3	178	0	0	0	0	0	112.7	M134 V137 L191 S374 L375 T381 T382	M134-A378 HydrophobicContact SD-CB 4.12Å; V137-A378 HydrophobicContact CB-CB 4.14Å; V137-A378 HydrophobicContact CG1-CB 4.15Å; V137-A378 HydrophobicContact CG2-CB 3.89Å; L191-A378 HydrophobicContact CD2-CB 4.04Å; S374-A378 WeakPolarHBondContact O-CB 3.45Å; S374-A378 PolarHBondContact O-N 3.01Å; L375-A378 PolarHBondContact O-N 3.12Å; A378-T381 WeakPolarHBondContact CA-OG1 3.02Å; A378-T381 PolarHBondContact O-OG1 2.89Å; A378-T382 WeakPolarHBondContact O-CB 3.36Å; A378-T382 WeakPolarHBondContact O-CG2 3.25Å; A378-T382 PolarHBondContact O-N 2.9Å; A378-T382 VanDerWaalsContact O-N 3.1Å; A378-T382 PolarHBondContact O-OG1 3Å
379	M	95.1	Very high	91.8	Very high	71 Å²	71	33.5 Å²	33.5	35%	0.35	18%	0.175	S	C	.	.	H	α-helix	trans	-63.5	-49.3	177.4	179.2	-97.1	-80.6	0	0	111.5	L130 M134 L375 L376 V377 T381 T382 V383	L130-M379 HydrophobicContact CD1-CB 3.99Å; L130-M379 HydrophobicContact CD1-CG 3.82Å; M134-M379 HydrophobicContact CE-CB 4.45Å; M134-M379 HydrophobicContact SD-CB 4.02Å; L375-M379 WeakPolarHBondContact O-CB 3.47Å; L375-M379 PolarHBondContact O-N 3.43Å; L376-M379 HydrophobicContact CD1-CE 3.81Å; L376-M379 PolarHBondContact O-N 3.43Å; V377-M379 VanDerWaalsContact C-N 3.34Å; V377-M379 PolarHBondContact O-N 3.47Å; M379-T381 PolarHBondContact O-N 2.96Å; M379-T382 PolarHBondContact O-N 3.45Å; M379-T382 PolarHBondContact O-OG1 3.41Å; M379-V383 WeakPolarHBondContact O-CG2 3.29Å; M379-V383 PolarHBondContact O-N 2.83Å; M379-V383 VanDerWaalsContact O-N 3.09Å
380	V	95.1	Very high	91.7	Very high	42 Å²	42	33.2 Å²	33.2	26%	0.255	18%	0.176	S	C	.	.	H	α-helix	trans	-66.8	-41.5	-179.7	176.6	0	0	0	0	111.3	L376 V377 T382 V383 V384 W477	L376-V380 HydrophobicContact CD1-CG2 4.21Å; L376-V380 WeakPolarHBondContact O-CG2 3.18Å; L376-V380 PolarHBondContact O-N 3.14Å; V377-V380 PolarHBondContact O-N 3.28Å; V380-T382 VanDerWaalsContact C-N 3.29Å; V380-T382 PolarHBondContact O-N 2.89Å; V380-V383 PolarHBondContact O-N 3.32Å; V380-V384 HydrophobicContact CG1-CG2 4.06Å; V380-V384 WeakPolarHBondContact O-CB 3.48Å; V380-V384 VanDerWaalsContact O-CG2 3.25Å; V380-V384 WeakPolarHBondContact O-CG2 3.25Å; V380-V384 PolarHBondContact O-N 3.47Å; V380-W477 HydrophobicContact CB-CH2 4Å; V380-W477 HydrophobicContact CB-CZ3 3.71Å; V380-W477 HydrophobicContact CG1-CH2 4.24Å; V380-W477 HydrophobicContact CG1-CZ3 3.67Å; V380-W477 HydrophobicContact CG2-CH2 4.02Å; V380-W477 HydrophobicContact CG2-CZ3 4.24Å
381	T	93.4	Very high	91.7	Very high	1 Å²	1	36.1 Å²	36.1	1%	0.006	20%	0.195	C	C	.	.	H	α-helix	trans	-58.8	-43	177.8	50.4	0	0	0	0	111.4	V377 A378 M379 I385 L474	V377-T381 HydrophobicContact CG1-CG2 4.17Å; V377-T381 WeakPolarHBondContact O-CB 3.03Å; V377-T381 VanDerWaalsContact O-CG2 3.27Å; V377-T381 WeakPolarHBondContact O-CG2 3.22Å; V377-T381 PolarHBondContact O-N 3.35Å; V377-T381 PolarHBondContact O-OG1 2.99Å; A378-T381 WeakPolarHBondContact CA-OG1 3.02Å; A378-T381 PolarHBondContact O-OG1 2.89Å; M379-T381 PolarHBondContact O-N 2.96Å; T381-I385 WeakPolarHBondContact O-CB 3.34Å; T381-I385 VanDerWaalsContact O-CD1 3.26Å; T381-I385 WeakPolarHBondContact O-CD1 3.29Å; T381-I385 WeakPolarHBondContact O-CG1 3.38Å; T381-I385 PolarHBondContact O-N 3.43Å; T381-L474 HydrophobicContact CG2-CB 4.44Å; T381-L474 HydrophobicContact CG2-CD2 3.98Å
382	T	92.9	Very high	91.3	Very high	3 Å²	3	39.9 Å²	39.9	2%	0.018	22%	0.215	C	C	.	.	H	α-helix	trans	-72.1	-40.5	-176.3	51.9	0	0	0	0	112.5	L130 N133 A378 M379 V380 F386	L130-T382 VanDerWaalsContact CD1-OG1 3.29Å; L130-T382 WeakPolarHBondContact CD1-OG1 3.37Å; N133-T382 HydrophobicContact CB-CG2 3.8Å; N133-T382 WeakPolarHBondContact ND2-CG2 3.2Å; A378-T382 WeakPolarHBondContact O-CB 3.36Å; A378-T382 WeakPolarHBondContact O-CG2 3.25Å; A378-T382 PolarHBondContact O-N 2.9Å; A378-T382 VanDerWaalsContact O-N 3.1Å; A378-T382 PolarHBondContact O-OG1 3Å; M379-T382 PolarHBondContact O-N 3.45Å; M379-T382 PolarHBondContact O-OG1 3.41Å; V380-T382 VanDerWaalsContact C-N 3.29Å; V380-T382 PolarHBondContact O-N 2.89Å; T382-F386 WeakPolarHBondContact O-CB 3.25Å; T382-F386 PolarHBondContact O-N 2.89Å
383	V	93.3	Very high	90.7	Very high	55 Å²	55	36.2 Å²	36.2	33%	0.333	20%	0.201	S	C	.	.	H	α-helix	trans	-63.3	-46.3	174.8	173.1	0	0	0	0	110.9	M379 V380 F386 L387	M379-V383 WeakPolarHBondContact O-CG2 3.29Å; M379-V383 PolarHBondContact O-N 2.83Å; M379-V383 VanDerWaalsContact O-N 3.09Å; V380-V383 PolarHBondContact O-N 3.32Å; V383-F386 PolarHBondContact O-N 3.34Å; V383-L387 VanDerWaalsContact O-CB 3.22Å; V383-L387 WeakPolarHBondContact O-CB 3.38Å; V383-L387 PolarHBondContact O-N 3.38Å
384	V	93	Very high	90.2	Very high	42 Å²	42	38.4 Å²	38.4	26%	0.255	21%	0.211	S	C	.	.	H	α-helix	trans	-63.4	-44.9	179.5	172	0	0	0	0	111.2	V380 A388 L470 L474	V380-V384 HydrophobicContact CG1-CG2 4.06Å; V380-V384 WeakPolarHBondContact O-CB 3.48Å; V380-V384 VanDerWaalsContact O-CG2 3.25Å; V380-V384 WeakPolarHBondContact O-CG2 3.25Å; V380-V384 PolarHBondContact O-N 3.47Å; V384-A388 WeakPolarHBondContact O-CB 3.34Å; V384-A388 PolarHBondContact O-N 3.18Å; V384-L470 HydrophobicContact CG1-CD1 4.44Å; V384-L470 HydrophobicContact CG1-CD2 4.17Å; V384-L474 HydrophobicContact CB-CD1 4.41Å; V384-L474 HydrophobicContact CG1-CD1 4.02Å
385	I	90.3	Very high	89.7	Confident	15 Å²	15	41.7 Å²	41.7	8%	0.077	23%	0.233	C	C	.	.	H	α-helix	trans	-60	-48.7	178.1	-73.4	164.7	0	0	0	111.4	F192 T381 S389 F441 F442	F192-I385 HydrophobicContact CE1-CD1 3.76Å; F192-I385 HydrophobicContact CE2-CD1 4.49Å; F192-I385 HydrophobicContact CZ-CD1 3.48Å; F192-I385 VanDerWaalsContact CZ-CD1 3.48Å; F192-I385 HydrophobicContact CZ-CG1 3.93Å; T381-I385 WeakPolarHBondContact O-CB 3.34Å; T381-I385 VanDerWaalsContact O-CD1 3.26Å; T381-I385 WeakPolarHBondContact O-CD1 3.29Å; T381-I385 WeakPolarHBondContact O-CG1 3.38Å; T381-I385 PolarHBondContact O-N 3.43Å; I385-S389 WeakPolarHBondContact O-CB 3.36Å; I385-S389 PolarHBondContact O-N 3.27Å; I385-S389 PolarHBondContact O-OG 3.31Å; I385-F441 HydrophobicContact CD1-CD1 4.38Å; I385-F441 HydrophobicContact CG1-CD1 3.82Å; I385-F441 HydrophobicContact CG1-CE1 4.09Å; I385-F441 HydrophobicContact CG1-CG 4.23Å; I385-F441 HydrophobicContact CG2-CB 3.56Å; I385-F441 HydrophobicContact CG2-CD1 4.28Å; I385-F441 HydrophobicContact CG2-CD2 4.42Å; I385-F441 HydrophobicContact CG2-CG 3.89Å; I385-F442 HydrophobicContact CG2-CE2 4.38Å; I385-F442 HydrophobicContact CG2-CZ 4.42Å
386	F	90.1	Very high	88.8	Confident	15 Å²	15	43.2 Å²	43.2	7%	0.066	24%	0.237	C	C	.	.	H	α-helix	trans	-64.7	-47.6	-178.5	-172	-88.2	0	0	0	110.8	L126 L129 T382 V383 S389 V390 F428 F442	L126-F386 HydrophobicContact CB-CD1 4.2Å; L126-F386 HydrophobicContact CB-CD2 4.46Å; L126-F386 HydrophobicContact CB-CE1 4.03Å; L126-F386 HydrophobicContact CB-CE2 4.32Å; L126-F386 HydrophobicContact CB-CG 4.42Å; L126-F386 HydrophobicContact CB-CZ 4.1Å; L126-F386 HydrophobicContact CD1-CB 3.76Å; L126-F386 HydrophobicContact CD1-CD1 3.98Å; L126-F386 HydrophobicContact CD1-CD2 4.21Å; L126-F386 HydrophobicContact CD1-CG 3.73Å; L126-F386 HydrophobicContact CD2-CD1 4.35Å; L126-F386 HydrophobicContact CG-CD1 4.4Å; L129-F386 HydrophobicContact CD2-CD2 4.37Å; T382-F386 WeakPolarHBondContact O-CB 3.25Å; T382-F386 PolarHBondContact O-N 2.89Å; V383-F386 PolarHBondContact O-N 3.34Å; F386-S389 PolarHBondContact O-N 2.65Å; F386-V390 HydrophobicContact CD1-CG2 4.22Å; F386-V390 HydrophobicContact CE1-CG2 3.98Å; F386-V390 HydrophobicContact CZ-CG2 4.43Å; F386-V390 WeakPolarHBondContact O-CG2 3.44Å; F386-V390 PolarHBondContact O-N 3.33Å; F386-V390 VanDerWaalsContact O-N 3.11Å; F386-F428 AromaticContact CE2-CZ 3.95Å; F386-F428 HydrophobicContact CE2-CZ 3.95Å; F386-F428 HydrophobicContact CZ-CE1 4.3Å; F386-F428 HydrophobicContact CZ-CZ 4.1Å; F386-F442 AromaticContact CD2-CZ 3.98Å; F386-F442 HydrophobicContact CD2-CZ 3.98Å
387	L	90	Very high	87.8	Confident	94 Å²	94	45.8 Å²	45.8	49%	0.492	25%	0.251	S	S	.	.	H	α-helix	trans	-64.8	-41.9	-179.7	-172.2	64.6	0	0	0	112.4	V383 S389 V390 L391	V383-L387 VanDerWaalsContact O-CB 3.22Å; V383-L387 WeakPolarHBondContact O-CB 3.38Å; V383-L387 PolarHBondContact O-N 3.38Å; L387-S389 VanDerWaalsContact C-N 3.3Å; L387-S389 PolarHBondContact O-N 3.19Å; L387-V390 PolarHBondContact O-N 3.47Å; L387-L391 HydrophobicContact CD1-CD1 3.49Å; L387-L391 VanDerWaalsContact CD1-CD1 3.49Å; L387-L391 HydrophobicContact CD1-CG 3.87Å; L387-L391 HydrophobicContact CD2-CD1 4.36Å; L387-L391 HydrophobicContact CG-CD1 3.74Å; L387-L391 HydrophobicContact CG-CG 4.32Å; L387-L391 WeakPolarHBondContact O-CB 3.38Å; L387-L391 PolarHBondContact O-N 2.75Å
388	A	88.2	Confident	86.6	Confident	6 Å²	6	49.1 Å²	49.1	5%	0.05	27%	0.269	C	S	.	.	H	α-helix	trans	-62.8	-38.5	176.5	0	0	0	0	0	111.6	V384 L392 F441 L470	V384-A388 WeakPolarHBondContact O-CB 3.34Å; V384-A388 PolarHBondContact O-N 3.18Å; A388-L392 WeakPolarHBondContact O-CA 3.5Å; A388-L392 WeakPolarHBondContact O-CB 3.41Å; A388-L392 PolarHBondContact O-N 3.09Å; A388-F441 HydrophobicContact CB-CE2 4.45Å; A388-L470 HydrophobicContact CB-CD1 3.86Å
389	S	86.6	Confident	84.6	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-69.7	-33.3	179.1	-56.8	0	0	0	0	112.8	I385 F386 L387 N435 F442	I385-S389 WeakPolarHBondContact O-CB 3.36Å; I385-S389 PolarHBondContact O-N 3.27Å; I385-S389 PolarHBondContact O-OG 3.31Å; F386-S389 PolarHBondContact O-N 2.65Å; L387-S389 VanDerWaalsContact C-N 3.3Å; L387-S389 PolarHBondContact O-N 3.19Å; S389-N435 PolarHBondContact O-ND2 2.86Å; S389-F442 WeakPolarHBondContact OG-CE2 3.33Å
390	V	85.4	Confident	82	Confident	53 Å²	53	55.5 Å²	55.5	32%	0.321	32%	0.32	S	S	.	.	H	α-helix	trans	-79.1	-45.2	178.6	173.7	0	0	0	0	112.1	F386 L387 F428	F386-V390 HydrophobicContact CD1-CG2 4.22Å; F386-V390 HydrophobicContact CE1-CG2 3.98Å; F386-V390 HydrophobicContact CZ-CG2 4.43Å; F386-V390 WeakPolarHBondContact O-CG2 3.44Å; F386-V390 PolarHBondContact O-N 3.33Å; F386-V390 VanDerWaalsContact O-N 3.11Å; L387-V390 PolarHBondContact O-N 3.47Å; V390-F428 HydrophobicContact CG2-CD1 4.01Å; V390-F428 HydrophobicContact CG2-CD2 4.02Å; V390-F428 HydrophobicContact CG2-CE1 3.82Å; V390-F428 HydrophobicContact CG2-CE2 3.81Å; V390-F428 HydrophobicContact CG2-CG 4.11Å; V390-F428 HydrophobicContact CG2-CZ 3.71Å
391	L	85.9	Confident	79.2	Confident	122 Å²	122	58.6 Å²	58.6	64%	0.639	34%	0.341	S	S	*	.	H	α-helix	trans	-88.6	-31.8	-172.2	-66.7	-178.8	0	0	0	114.3	L387	L387-L391 HydrophobicContact CD1-CD1 3.49Å; L387-L391 VanDerWaalsContact CD1-CD1 3.49Å; L387-L391 HydrophobicContact CD1-CG 3.87Å; L387-L391 HydrophobicContact CD2-CD1 4.36Å; L387-L391 HydrophobicContact CG-CD1 3.74Å; L387-L391 HydrophobicContact CG-CG 4.32Å; L387-L391 WeakPolarHBondContact O-CB 3.38Å; L387-L391 PolarHBondContact O-N 2.75Å
392	L	83.3	Confident	76.3	Confident	83 Å²	83	64.6 Å²	64.6	44%	0.435	38%	0.378	S	S	.	.	S	Bend	trans	-117	1.7	-168	-53.6	172.3	0	0	0	112.7	A388 I466	A388-L392 WeakPolarHBondContact O-CA 3.5Å; A388-L392 WeakPolarHBondContact O-CB 3.41Å; A388-L392 PolarHBondContact O-N 3.09Å; L392-I466 HydrophobicContact CD1-CD1 4.43Å; L392-I466 HydrophobicContact CD1-CG2 3.88Å
393	G	78.6	Confident	73.6	Confident	22 Å²	22	70.8 Å²	70.8	23%	0.227	42%	0.416	C	S	.	.	P	Polyproline II helix	trans	-77.3	128.7	176.2	0	0	0	0	0	111.9	N435	G393-N435 WeakPolarHBondContact CA-OD1 3.29Å
394	E	81.1	Confident	70.9	Confident	73 Å²	73	76 Å²	76	34%	0.341	44%	0.436	S	S	.	.	P	Polyproline II helix	trans	-87.6	132.2	167	-71.9	176.9	-160.8	0	0	109.4	R396 D436 S460 T463	E394-R396 IonicContact OE2-CZ 2.73Å; E394-R396 IonicContact OE2-NE 3.6Å; E394-R396 IonicContact OE2-NH2 3.38Å; E394-R396 PolarHBondContact OE2-NH2 2.86Å; E394-D436 PolarHBondContact O-N 3.09Å; E394-S460 PolarHBondContact OE1-OG 3.33Å; E394-S460 VanDerWaalsContact OE2-CB 3.24Å; E394-S460 WeakPolarHBondContact OE2-CB 3.14Å; E394-S460 PolarHBondContact OE2-OG 3.47Å; E394-T463 HydrophobicContact CB-CG2 4.27Å; E394-T463 HydrophobicContact CG-CG2 4Å
395	C	81.9	Confident	68.1	Low	68 Å²	68	80 Å²	80	46%	0.459	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	125.3	169.9	-60.6	0	0	0	0	109.5	C429 Y434	C395-C429 VanDerWaalsContact CA-SG 3.5Å; C395-C429 HydrophobicContact CB-CB 3.81Å; C395-C429 WeakPolarHBondContact CB-SG 3.28Å; C395-C429 VanDerWaalsContact SG-CA 3.6Å; C395-C429 WeakPolarHBondContact SG-CB 3.12Å; C395-C429 CovalentContact SG-SG 2.03Å; C395-C429 PolarHBondContact SG-SG 3.29Å; C395-Y434 WeakPolarHBondContact CA-O 3.42Å
396	R	76.3	Confident	65.5	Low	60 Å²	60	85.1 Å²	85.1	23%	0.226	49%	0.494	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	145.9	176	-64	-166.6	176.5	-145.5	-13.2	110.5	E394 S433 Y434 D436 T458 S460	E394-R396 IonicContact OE2-CZ 2.73Å; E394-R396 IonicContact OE2-NE 3.6Å; E394-R396 IonicContact OE2-NH2 3.38Å; E394-R396 PolarHBondContact OE2-NH2 2.86Å; R396-S433 CarbonylContact O-C 3.12Å; R396-S433 WeakPolarHBondContact O-CA 3.24Å; R396-S433 WeakPolarHBondContact O-CB 3.5Å; R396-Y434 HydrophobicContact CB-CE1 3.98Å; R396-Y434 PolarHBondContact N-O 3.01Å; R396-Y434 VanDerWaalsContact O-CD1 3.3Å; R396-Y434 WeakPolarHBondContact O-CD1 3.3Å; R396-Y434 PolarHBondContact O-N 3.28Å; R396-D436 WeakPolarHBondContact CD-OD1 3.33Å; R396-D436 VanDerWaalsContact CD-OD2 3.23Å; R396-D436 WeakPolarHBondContact CD-OD2 3.32Å; R396-D436 IonicContact CZ-OD2 2.88Å; R396-D436 IonicContact NE-OD2 3.61Å; R396-D436 PolarHBondContact NE-OD2 3.39Å; R396-T458 PolarHBondContact NH1-O 2.96Å; R396-T458 PolarHBondContact NH1-OG1 3.37Å; R396-S460 VanDerWaalsContact NH2-CA 3.34Å
397	D	74.3	Confident	62.8	Low	136 Å²	136	90.8 Å²	90.8	73%	0.727	53%	0.53	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.5	135.8	180	-67.8	-37.2	0	0	0	111	S399	D397-S399 PolarHBondContact O-N 3.43Å
398	L	67.8	Low	60	Low	70 Å²	70	91.6 Å²	91.6	37%	0.366	54%	0.539	S	S	.	.			trans	-67.6	107.1	169.4	-172.3	71.2	0	0	0	107.1	S400 I424 K432 Y434	L398-S400 PolarHBondContact O-N 3.47Å; L398-I424 HydrophobicContact CD1-CD1 3.85Å; L398-I424 HydrophobicContact CD1-CG2 4.36Å; L398-K432 WeakPolarHBondContact CB-O 3.47Å; L398-K432 PolarHBondContact N-O 3.07Å; L398-K432 VanDerWaalsContact N-O 3.08Å; L398-Y434 HydrophobicContact CD1-CD1 4.4Å
399	S	54.9	Low	57.3	Low	114 Å²	114	95.7 Å²	95.7	80%	0.797	57%	0.573	S	S	*	*			trans	-58.1	99.4	179.7	56.2	0	0	0	0	109.9	D397	D397-S399 PolarHBondContact O-N 3.43Å
400	S	39.3	Very low	54.6	Low	91 Å²	91	103.1 Å²	103.1	64%	0.636	61%	0.612	S	S	*	*			trans	-59.3	143.9	166.3	61	0	0	0	0	108.8	L398 T402	L398-S400 PolarHBondContact O-N 3.47Å; S400-T402 PolarHBondContact O-N 2.85Å
401	P	37.3	Very low	51.8	Low	107 Å²	107	106.4 Å²	106.4	70%	0.695	64%	0.636	S	S	*	*			trans	-59.2	112.9	174.2	25.6	-31.2	0	0	0	107.4	T403	P401-T403 PolarHBondContact O-N 3.33Å; P401-T403 VanDerWaalsContact O-N 3.14Å
402	T	32.3	Very low	49.1	Very low	127 Å²	127	110.7 Å²	110.7	78%	0.779	64%	0.643	S	S	*	*			trans	-55.4	121.6	176.7	16.2	0	0	0	0	109	S400 H404	S400-T402 PolarHBondContact O-N 2.85Å; T402-H404 PolarHBondContact O-N 3.01Å
403	T	36	Very low	46.2	Very low	133 Å²	133	114.9 Å²	114.9	82%	0.816	66%	0.661	S	S	*	*			trans	-49.1	99.7	169.1	4.9	0	0	0	0	110.3	P401	P401-T403 PolarHBondContact O-N 3.33Å; P401-T403 VanDerWaalsContact O-N 3.14Å
404	H	35.9	Very low	43.8	Very low	164 Å²	164	120.1 Å²	120.1	76%	0.759	69%	0.688	S	S	*	*			trans	-146.8	107.9	152.9	-87.6	-65.1	0	0	0	110.4	T402	T402-H404 PolarHBondContact O-N 3.01Å
405	N	33.8	Very low	41.4	Very low	127 Å²	127	122.3 Å²	122.3	68%	0.679	71%	0.711	S	S	*	*			trans	67.9	110.2	159.8	-59.7	-9.4	0	0	0	119	T407	N405-T407 PolarHBondContact O-N 2.77Å
406	S	35.8	Very low	38.9	Very low	123 Å²	123	121.2 Å²	121.2	86%	0.86	71%	0.711	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.5	37.2	-176.9	-38.5	0	0	0	0	116.4
407	T	33.4	Very low	36.8	Very low	133 Å²	133	121.9 Å²	121.9	82%	0.816	73%	0.726	S	S	*	*	T	Hydrogen-bonded Turn	trans	-125.9	2.6	175.8	47.9	0	0	0	0	114.5	N405	N405-T407 PolarHBondContact O-N 2.77Å
408	T	32.5	Very low	35	Very low	111 Å²	111	123.6 Å²	123.6	68%	0.681	73%	0.729	S	S	*	*			trans	-116	29.2	173.7	23.4	0	0	0	0	112.9	L410	T408-L410 VanDerWaalsContact C-N 3.29Å; T408-L410 PolarHBondContact O-N 2.97Å
409	A	32	Very low	33.9	Very low	93 Å²	93	125.7 Å²	125.7	77%	0.769	74%	0.741	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.3	-2.1	178.1	0	0	0	0	0	114.4
410	L	29	Very low	33.6	Very low	156 Å²	156	123.4 Å²	123.4	82%	0.817	72%	0.719	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.4	-6.8	-176.6	-146.5	84.5	0	0	0	114.9	T408	T408-L410 VanDerWaalsContact C-N 3.29Å; T408-L410 PolarHBondContact O-N 2.97Å
411	C	25.9	Very low	34.1	Very low	122 Å²	122	124.2 Å²	124.2	82%	0.824	72%	0.716	S	S	*	*	S	Bend	trans	-120	33.6	-173.6	-69.3	0	0	0	0	114.2
412	R	29	Very low	34.8	Very low	212 Å²	212	122.5 Å²	122.5	80%	0.8	71%	0.706	S	S	*	*	S	Bend	trans	-120.3	13	172.2	-130.2	176.8	-166.6	149.2	2.4	113.5
413	Q	24.1	Very low	36.1	Very low	170 Å²	170	117.7 Å²	117.7	79%	0.794	68%	0.677	S	S	*	*			trans	-118.4	41.2	-165.3	-148.3	-178	10.8	0	0	113.2
414	V	27.9	Very low	37.7	Very low	133 Å²	133	112.4 Å²	112.4	81%	0.806	64%	0.643	S	S	*	*	S	Bend	trans	-144.8	116.4	160.4	-172.4	0	0	0	0	107.4
415	S	29.2	Very low	39.3	Very low	118 Å²	118	107.4 Å²	107.4	83%	0.825	62%	0.618	S	S	*	*	S	Bend	trans	85.9	102.8	173.1	-47.1	0	0	0	0	117.8
416	G	31.4	Very low	41.1	Very low	45 Å²	45	105.8 Å²	105.8	46%	0.464	61%	0.606	S	S	.	*	S	Bend	trans	103.3	-3.2	143	0	0	0	0	0	120.1
417	S	31.4	Very low	42.9	Very low	75 Å²	75	101 Å²	101	52%	0.524	57%	0.57	S	S	.	*	H	α-helix	trans	-81.9	-18.9	-175.3	55.6	0	0	0	0	115.6
418	E	35.3	Very low	44.8	Very low	171 Å²	171	96.7 Å²	96.7	80%	0.799	54%	0.54	S	S	*	.	H	α-helix	trans	-80.4	-31.7	179.4	-70	-174.2	160.1	0	0	113
419	D	45.8	Very low	46.8	Very low	115 Å²	115	92.2 Å²	92.2	62%	0.615	51%	0.513	S	S	*	.	H	α-helix	trans	-76.4	-36.5	-178.5	-69.4	-36.8	0	0	0	112.6	S422 T423	D419-S422 PolarHBondContact O-N 3.02Å; D419-S422 PolarHBondContact O-OG 2.95Å; D419-T423 WeakPolarHBondContact O-CG2 3.43Å; D419-T423 PolarHBondContact O-N 3.32Å
420	I	49.2	Very low	48.5	Very low	65 Å²	65	92.1 Å²	92.1	33%	0.333	51%	0.507	S	S	.	.	H	α-helix	trans	-70.5	-40.3	-175.8	-58.8	170	0	0	0	111.1	S422 T423 I424	I420-S422 VanDerWaalsContact C-N 3.31Å; I420-S422 PolarHBondContact O-N 3.46Å; I420-T423 PolarHBondContact O-N 2.94Å; I420-T423 PolarHBondContact O-OG1 3.09Å; I420-I424 PolarHBondContact O-N 3.47Å
421	N	50.1	Low	50.3	Low	108 Å²	108	91.7 Å²	91.7	58%	0.578	51%	0.506	S	S	*	.	H	α-helix	trans	-68.1	-28.9	177.5	-73.5	-20.1	0	0	0	113	T423	N421-T423 VanDerWaalsContact C-N 3.27Å; N421-T423 PolarHBondContact O-N 3.47Å
422	S	51.8	Low	52.4	Low	71 Å²	71	94.1 Å²	94.1	50%	0.497	50%	0.502	S	S	.	.	H	α-helix	trans	-74.3	-17.2	176.4	77.5	0	0	0	0	113.8	D419 I420	D419-S422 PolarHBondContact O-N 3.02Å; D419-S422 PolarHBondContact O-OG 2.95Å; I420-S422 VanDerWaalsContact C-N 3.31Å; I420-S422 PolarHBondContact O-N 3.46Å
423	T	58.5	Low	54.5	Low	26 Å²	26	84.2 Å²	84.2	16%	0.16	47%	0.465	C	S	.	.	H	α-helix	trans	-96.6	-14.4	-179.4	61.1	0	0	0	0	112.9	D419 I420 N421 R425 N443 A447 Q451	D419-T423 WeakPolarHBondContact O-CG2 3.43Å; D419-T423 PolarHBondContact O-N 3.32Å; I420-T423 PolarHBondContact O-N 2.94Å; I420-T423 PolarHBondContact O-OG1 3.09Å; N421-T423 VanDerWaalsContact C-N 3.27Å; N421-T423 PolarHBondContact O-N 3.47Å; T423-R425 PolarHBondContact O-N 3.36Å; T423-N443 PolarHBondContact O-ND2 3.45Å; T423-N443 PolarHBondContact O-OD1 3.24Å; T423-A447 HydrophobicContact CG2-CB 4.34Å; T423-Q451 PolarHBondContact O-NE2 3.49Å; T423-Q451 PolarHBondContact OG1-NE2 3.14Å
424	I	69.3	Low	57.1	Low	22 Å²	22	76.9 Å²	76.9	11%	0.113	43%	0.43	C	S	.	.			trans	-77.4	123.2	176.4	-64.8	167.2	0	0	0	109.2	L398 I420 Y434	L398-I424 HydrophobicContact CD1-CD1 3.85Å; L398-I424 HydrophobicContact CD1-CG2 4.36Å; I420-I424 PolarHBondContact O-N 3.47Å; I424-Y434 HydrophobicContact CG2-CD1 4.03Å; I424-Y434 HydrophobicContact CG2-CD2 3.79Å; I424-Y434 HydrophobicContact CG2-CG 3.43Å; I424-Y434 VanDerWaalsContact CG2-CG 3.43Å
425	R	71.2	Confident	59.8	Low	60 Å²	60	70.7 Å²	70.7	23%	0.226	39%	0.393	C	S	.	.			trans	-101.5	119.9	-176.8	-59.6	-61.2	179.2	-177.3	-4.2	110.7	T423 F427 N435 T439 N443	T423-R425 PolarHBondContact O-N 3.36Å; R425-F427 HydrophobicContact CB-CD2 4.06Å; R425-F427 HydrophobicContact CB-CE2 4.22Å; R425-F427 HydrophobicContact CB-CG 4.3Å; R425-F427 HydrophobicContact CG-CE2 4.25Å; R425-F427 PolarHBondContact O-N 3.07Å; R425-N435 PolarHBondContact O-N 2.97Å; R425-T439 PolarHBondContact N-OG1 3.31Å; R425-N443 PolarHBondContact NE-OD1 2.88Å; R425-N443 VanDerWaalsContact NE-OD1 3.17Å
426	Q	70.5	Confident	62.4	Low	92 Å²	92	65 Å²	65	43%	0.43	35%	0.353	S	S	.	.			trans	-85.5	19.9	178.5	-60.7	-178.3	21.9	0	0	113.5	F428	Q426-F428 PolarHBondContact O-N 2.95Å
427	F	73.7	Confident	65	Low	24 Å²	24	62.9 Å²	62.9	11%	0.105	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	136.5	-175.2	-60.5	-25.1	0	0	0	112	A110 I113 R425 C429 N435 A438 F442	A110-F427 HydrophobicContact CB-CE1 4Å; A110-F427 HydrophobicContact CB-CZ 3.94Å; I113-F427 HydrophobicContact CB-CD1 4.45Å; I113-F427 HydrophobicContact CD1-CD1 4.45Å; I113-F427 HydrophobicContact CD1-CD2 4.06Å; I113-F427 HydrophobicContact CD1-CE1 4.4Å; I113-F427 HydrophobicContact CD1-CE2 4.01Å; I113-F427 HydrophobicContact CD1-CG 4.29Å; I113-F427 HydrophobicContact CD1-CZ 4.19Å; I113-F427 HydrophobicContact CG2-CB 4.22Å; I113-F427 HydrophobicContact CG2-CD1 3.85Å; I113-F427 HydrophobicContact CG2-CE1 4.43Å; I113-F427 HydrophobicContact CG2-CG 4.1Å; R425-F427 HydrophobicContact CB-CD2 4.06Å; R425-F427 HydrophobicContact CB-CE2 4.22Å; R425-F427 HydrophobicContact CB-CG 4.3Å; R425-F427 HydrophobicContact CG-CE2 4.25Å; R425-F427 PolarHBondContact O-N 3.07Å; F427-C429 PolarHBondContact O-N 3.22Å; F427-N435 VanDerWaalsContact O-CB 3.27Å; F427-N435 WeakPolarHBondContact O-CB 3.5Å; F427-A438 HydrophobicContact CB-CB 4.23Å; F427-A438 HydrophobicContact CD2-CB 4.36Å; F427-F442 HydrophobicContact CD2-CB 4.31Å; F427-F442 HydrophobicContact CD2-CD2 4.11Å; F427-F442 HydrophobicContact CD2-CG 4.08Å; F427-F442 HydrophobicContact CE2-CB 3.89Å; F427-F442 HydrophobicContact CE2-CD1 4.13Å; F427-F442 HydrophobicContact CE2-CD2 4.4Å; F427-F442 AromaticContact CE2-CG 3.9Å; F427-F442 HydrophobicContact CE2-CG 3.9Å
428	F	73.4	Confident	67.4	Low	41 Å²	41	59.3 Å²	59.3	18%	0.18	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	64.8	11.2	174.2	-39.9	-64.2	0	0	0	115.8	I113 L122 F386 V390 Q426	I113-F428 HydrophobicContact CD1-CZ 4.33Å; I113-F428 HydrophobicContact CG2-CD1 4.45Å; I113-F428 HydrophobicContact CG2-CE1 3.88Å; I113-F428 HydrophobicContact CG2-CZ 4.2Å; L122-F428 HydrophobicContact CD2-CD1 3.97Å; L122-F428 HydrophobicContact CD2-CE1 3.58Å; F386-F428 AromaticContact CE2-CZ 3.95Å; F386-F428 HydrophobicContact CE2-CZ 3.95Å; F386-F428 HydrophobicContact CZ-CE1 4.3Å; F386-F428 HydrophobicContact CZ-CZ 4.1Å; V390-F428 HydrophobicContact CG2-CD1 4.01Å; V390-F428 HydrophobicContact CG2-CD2 4.02Å; V390-F428 HydrophobicContact CG2-CE1 3.82Å; V390-F428 HydrophobicContact CG2-CE2 3.81Å; V390-F428 HydrophobicContact CG2-CG 4.11Å; V390-F428 HydrophobicContact CG2-CZ 3.71Å; Q426-F428 PolarHBondContact O-N 2.95Å
429	C	74.4	Confident	69.8	Low	17 Å²	17	51.2 Å²	51.2	12%	0.115	27%	0.268	C	S	.	.	S	Bend	trans	-121.1	155.2	179.3	-65.8	0	0	0	0	111.3	C395 F427 S433	C395-C429 VanDerWaalsContact CA-SG 3.5Å; C395-C429 HydrophobicContact CB-CB 3.81Å; C395-C429 WeakPolarHBondContact CB-SG 3.28Å; C395-C429 VanDerWaalsContact SG-CA 3.6Å; C395-C429 WeakPolarHBondContact SG-CB 3.12Å; C395-C429 CovalentContact SG-SG 2.03Å; C395-C429 PolarHBondContact SG-SG 3.29Å; F427-C429 PolarHBondContact O-N 3.22Å; C429-S433 WeakPolarHBondContact CB-OG 3.37Å
430	S	68.6	Low	71.7	Confident	91 Å²	91	46 Å²	46	64%	0.636	24%	0.24	S	C	*	.			trans	-65	150.7	178	50.3	0	0	0	0	112.2	K432 S433	S430-K432 PolarHBondContact O-N 3.46Å; S430-S433 PolarHBondContact N-OG 3.46Å; S430-S433 PolarHBondContact O-N 3.39Å; S430-S433 PolarHBondContact O-OG 3.36Å; S430-S433 PolarHBondContact OG-OG 2.92Å
431	N	64.8	Low	73.5	Confident	148 Å²	148	43.8 Å²	43.8	79%	0.791	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-44.3	123.6	178.5	-70.1	-12.5	0	0	0	111.5
432	K	70.1	Confident	75.2	Confident	172 Å²	172	38.8 Å²	38.8	75%	0.748	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	90.7	-0.7	-176.6	-52.1	173.6	-178.4	179.6	0	117.4	L398 S430	L398-K432 WeakPolarHBondContact CB-O 3.47Å; L398-K432 PolarHBondContact N-O 3.07Å; L398-K432 VanDerWaalsContact N-O 3.08Å; S430-K432 PolarHBondContact O-N 3.46Å
433	S	74.9	Confident	76.8	Confident	4 Å²	4	35.8 Å²	35.8	3%	0.028	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	150.1	171	59.8	0	0	0	0	111.1	R396 C429 S430	R396-S433 CarbonylContact O-C 3.12Å; R396-S433 WeakPolarHBondContact O-CA 3.24Å; R396-S433 WeakPolarHBondContact O-CB 3.5Å; C429-S433 WeakPolarHBondContact CB-OG 3.37Å; S430-S433 PolarHBondContact N-OG 3.46Å; S430-S433 PolarHBondContact O-N 3.39Å; S430-S433 PolarHBondContact O-OG 3.36Å; S430-S433 PolarHBondContact OG-OG 2.92Å
434	Y	78.5	Confident	78.1	Confident	16 Å²	16	36.9 Å²	36.9	6%	0.063	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	152.5	178.3	74.8	-87.4	0	0	0	111.3	C395 R396 L398 I424 D436	C395-Y434 WeakPolarHBondContact CA-O 3.42Å; R396-Y434 HydrophobicContact CB-CE1 3.98Å; R396-Y434 PolarHBondContact N-O 3.01Å; R396-Y434 VanDerWaalsContact O-CD1 3.3Å; R396-Y434 WeakPolarHBondContact O-CD1 3.3Å; R396-Y434 PolarHBondContact O-N 3.28Å; L398-Y434 HydrophobicContact CD1-CD1 4.4Å; I424-Y434 HydrophobicContact CG2-CD1 4.03Å; I424-Y434 HydrophobicContact CG2-CD2 3.79Å; I424-Y434 HydrophobicContact CG2-CG 3.43Å; I424-Y434 VanDerWaalsContact CG2-CG 3.43Å; Y434-D436 WeakPolarHBondContact CE2-OD1 3.46Å; Y434-D436 PolarHBondContact OH-OD1 3.39Å
435	N	83.8	Confident	79	Confident	3 Å²	3	37.2 Å²	37.2	2%	0.016	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	117.4	178.8	-176.5	-31.7	0	0	0	109.5	S389 G393 R425 F427 M437 A438 T439	S389-N435 PolarHBondContact O-ND2 2.86Å; G393-N435 WeakPolarHBondContact CA-OD1 3.29Å; R425-N435 PolarHBondContact O-N 2.97Å; F427-N435 VanDerWaalsContact O-CB 3.27Å; F427-N435 WeakPolarHBondContact O-CB 3.5Å; N435-M437 VanDerWaalsContact C-N 3.35Å; N435-M437 PolarHBondContact O-N 3.43Å; N435-M437 PolarHBondContact OD1-N 2.93Å; N435-A438 HydrophobicContact CB-CB 3.78Å; N435-A438 PolarHBondContact O-N 2.91Å; N435-A438 PolarHBondContact OD1-N 2.81Å; N435-A438 VanDerWaalsContact OD1-N 3.12Å; N435-T439 WeakPolarHBondContact O-CB 3.45Å; N435-T439 PolarHBondContact O-N 3.49Å; N435-T439 PolarHBondContact O-OG1 3.46Å
436	D	83.4	Confident	79.6	Confident	0 Å²	0	36.9 Å²	36.9	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-57.2	-46.8	-179.2	-79.2	1.2	0	0	0	111.8	E394 R396 Y434 T439 L440 F459 S460	E394-D436 PolarHBondContact O-N 3.09Å; R396-D436 WeakPolarHBondContact CD-OD1 3.33Å; R396-D436 VanDerWaalsContact CD-OD2 3.23Å; R396-D436 WeakPolarHBondContact CD-OD2 3.32Å; R396-D436 IonicContact CZ-OD2 2.88Å; R396-D436 IonicContact NE-OD2 3.61Å; R396-D436 PolarHBondContact NE-OD2 3.39Å; Y434-D436 WeakPolarHBondContact CE2-OD1 3.46Å; Y434-D436 PolarHBondContact OH-OD1 3.39Å; D436-T439 PolarHBondContact O-N 3.04Å; D436-L440 PolarHBondContact O-N 3.43Å; D436-F459 HydrophobicContact CB-CD1 4.32Å; D436-S460 PolarHBondContact OD2-N 2.86Å
437	M	86.2	Confident	80.3	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-71.4	-42.2	-175.5	-174.8	66.7	79.9	0	0	111.5	N435 T439 L440 F441 T463 I466 F467	N435-M437 VanDerWaalsContact C-N 3.35Å; N435-M437 PolarHBondContact O-N 3.43Å; N435-M437 PolarHBondContact OD1-N 2.93Å; M437-T439 PolarHBondContact O-N 2.88Å; M437-L440 PolarHBondContact O-N 3.31Å; M437-L440 VanDerWaalsContact O-N 3.16Å; M437-F441 HydrophobicContact CG-CD2 3.88Å; M437-F441 HydrophobicContact CG-CE2 4.04Å; M437-F441 PolarHBondContact O-N 3.11Å; M437-F441 VanDerWaalsContact O-N 3.11Å; M437-F441 HydrophobicContact SD-CD2 3.71Å; M437-F441 HydrophobicContact SD-CE2 3.39Å; M437-F441 WeakPolarHBondContact SD-CE2 3.41Å; M437-F441 HydrophobicContact SD-CZ 4.45Å; M437-T463 VanDerWaalsContact CE-O 3.28Å; M437-T463 WeakPolarHBondContact CE-O 3.42Å; M437-I466 HydrophobicContact CE-CB 4.08Å; M437-I466 HydrophobicContact CE-CG2 3.89Å; M437-F467 HydrophobicContact CE-CB 4.17Å; M437-F467 HydrophobicContact SD-CB 3.86Å; M437-F467 HydrophobicContact SD-CD2 4.03Å; M437-F467 HydrophobicContact SD-CG 4.43Å
438	A	82.9	Confident	81	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-64.2	-34.8	177.6	0	0	0	0	0	111.4	F427 N435 L440 F441 F442	F427-A438 HydrophobicContact CB-CB 4.23Å; F427-A438 HydrophobicContact CD2-CB 4.36Å; N435-A438 HydrophobicContact CB-CB 3.78Å; N435-A438 PolarHBondContact O-N 2.91Å; N435-A438 PolarHBondContact OD1-N 2.81Å; N435-A438 VanDerWaalsContact OD1-N 3.12Å; A438-L440 VanDerWaalsContact C-N 3.29Å; A438-L440 PolarHBondContact O-N 3.42Å; A438-F441 PolarHBondContact O-N 3.48Å; A438-F442 HydrophobicContact CB-CD2 4.01Å; A438-F442 HydrophobicContact CB-CE2 4.49Å; A438-F442 WeakPolarHBondContact O-CB 3.31Å; A438-F442 PolarHBondContact O-N 2.73Å
439	T	84.3	Confident	81.7	Confident	0 Å²	0	30.5 Å²	30.5	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-63.9	-34.3	175.9	-59.8	0	0	0	0	111.7	R425 N435 D436 M437 N443	R425-T439 PolarHBondContact N-OG1 3.31Å; N435-T439 WeakPolarHBondContact O-CB 3.45Å; N435-T439 PolarHBondContact O-N 3.49Å; N435-T439 PolarHBondContact O-OG1 3.46Å; D436-T439 PolarHBondContact O-N 3.04Å; M437-T439 PolarHBondContact O-N 2.88Å; T439-N443 WeakPolarHBondContact O-CB 3.45Å; T439-N443 PolarHBondContact O-ND2 2.89Å
440	L	85.9	Confident	82.3	Confident	5 Å²	5	32.9 Å²	32.9	3%	0.026	17%	0.174	C	C	.	.	H	α-helix	trans	-76.8	-40.5	176.8	-66.5	174.1	0	0	0	113.4	D436 M437 A438 L452 F459 L464 F467	D436-L440 PolarHBondContact O-N 3.43Å; M437-L440 PolarHBondContact O-N 3.31Å; M437-L440 VanDerWaalsContact O-N 3.16Å; A438-L440 VanDerWaalsContact C-N 3.29Å; A438-L440 PolarHBondContact O-N 3.42Å; L440-L452 HydrophobicContact CD2-CD2 4.16Å; L440-L452 HydrophobicContact CD2-CG 4.2Å; L440-F459 HydrophobicContact CD1-CD1 4.49Å; L440-F459 HydrophobicContact CD1-CE1 4.49Å; L440-F459 HydrophobicContact CD2-CE1 4.13Å; L440-F459 HydrophobicContact CD2-CZ 4.34Å; L440-F459 HydrophobicContact CG-CE1 4.25Å; L440-L464 HydrophobicContact CD1-CD2 4.17Å; L440-F467 HydrophobicContact CB-CD2 3.84Å; L440-F467 HydrophobicContact CB-CE2 3.6Å; L440-F467 HydrophobicContact CB-CG 4.47Å; L440-F467 HydrophobicContact CB-CZ 4.05Å; L440-F467 HydrophobicContact CD1-CB 4.29Å; L440-F467 HydrophobicContact CD1-CD1 4.05Å; L440-F467 HydrophobicContact CD1-CD2 4.04Å; L440-F467 HydrophobicContact CD1-CE1 4.43Å; L440-F467 HydrophobicContact CD1-CE2 4.42Å; L440-F467 HydrophobicContact CD1-CG 3.85Å
441	F	87.9	Confident	83	Confident	19 Å²	19	28.9 Å²	28.9	8%	0.083	15%	0.145	C	C	.	.	H	α-helix	trans	-89	-35.2	-174.8	-79.8	-58.1	0	0	0	115.5	F192 I385 A388 M437 A438 N443 F467 L470 Y471	F192-F441 HydrophobicContact CE1-CD1 4.48Å; F192-F441 HydrophobicContact CZ-CD1 4.09Å; F192-F441 AromaticContact CZ-CE1 3.86Å; F192-F441 HydrophobicContact CZ-CE1 3.86Å; I385-F441 HydrophobicContact CD1-CD1 4.38Å; I385-F441 HydrophobicContact CG1-CD1 3.82Å; I385-F441 HydrophobicContact CG1-CE1 4.09Å; I385-F441 HydrophobicContact CG1-CG 4.23Å; I385-F441 HydrophobicContact CG2-CB 3.56Å; I385-F441 HydrophobicContact CG2-CD1 4.28Å; I385-F441 HydrophobicContact CG2-CD2 4.42Å; I385-F441 HydrophobicContact CG2-CG 3.89Å; A388-F441 HydrophobicContact CB-CE2 4.45Å; M437-F441 HydrophobicContact CG-CD2 3.88Å; M437-F441 HydrophobicContact CG-CE2 4.04Å; M437-F441 PolarHBondContact O-N 3.11Å; M437-F441 VanDerWaalsContact O-N 3.11Å; M437-F441 HydrophobicContact SD-CD2 3.71Å; M437-F441 HydrophobicContact SD-CE2 3.39Å; M437-F441 WeakPolarHBondContact SD-CE2 3.41Å; M437-F441 HydrophobicContact SD-CZ 4.45Å; A438-F441 PolarHBondContact O-N 3.48Å; F441-N443 VanDerWaalsContact C-N 3.34Å; F441-F467 HydrophobicContact CD1-CD2 4.14Å; F441-F467 AromaticContact CD1-CE2 3.67Å; F441-F467 HydrophobicContact CD1-CE2 3.67Å; F441-F467 HydrophobicContact CD2-CD2 4.04Å; F441-F467 HydrophobicContact CD2-CE2 4.3Å; F441-F467 AromaticContact CE1-CD2 3.72Å; F441-F467 HydrophobicContact CE1-CD2 3.72Å; F441-F467 AromaticContact CE1-CE2 3.51Å; F441-F467 HydrophobicContact CE1-CE2 3.51Å; F441-F467 AromaticContact CE2-CD2 3.64Å; F441-F467 HydrophobicContact CE2-CD2 3.64Å; F441-F467 HydrophobicContact CE2-CE2 4.18Å; F441-F467 HydrophobicContact CG-CD2 4.28Å; F441-F467 HydrophobicContact CG-CE2 4.06Å; F441-F467 AromaticContact CZ-CD2 3.44Å; F441-F467 HydrophobicContact CZ-CD2 3.44Å; F441-F467 VanDerWaalsContact CZ-CD2 3.44Å; F441-F467 AromaticContact CZ-CE2 3.77Å; F441-F467 HydrophobicContact CZ-CE2 3.77Å; F441-F467 HydrophobicContact CZ-CG 4.48Å; F441-L470 HydrophobicContact CZ-CB 4.39Å; F441-Y471 HydrophobicContact CE1-CD2 4.19Å
442	F	85.2	Confident	84.1	Confident	4 Å²	4	21.8 Å²	21.8	2%	0.018	11%	0.107	C	C	.	.	S	Bend	trans	-88.8	-1	-176.7	-73.5	-86.9	0	0	0	113.6	F106 L129 I385 F386 S389 F427 A438	F106-F442 HydrophobicContact CE1-CB 4.36Å; F106-F442 HydrophobicContact CE1-CD1 4.08Å; F106-F442 WeakPolarHBondContact CE1-O 3.25Å; F106-F442 WeakPolarHBondContact CZ-O 3.3Å; L129-F442 HydrophobicContact CD2-CE1 3.78Å; L129-F442 HydrophobicContact CD2-CZ 4.39Å; I385-F442 HydrophobicContact CG2-CE2 4.38Å; I385-F442 HydrophobicContact CG2-CZ 4.42Å; F386-F442 AromaticContact CD2-CZ 3.98Å; F386-F442 HydrophobicContact CD2-CZ 3.98Å; S389-F442 WeakPolarHBondContact OG-CE2 3.33Å; F427-F442 HydrophobicContact CD2-CB 4.31Å; F427-F442 HydrophobicContact CD2-CD2 4.11Å; F427-F442 HydrophobicContact CD2-CG 4.08Å; F427-F442 HydrophobicContact CE2-CB 3.89Å; F427-F442 HydrophobicContact CE2-CD1 4.13Å; F427-F442 HydrophobicContact CE2-CD2 4.4Å; F427-F442 AromaticContact CE2-CG 3.9Å; F427-F442 HydrophobicContact CE2-CG 3.9Å; A438-F442 HydrophobicContact CB-CD2 4.01Å; A438-F442 HydrophobicContact CB-CE2 4.49Å; A438-F442 WeakPolarHBondContact O-CB 3.31Å; A438-F442 PolarHBondContact O-N 2.73Å
443	N	85.3	Confident	85	Confident	8 Å²	8	13.6 Å²	13.6	4%	0.043	7%	0.072	C	C	.	.	S	Bend	trans	-90.6	155.4	169.5	-78.4	-31.5	0	0	0	111.8	T423 R425 T439 F441 Q445 A447 Q451	T423-N443 PolarHBondContact O-ND2 3.45Å; T423-N443 PolarHBondContact O-OD1 3.24Å; R425-N443 PolarHBondContact NE-OD1 2.88Å; R425-N443 VanDerWaalsContact NE-OD1 3.17Å; T439-N443 WeakPolarHBondContact O-CB 3.45Å; T439-N443 PolarHBondContact O-ND2 2.89Å; F441-N443 VanDerWaalsContact C-N 3.34Å; N443-Q445 PolarHBondContact O-N 3.3Å; N443-A447 HydrophobicContact CB-CB 4.42Å; N443-Q451 PolarHBondContact ND2-NE2 3.28Å; N443-Q451 PolarHBondContact ND2-OE1 3.32Å
444	P	85.8	Confident	85.4	Confident	49 Å²	49	15.2 Å²	15.2	32%	0.318	8%	0.079	S	C	.	.			trans	-52.1	140.2	163.6	-21.4	32.2	0	0	0	110.2	T102 E446 A447 A448	T102-P444 HydrophobicContact CG2-CG 4.17Å; P444-E446 PolarHBondContact O-N 2.93Å; P444-E446 VanDerWaalsContact O-N 3.15Å; P444-A447 WeakPolarHBondContact O-CB 3.2Å; P444-A447 PolarHBondContact O-N 3.44Å; P444-A448 PolarHBondContact O-N 2.94Å
445	Q	88.1	Confident	85.4	Confident	29 Å²	29	15.6 Å²	15.6	14%	0.136	8%	0.081	C	C	.	.	H	α-helix	trans	-56.6	-35.3	-176	-62.1	170.5	34.8	0	0	112.3	L191 V193 N443 A448 I449 Y471 V489 L493	L191-Q445 PolarHBondContact O-NE2 3.23Å; L191-Q445 VanDerWaalsContact O-NE2 3.14Å; V193-Q445 PolarHBondContact O-NE2 2.92Å; N443-Q445 PolarHBondContact O-N 3.3Å; Q445-A448 PolarHBondContact O-N 2.89Å; Q445-I449 WeakPolarHBondContact O-CG1 3.4Å; Q445-I449 PolarHBondContact O-N 3.49Å; Q445-Y471 PolarHBondContact OE1-OH 3.3Å; Q445-V489 HydrophobicContact CB-CG1 3.74Å; Q445-L493 HydrophobicContact CB-CD2 4.35Å; Q445-L493 HydrophobicContact CG-CD2 4.45Å
446	E	84.8	Confident	84.4	Confident	52 Å²	52	21.3 Å²	21.3	24%	0.243	11%	0.112	C	C	.	.	H	α-helix	trans	-60.7	-43.5	175.9	-59.6	167.9	-162.7	0	0	111.9	K195 L308 P444 I449 H450	K195-E446 WeakPolarHBondContact CE-OE1 3.38Å; K195-E446 IonicContact NZ-OE1 3.07Å; K195-E446 PolarHBondContact NZ-OE1 2.95Å; K195-E446 IonicContact NZ-OE2 3.31Å; L308-E446 HydrophobicContact CD1-CB 4.08Å; L308-E446 HydrophobicContact CD1-CG 3.8Å; P444-E446 PolarHBondContact O-N 2.93Å; P444-E446 VanDerWaalsContact O-N 3.15Å; E446-I449 PolarHBondContact O-N 3.22Å; E446-H450 PolarHBondContact O-N 3.19Å; E446-H450 VanDerWaalsContact O-N 3.1Å
447	A	83.9	Confident	83.4	Confident	23 Å²	23	22.6 Å²	22.6	19%	0.19	12%	0.124	C	C	.	.	H	α-helix	trans	-70.1	-37	177.6	0	0	0	0	0	111.6	T423 N443 P444 H450 Q451	T423-A447 HydrophobicContact CG2-CB 4.34Å; N443-A447 HydrophobicContact CB-CB 4.42Å; P444-A447 WeakPolarHBondContact O-CB 3.2Å; P444-A447 PolarHBondContact O-N 3.44Å; A447-H450 PolarHBondContact O-N 2.99Å; A447-Q451 WeakPolarHBondContact O-CG 3.41Å; A447-Q451 PolarHBondContact O-N 3.17Å
448	A	87.9	Confident	82.3	Confident	0 Å²	0	26.4 Å²	26.4	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-63.5	-39.4	175.1	0	0	0	0	0	112.1	P444 Q445 Q451 L452 L493	P444-A448 PolarHBondContact O-N 2.94Å; Q445-A448 PolarHBondContact O-N 2.89Å; A448-Q451 PolarHBondContact O-N 3.33Å; A448-L452 WeakPolarHBondContact O-CG 3.03Å; A448-L452 PolarHBondContact O-N 2.97Å; A448-L493 HydrophobicContact CB-CD1 3.96Å; A448-L493 HydrophobicContact CB-CD2 4.41Å
449	I	89.8	Confident	82.1	Confident	1 Å²	1	26.6 Å²	26.6	1%	0.005	15%	0.149	C	C	.	.	H	α-helix	trans	-61.7	-48.5	172.5	-67.1	170.4	0	0	0	110.2	L308 F310 Q445 E446 Q451 L452 F453 V489 L492 L493	L308-I449 HydrophobicContact CD1-CD1 4.48Å; F310-I449 HydrophobicContact CD1-CG2 4.15Å; F310-I449 HydrophobicContact CE1-CG2 4.14Å; Q445-I449 WeakPolarHBondContact O-CG1 3.4Å; Q445-I449 PolarHBondContact O-N 3.49Å; E446-I449 PolarHBondContact O-N 3.22Å; I449-Q451 VanDerWaalsContact C-N 3.27Å; I449-Q451 PolarHBondContact O-N 3.14Å; I449-L452 PolarHBondContact O-N 3.44Å; I449-L452 VanDerWaalsContact O-N 3.15Å; I449-F453 HydrophobicContact CG2-CD2 3.78Å; I449-F453 HydrophobicContact CG2-CE1 4.16Å; I449-F453 HydrophobicContact CG2-CE2 3.32Å; I449-F453 HydrophobicContact CG2-CG 4.4Å; I449-F453 HydrophobicContact CG2-CZ 3.53Å; I449-F453 WeakPolarHBondContact O-CG 3.37Å; I449-F453 PolarHBondContact O-N 2.78Å; I449-V489 HydrophobicContact CD1-CG1 3.94Å; I449-L492 HydrophobicContact CD1-CB 4.03Å; I449-L493 HydrophobicContact CD1-CB 4.25Å; I449-L493 HydrophobicContact CG1-CB 3.94Å; I449-L493 HydrophobicContact CG1-CD1 3.72Å; I449-L493 HydrophobicContact CG1-CG 4.38Å
450	H	85.3	Confident	82	Confident	67 Å²	67	27 Å²	27	31%	0.31	15%	0.152	S	C	.	.	H	α-helix	trans	-60.5	-37.1	-179.7	-169.5	-85.6	0	0	0	112.5	E446 A447 F453 H454	E446-H450 PolarHBondContact O-N 3.19Å; E446-H450 VanDerWaalsContact O-N 3.1Å; A447-H450 PolarHBondContact O-N 2.99Å; H450-F453 PolarHBondContact O-N 3.49Å; H450-H454 AromaticContact CD2-CE1 3.73Å; H450-H454 AromaticContact CD2-ND1 3.65Å; H450-H454 AromaticContact CE1-CE1 3.95Å; H450-H454 AromaticContact CE1-ND1 3.47Å; H450-H454 PolarHBondContact CE1-ND1 3.44Å; H450-H454 AromaticContact CG-ND1 3.9Å; H450-H454 AromaticContact ND1-ND1 3.79Å; H450-H454 AromaticContact NE2-CE1 3.4Å; H450-H454 PolarHBondContact NE2-CE1 3.1Å; H450-H454 AromaticContact NE2-ND1 3.36Å; H450-H454 PolarHBondContact NE2-ND1 3.04Å; H450-H454 PolarHBondContact O-N 2.94Å; H450-H454 PolarHBondContact O-ND1 3.47Å
451	Q	85.3	Confident	82	Confident	6 Å²	6	29.4 Å²	29.4	3%	0.028	17%	0.168	C	C	.	.	H	α-helix	trans	-64.8	-45.9	173.7	-75.2	174.1	-18.7	0	0	112.1	T423 N443 A447 A448 I449 F453 Q455	T423-Q451 PolarHBondContact O-NE2 3.49Å; T423-Q451 PolarHBondContact OG1-NE2 3.14Å; N443-Q451 PolarHBondContact ND2-NE2 3.28Å; N443-Q451 PolarHBondContact ND2-OE1 3.32Å; A447-Q451 WeakPolarHBondContact O-CG 3.41Å; A447-Q451 PolarHBondContact O-N 3.17Å; A448-Q451 PolarHBondContact O-N 3.33Å; I449-Q451 VanDerWaalsContact C-N 3.27Å; I449-Q451 PolarHBondContact O-N 3.14Å; Q451-F453 PolarHBondContact O-N 2.89Å; Q451-Q455 WeakPolarHBondContact O-CB 3.21Å; Q451-Q455 PolarHBondContact O-N 3.35Å
452	L	87.7	Confident	82	Confident	0 Å²	0	31.1 Å²	31.1	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-62.3	-30.9	177.8	-72.3	168.7	0	0	0	112.7	L440 A448 I449 F459 L464 L493 A496 A497 R500	L440-L452 HydrophobicContact CD2-CD2 4.16Å; L440-L452 HydrophobicContact CD2-CG 4.2Å; A448-L452 WeakPolarHBondContact O-CG 3.03Å; A448-L452 PolarHBondContact O-N 2.97Å; I449-L452 PolarHBondContact O-N 3.44Å; I449-L452 VanDerWaalsContact O-N 3.15Å; L452-F459 HydrophobicContact CD2-CD2 4.45Å; L452-F459 HydrophobicContact CD2-CE2 4.22Å; L452-L464 HydrophobicContact CD2-CD2 3.96Å; L452-L493 HydrophobicContact CD1-CD1 3.61Å; L452-A496 HydrophobicContact CB-CB 4.34Å; L452-A496 HydrophobicContact CD1-CB 3.88Å; L452-A497 HydrophobicContact CD1-CB 4.39Å; L452-R500 HydrophobicContact CD2-CB 4.21Å; L452-R500 HydrophobicContact CD2-CG 4.13Å; L452-R500 PolarHBondContact O-NH1 2.65Å
453	F	88.1	Confident	82.1	Confident	0 Å²	0	31 Å²	31	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-77.2	-50.4	179	-68.6	-10.3	0	0	0	113.1	F310 F313 I449 H450 Q451 A496 G517 A520 L521 A524	F310-F453 HydrophobicContact CB-CD2 4.26Å; F310-F453 HydrophobicContact CB-CE2 4.18Å; F310-F453 HydrophobicContact CD1-CD2 4.24Å; F310-F453 AromaticContact CD1-CE2 3.56Å; F310-F453 HydrophobicContact CD1-CE2 3.56Å; F310-F453 HydrophobicContact CE1-CE2 4.08Å; F310-F453 HydrophobicContact CG-CD2 4.5Å; F310-F453 AromaticContact CG-CE2 3.95Å; F310-F453 HydrophobicContact CG-CE2 3.95Å; F313-F453 HydrophobicContact CE1-CB 4.12Å; F313-F453 HydrophobicContact CE1-CG 4.41Å; F313-F453 HydrophobicContact CE2-CD2 4.32Å; F313-F453 HydrophobicContact CZ-CB 3.77Å; F313-F453 AromaticContact CZ-CD2 3.67Å; F313-F453 HydrophobicContact CZ-CD2 3.67Å; F313-F453 HydrophobicContact CZ-CE2 4.35Å; F313-F453 AromaticContact CZ-CG 3.78Å; F313-F453 HydrophobicContact CZ-CG 3.78Å; I449-F453 HydrophobicContact CG2-CD2 3.78Å; I449-F453 HydrophobicContact CG2-CE1 4.16Å; I449-F453 HydrophobicContact CG2-CE2 3.32Å; I449-F453 HydrophobicContact CG2-CG 4.4Å; I449-F453 HydrophobicContact CG2-CZ 3.53Å; I449-F453 WeakPolarHBondContact O-CG 3.37Å; I449-F453 PolarHBondContact O-N 2.78Å; H450-F453 PolarHBondContact O-N 3.49Å; Q451-F453 PolarHBondContact O-N 2.89Å; F453-A496 HydrophobicContact CD1-CB 4.5Å; F453-A496 HydrophobicContact CE1-CB 3.75Å; F453-A496 HydrophobicContact CZ-CB 4.44Å; F453-G517 WeakPolarHBondContact O-CA 3.35Å; F453-A520 HydrophobicContact CD1-CB 3.8Å; F453-A520 HydrophobicContact CE1-CB 4.08Å; F453-L521 HydrophobicContact CE1-CB 4.37Å; F453-L521 HydrophobicContact CE2-CD1 4.21Å; F453-L521 HydrophobicContact CZ-CD1 4.03Å; F453-A524 HydrophobicContact CE1-CB 4.4Å; F453-A524 HydrophobicContact CZ-CB 4.22Å
454	H	83.8	Confident	82.3	Confident	38 Å²	38	30.7 Å²	30.7	18%	0.176	18%	0.183	C	C	.	.	H	α-helix	trans	-109.5	-17.1	-169	-57.6	101.6	0	0	0	115.7	F310 H450 D456	F310-H454 PolarHBondContact O-CE1 2.93Å; H450-H454 AromaticContact CD2-CE1 3.73Å; H450-H454 AromaticContact CD2-ND1 3.65Å; H450-H454 AromaticContact CE1-CE1 3.95Å; H450-H454 AromaticContact CE1-ND1 3.47Å; H450-H454 PolarHBondContact CE1-ND1 3.44Å; H450-H454 AromaticContact CG-ND1 3.9Å; H450-H454 AromaticContact ND1-ND1 3.79Å; H450-H454 AromaticContact NE2-CE1 3.4Å; H450-H454 PolarHBondContact NE2-CE1 3.1Å; H450-H454 AromaticContact NE2-ND1 3.36Å; H450-H454 PolarHBondContact NE2-ND1 3.04Å; H450-H454 PolarHBondContact O-N 2.94Å; H450-H454 PolarHBondContact O-ND1 3.47Å; H454-D456 PolarHBondContact O-N 3.14Å
455	Q	77.8	Confident	82.5	Confident	24 Å²	24	31 Å²	31	11%	0.112	19%	0.187	C	C	.	.			trans	-73.8	122.3	-177.2	-166.9	173.8	-11.5	0	0	109.5	Q451 G457 R500	Q451-Q455 WeakPolarHBondContact O-CB 3.21Å; Q451-Q455 PolarHBondContact O-N 3.35Å; Q455-G457 VanDerWaalsContact C-N 3.26Å; Q455-R500 VanDerWaalsContact O-CZ 3.32Å; Q455-R500 PolarHBondContact O-NH1 2.97Å; Q455-R500 PolarHBondContact O-NH2 3.34Å
456	D	62.9	Low	82.7	Confident	123 Å²	123	32.4 Å²	32.4	66%	0.658	19%	0.194	S	C	*	.			trans	-79.4	-11.5	174.9	-69.1	-41.3	0	0	0	113.2	H454 T458	H454-D456 PolarHBondContact O-N 3.14Å; D456-T458 PolarHBondContact O-N 2.87Å
457	G	61.6	Low	83.1	Confident	26 Å²	26	30 Å²	30	27%	0.268	18%	0.183	S	C	.	.	S	Bend	trans	-50.3	129.6	172.8	0	0	0	0	0	110.9	Q455 F459	Q455-G457 VanDerWaalsContact C-N 3.26Å; G457-F459 PolarHBondContact O-N 3.41Å
458	T	64.6	Low	83.5	Confident	81 Å²	81	30.2 Å²	30.2	50%	0.497	18%	0.18	S	C	.	.			trans	-73.3	115.6	178	57.3	0	0	0	0	107.5	R396 D456	R396-T458 PolarHBondContact NH1-O 2.96Å; R396-T458 PolarHBondContact NH1-OG1 3.37Å; D456-T458 PolarHBondContact O-N 2.87Å
459	F	77.9	Confident	83.8	Confident	3 Å²	3	34.9 Å²	34.9	1%	0.013	20%	0.204	C	C	.	.			trans	-80.1	138.7	161.1	-65.2	-82.4	0	0	0	108	D436 L440 L452 G457 L464 N504	D436-F459 HydrophobicContact CB-CD1 4.32Å; L440-F459 HydrophobicContact CD1-CD1 4.49Å; L440-F459 HydrophobicContact CD1-CE1 4.49Å; L440-F459 HydrophobicContact CD2-CE1 4.13Å; L440-F459 HydrophobicContact CD2-CZ 4.34Å; L440-F459 HydrophobicContact CG-CE1 4.25Å; L452-F459 HydrophobicContact CD2-CD2 4.45Å; L452-F459 HydrophobicContact CD2-CE2 4.22Å; G457-F459 PolarHBondContact O-N 3.41Å; F459-L464 HydrophobicContact CB-CD1 3.56Å; F459-L464 HydrophobicContact CB-CD2 4.2Å; F459-L464 HydrophobicContact CB-CG 3.68Å; F459-L464 HydrophobicContact CG-CD1 4.42Å; F459-L464 HydrophobicContact CG-CD2 4.41Å; F459-L464 HydrophobicContact CG-CG 4.42Å; F459-N504 PolarHBondContact O-ND2 3.2Å
460	S	82.4	Confident	84	Confident	10 Å²	10	36.7 Å²	36.7	7%	0.07	21%	0.214	C	C	.	.			trans	-57.5	134.2	173.4	-162.7	0	0	0	0	110.5	E394 R396 D436 A462 T463 L464	E394-S460 PolarHBondContact OE1-OG 3.33Å; E394-S460 VanDerWaalsContact OE2-CB 3.24Å; E394-S460 WeakPolarHBondContact OE2-CB 3.14Å; E394-S460 PolarHBondContact OE2-OG 3.47Å; R396-S460 VanDerWaalsContact NH2-CA 3.34Å; D436-S460 PolarHBondContact OD2-N 2.86Å; S460-A462 PolarHBondContact O-N 3.39Å; S460-T463 VanDerWaalsContact CB-OG1 3.32Å; S460-T463 WeakPolarHBondContact CB-OG1 3.46Å; S460-T463 PolarHBondContact O-N 3.31Å; S460-T463 PolarHBondContact O-OG1 2.9Å; S460-T463 VanDerWaalsContact O-OG1 3.04Å; S460-L464 PolarHBondContact O-N 3.25Å
461	P	85.7	Confident	84.4	Confident	55 Å²	55	33.6 Å²	33.6	36%	0.357	20%	0.199	S	C	.	.	H	α-helix	trans	-56.8	-32.5	170.9	-24.1	33.6	0	0	0	112.4	S465 L501 N504	P461-S465 WeakPolarHBondContact O-CB 3.48Å; P461-S465 PolarHBondContact O-N 3.19Å; P461-L501 HydrophobicContact CB-CD1 4.22Å; P461-L501 VanDerWaalsContact O-CD1 3.22Å; P461-L501 WeakPolarHBondContact O-CD1 3.22Å; P461-N504 HydrophobicContact CG-CB 4.34Å
462	A	87.7	Confident	84.9	Confident	54 Å²	54	34 Å²	34	45%	0.446	20%	0.201	S	C	.	.	H	α-helix	trans	-67.7	-49.6	178.1	0	0	0	0	0	111.9	S460 L464 S465 I466	S460-A462 PolarHBondContact O-N 3.39Å; A462-L464 PolarHBondContact O-N 3.4Å; A462-S465 PolarHBondContact O-N 3Å; A462-I466 WeakPolarHBondContact O-CG1 3.33Å; A462-I466 PolarHBondContact O-N 3.39Å; A462-I466 VanDerWaalsContact O-N 3.08Å
463	T	87.9	Confident	85.3	Confident	3 Å²	3	37.7 Å²	37.7	2%	0.018	22%	0.22	C	C	.	.	H	α-helix	trans	-64.3	-41.5	179.6	60	0	0	0	0	111.3	E394 M437 S460 S465 I466 F467	E394-T463 HydrophobicContact CB-CG2 4.27Å; E394-T463 HydrophobicContact CG-CG2 4Å; M437-T463 VanDerWaalsContact CE-O 3.28Å; M437-T463 WeakPolarHBondContact CE-O 3.42Å; S460-T463 VanDerWaalsContact CB-OG1 3.32Å; S460-T463 WeakPolarHBondContact CB-OG1 3.46Å; S460-T463 PolarHBondContact O-N 3.31Å; S460-T463 PolarHBondContact O-OG1 2.9Å; S460-T463 VanDerWaalsContact O-OG1 3.04Å; T463-S465 PolarHBondContact O-N 3.24Å; T463-I466 PolarHBondContact O-N 3.37Å; T463-F467 VanDerWaalsContact O-CB 3.32Å; T463-F467 WeakPolarHBondContact O-CB 3.41Å; T463-F467 PolarHBondContact O-N 2.83Å
464	L	89.4	Confident	85.5	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-62.2	-41.1	174.5	-81.2	172.2	0	0	0	112.8	L440 L452 F459 S460 A462 F467 F468 R500 L501	L440-L464 HydrophobicContact CD1-CD2 4.17Å; L452-L464 HydrophobicContact CD2-CD2 3.96Å; F459-L464 HydrophobicContact CB-CD1 3.56Å; F459-L464 HydrophobicContact CB-CD2 4.2Å; F459-L464 HydrophobicContact CB-CG 3.68Å; F459-L464 HydrophobicContact CG-CD1 4.42Å; F459-L464 HydrophobicContact CG-CD2 4.41Å; F459-L464 HydrophobicContact CG-CG 4.42Å; S460-L464 PolarHBondContact O-N 3.25Å; A462-L464 PolarHBondContact O-N 3.4Å; L464-F467 PolarHBondContact O-N 3.06Å; L464-F468 VanDerWaalsContact O-CB 3.3Å; L464-F468 WeakPolarHBondContact O-CB 3.45Å; L464-F468 PolarHBondContact O-N 2.95Å; L464-R500 HydrophobicContact CD1-CB 4.38Å; L464-R500 HydrophobicContact CD1-CG 3.96Å; L464-L501 HydrophobicContact CB-CD1 4.09Å
465	S	90.8	Very high	86	Confident	56 Å²	56	36.8 Å²	36.8	39%	0.392	22%	0.217	S	C	.	.	H	α-helix	trans	-64.9	-41.1	178.8	-172.8	0	0	0	0	111.8	P461 A462 T463 L469	P461-S465 WeakPolarHBondContact O-CB 3.48Å; P461-S465 PolarHBondContact O-N 3.19Å; A462-S465 PolarHBondContact O-N 3Å; T463-S465 PolarHBondContact O-N 3.24Å; S465-L469 PolarHBondContact O-N 3.47Å; S465-L469 VanDerWaalsContact O-N 3.15Å
466	I	91.6	Very high	86.8	Confident	58 Å²	58	35.9 Å²	35.9	30%	0.297	21%	0.213	S	C	.	.	H	α-helix	trans	-67	-46.1	176.6	-67.4	167.5	0	0	0	110.2	L392 M437 A462 T463 F468 L469 L470	L392-I466 HydrophobicContact CD1-CD1 4.43Å; L392-I466 HydrophobicContact CD1-CG2 3.88Å; M437-I466 HydrophobicContact CE-CB 4.08Å; M437-I466 HydrophobicContact CE-CG2 3.89Å; A462-I466 WeakPolarHBondContact O-CG1 3.33Å; A462-I466 PolarHBondContact O-N 3.39Å; A462-I466 VanDerWaalsContact O-N 3.08Å; T463-I466 PolarHBondContact O-N 3.37Å; I466-F468 PolarHBondContact O-N 3.18Å; I466-L469 PolarHBondContact O-N 3.46Å; I466-L470 HydrophobicContact CG2-CD1 3.79Å; I466-L470 HydrophobicContact CG2-CG 4.32Å; I466-L470 WeakPolarHBondContact O-CB 3.35Å; I466-L470 WeakPolarHBondContact O-CG 3.34Å; I466-L470 PolarHBondContact O-N 3.24Å
467	F	92.1	Very high	88.3	Confident	1 Å²	1	33.3 Å²	33.3	0%	0.004	20%	0.195	C	C	.	.	H	α-helix	trans	-56.2	-50.1	176.5	174.8	-98.4	0	0	0	111.1	M437 L440 F441 T463 L464 L469 L470 Y471 L493 A497	M437-F467 HydrophobicContact CE-CB 4.17Å; M437-F467 HydrophobicContact SD-CB 3.86Å; M437-F467 HydrophobicContact SD-CD2 4.03Å; M437-F467 HydrophobicContact SD-CG 4.43Å; L440-F467 HydrophobicContact CB-CD2 3.84Å; L440-F467 HydrophobicContact CB-CE2 3.6Å; L440-F467 HydrophobicContact CB-CG 4.47Å; L440-F467 HydrophobicContact CB-CZ 4.05Å; L440-F467 HydrophobicContact CD1-CB 4.29Å; L440-F467 HydrophobicContact CD1-CD1 4.05Å; L440-F467 HydrophobicContact CD1-CD2 4.04Å; L440-F467 HydrophobicContact CD1-CE1 4.43Å; L440-F467 HydrophobicContact CD1-CE2 4.42Å; L440-F467 HydrophobicContact CD1-CG 3.85Å; F441-F467 HydrophobicContact CD1-CD2 4.14Å; F441-F467 AromaticContact CD1-CE2 3.67Å; F441-F467 HydrophobicContact CD1-CE2 3.67Å; F441-F467 HydrophobicContact CD2-CD2 4.04Å; F441-F467 HydrophobicContact CD2-CE2 4.3Å; F441-F467 AromaticContact CE1-CD2 3.72Å; F441-F467 HydrophobicContact CE1-CD2 3.72Å; F441-F467 AromaticContact CE1-CE2 3.51Å; F441-F467 HydrophobicContact CE1-CE2 3.51Å; F441-F467 AromaticContact CE2-CD2 3.64Å; F441-F467 HydrophobicContact CE2-CD2 3.64Å; F441-F467 HydrophobicContact CE2-CE2 4.18Å; F441-F467 HydrophobicContact CG-CD2 4.28Å; F441-F467 HydrophobicContact CG-CE2 4.06Å; F441-F467 AromaticContact CZ-CD2 3.44Å; F441-F467 HydrophobicContact CZ-CD2 3.44Å; F441-F467 VanDerWaalsContact CZ-CD2 3.44Å; F441-F467 AromaticContact CZ-CE2 3.77Å; F441-F467 HydrophobicContact CZ-CE2 3.77Å; F441-F467 HydrophobicContact CZ-CG 4.48Å; T463-F467 VanDerWaalsContact O-CB 3.32Å; T463-F467 WeakPolarHBondContact O-CB 3.41Å; T463-F467 PolarHBondContact O-N 2.83Å; L464-F467 PolarHBondContact O-N 3.06Å; F467-L469 PolarHBondContact O-N 2.93Å; F467-L470 PolarHBondContact O-N 2.95Å; F467-Y471 HydrophobicContact CE2-CD2 4.21Å; F467-Y471 AromaticContact CZ-CD2 3.92Å; F467-Y471 HydrophobicContact CZ-CD2 3.92Å; F467-Y471 HydrophobicContact CZ-CG 4.31Å; F467-Y471 WeakPolarHBondContact O-CB 3.49Å; F467-Y471 PolarHBondContact O-N 3.48Å; F467-L493 HydrophobicContact CE1-CG 4.39Å; F467-L493 HydrophobicContact CZ-CD2 4.14Å; F467-L493 HydrophobicContact CZ-CG 4.27Å; F467-A497 HydrophobicContact CD1-CB 3.84Å; F467-A497 HydrophobicContact CE1-CB 3.92Å
468	F	94.1	Very high	89.8	Confident	29 Å²	29	32.1 Å²	32.1	13%	0.127	18%	0.182	C	C	.	.	H	α-helix	trans	-56.1	-49.5	178.8	168.6	-100.9	0	0	0	111.9	L343 L464 I466 Y471 F472 C494 A497 F498	L343-F468 HydrophobicContact CD1-CZ 3.9Å; L343-F468 HydrophobicContact CD2-CZ 4.35Å; L464-F468 VanDerWaalsContact O-CB 3.3Å; L464-F468 WeakPolarHBondContact O-CB 3.45Å; L464-F468 PolarHBondContact O-N 2.95Å; I466-F468 PolarHBondContact O-N 3.18Å; F468-Y471 PolarHBondContact O-N 3.21Å; F468-F472 WeakPolarHBondContact O-CB 3.33Å; F468-F472 PolarHBondContact O-N 3.47Å; F468-C494 WeakPolarHBondContact CD2-O 3.31Å; F468-C494 WeakPolarHBondContact CE2-SG 3.42Å; F468-A497 HydrophobicContact CB-CB 4.43Å; F468-F498 HydrophobicContact CD2-CB 3.98Å; F468-F498 HydrophobicContact CE2-CB 3.79Å
469	L	94.2	Very high	91.1	Very high	98 Å²	98	28.9 Å²	28.9	51%	0.513	16%	0.161	S	C	.	.	H	α-helix	trans	-66.2	-45.6	-177.1	-173.5	147.7	0	0	0	112.1	S465 I466 F467 L473	S465-L469 PolarHBondContact O-N 3.47Å; S465-L469 VanDerWaalsContact O-N 3.15Å; I466-L469 PolarHBondContact O-N 3.46Å; F467-L469 PolarHBondContact O-N 2.93Å; L469-L473 HydrophobicContact CD2-CD1 3.84Å; L469-L473 WeakPolarHBondContact O-CG 3.32Å; L469-L473 PolarHBondContact O-N 2.74Å
470	L	93.4	Very high	91.5	Very high	38 Å²	38	30.2 Å²	30.2	20%	0.199	18%	0.175	C	C	.	.	H	α-helix	trans	-63.8	-45.9	177.5	-69.6	177.2	0	0	0	111.2	V384 A388 F441 I466 F467 L473 L474	V384-L470 HydrophobicContact CG1-CD1 4.44Å; V384-L470 HydrophobicContact CG1-CD2 4.17Å; A388-L470 HydrophobicContact CB-CD1 3.86Å; F441-L470 HydrophobicContact CZ-CB 4.39Å; I466-L470 HydrophobicContact CG2-CD1 3.79Å; I466-L470 HydrophobicContact CG2-CG 4.32Å; I466-L470 WeakPolarHBondContact O-CB 3.35Å; I466-L470 WeakPolarHBondContact O-CG 3.34Å; I466-L470 PolarHBondContact O-N 3.24Å; F467-L470 PolarHBondContact O-N 2.95Å; L470-L473 PolarHBondContact O-N 2.96Å; L470-L474 WeakPolarHBondContact O-CB 3.48Å; L470-L474 VanDerWaalsContact O-CG 3.26Å; L470-L474 WeakPolarHBondContact O-CG 3.26Å; L470-L474 PolarHBondContact O-N 3.2Å
471	Y	94.1	Very high	91.9	Very high	3 Å²	3	29.9 Å²	29.9	1%	0.012	17%	0.173	C	C	.	.	H	α-helix	trans	-64.3	-42.2	-179.6	-164.2	-83.8	0	0	0	111.5	F192 F441 Q445 F467 F468 L473 A475 P490 L493 C494	F192-Y471 HydrophobicContact CB-CE2 4.41Å; F192-Y471 HydrophobicContact CD1-CD2 4.24Å; F192-Y471 AromaticContact CD1-CE2 3.49Å; F192-Y471 HydrophobicContact CD1-CE2 3.49Å; F192-Y471 VanDerWaalsContact CD1-CE2 3.49Å; F192-Y471 HydrophobicContact CD2-CD2 4.2Å; F192-Y471 HydrophobicContact CD2-CE2 4.07Å; F192-Y471 HydrophobicContact CE1-CD2 4.01Å; F192-Y471 AromaticContact CE1-CE2 3.6Å; F192-Y471 HydrophobicContact CE1-CE2 3.6Å; F192-Y471 AromaticContact CE2-CD2 3.95Å; F192-Y471 HydrophobicContact CE2-CD2 3.95Å; F192-Y471 HydrophobicContact CE2-CE2 4.14Å; F192-Y471 HydrophobicContact CG-CD2 4.33Å; F192-Y471 AromaticContact CG-CE2 3.74Å; F192-Y471 HydrophobicContact CG-CE2 3.74Å; F192-Y471 AromaticContact CG-CZ 3.98Å; F192-Y471 AromaticContact CZ-CD2 3.85Å; F192-Y471 HydrophobicContact CZ-CD2 3.85Å; F192-Y471 AromaticContact CZ-CE2 3.93Å; F192-Y471 HydrophobicContact CZ-CE2 3.93Å; F441-Y471 HydrophobicContact CE1-CD2 4.19Å; Q445-Y471 PolarHBondContact OE1-OH 3.3Å; F467-Y471 HydrophobicContact CE2-CD2 4.21Å; F467-Y471 AromaticContact CZ-CD2 3.92Å; F467-Y471 HydrophobicContact CZ-CD2 3.92Å; F467-Y471 HydrophobicContact CZ-CG 4.31Å; F467-Y471 WeakPolarHBondContact O-CB 3.49Å; F467-Y471 PolarHBondContact O-N 3.48Å; F468-Y471 PolarHBondContact O-N 3.21Å; Y471-L473 PolarHBondContact O-N 3.19Å; Y471-A475 HydrophobicContact CD1-CB 4.32Å; Y471-A475 HydrophobicContact CE1-CB 4.16Å; Y471-A475 WeakPolarHBondContact O-CB 2.99Å; Y471-A475 PolarHBondContact O-N 3.49Å; Y471-P490 HydrophobicContact CE1-CB 3.99Å; Y471-P490 WeakPolarHBondContact CE1-O 3.45Å; Y471-P490 WeakPolarHBondContact OH-CA 3.25Å; Y471-L493 HydrophobicContact CD2-CD2 4.34Å; Y471-L493 HydrophobicContact CE1-CB 4.34Å; Y471-L493 HydrophobicContact CE1-CD2 4.3Å; Y471-L493 HydrophobicContact CE2-CD2 3.65Å; Y471-C494 HydrophobicContact CD1-CB 4.15Å
472	F	95.5	Very high	92.1	Very high	14 Å²	14	28 Å²	28	6%	0.061	16%	0.161	C	C	.	.	H	α-helix	trans	-56.9	-50.6	176.8	176.5	-91.1	0	0	0	112.3	L346 F347 M350 F468 C476 F527	L346-F472 HydrophobicContact CD2-CE1 4.34Å; L346-F472 HydrophobicContact CD2-CZ 4.11Å; L346-F472 HydrophobicContact CG-CZ 4.18Å; F347-F472 HydrophobicContact CB-CE2 3.81Å; F347-F472 HydrophobicContact CB-CZ 3.94Å; F347-F472 HydrophobicContact CD2-CD2 4.1Å; F347-F472 AromaticContact CD2-CE2 3.75Å; F347-F472 HydrophobicContact CD2-CE2 3.75Å; F347-F472 HydrophobicContact CD2-CZ 4.1Å; F347-F472 HydrophobicContact CG-CE2 4.28Å; M350-F472 HydrophobicContact SD-CE1 3.94Å; F468-F472 WeakPolarHBondContact O-CB 3.33Å; F468-F472 PolarHBondContact O-N 3.47Å; F472-C476 WeakPolarHBondContact O-CB 2.93Å; F472-C476 PolarHBondContact O-N 2.87Å; F472-F527 HydrophobicContact CD2-CE2 4.01Å; F472-F527 AromaticContact CD2-CZ 3.82Å; F472-F527 HydrophobicContact CD2-CZ 3.82Å; F472-F527 AromaticContact CE2-CE2 3.78Å; F472-F527 HydrophobicContact CE2-CE2 3.78Å; F472-F527 AromaticContact CE2-CZ 3.79Å; F472-F527 HydrophobicContact CE2-CZ 3.79Å
473	L	95.1	Very high	92.4	Very high	78 Å²	78	25.5 Å²	25.5	41%	0.408	14%	0.14	S	C	.	.	H	α-helix	trans	-67.1	-45	-178.5	-66.8	175.1	0	0	0	112.1	M350 L469 L470 Y471 C476 W477	M350-L473 HydrophobicContact CE-CD2 3.73Å; L469-L473 HydrophobicContact CD2-CD1 3.84Å; L469-L473 WeakPolarHBondContact O-CG 3.32Å; L469-L473 PolarHBondContact O-N 2.74Å; L470-L473 PolarHBondContact O-N 2.96Å; Y471-L473 PolarHBondContact O-N 3.19Å; L473-C476 PolarHBondContact O-N 3.05Å; L473-W477 PolarHBondContact O-N 3.45Å
474	L	94	Very high	92.7	Very high	15 Å²	15	25.3 Å²	25.3	8%	0.079	14%	0.139	C	C	.	.	H	α-helix	trans	-69.7	-38.5	-178.9	-68.8	175.3	0	0	0	112.1	F192 T381 V384 L470 C476 W477 T478	F192-L474 HydrophobicContact CD2-CB 3.51Å; F192-L474 HydrophobicContact CE2-CB 3.41Å; F192-L474 VanDerWaalsContact CE2-CB 3.41Å; F192-L474 HydrophobicContact CE2-CD1 3.6Å; F192-L474 HydrophobicContact CE2-CG 4.15Å; F192-L474 HydrophobicContact CZ-CD1 4.34Å; T381-L474 HydrophobicContact CG2-CB 4.44Å; T381-L474 HydrophobicContact CG2-CD2 3.98Å; V384-L474 HydrophobicContact CB-CD1 4.41Å; V384-L474 HydrophobicContact CG1-CD1 4.02Å; L470-L474 WeakPolarHBondContact O-CB 3.48Å; L470-L474 VanDerWaalsContact O-CG 3.26Å; L470-L474 WeakPolarHBondContact O-CG 3.26Å; L470-L474 PolarHBondContact O-N 3.2Å; L474-C476 VanDerWaalsContact C-N 3.35Å; L474-W477 HydrophobicContact CD2-CE3 4.32Å; L474-W477 PolarHBondContact O-N 3.17Å; L474-T478 WeakPolarHBondContact O-CB 3.35Å; L474-T478 PolarHBondContact O-N 2.97Å; L474-T478 PolarHBondContact O-OG1 3.15Å
475	A	93.6	Very high	92.7	Very high	4 Å²	4	25.4 Å²	25.4	3%	0.033	14%	0.14	C	C	.	.	H	α-helix	trans	-63.4	-41.6	173.2	0	0	0	0	0	111.2	F192 F347 Y471 W477 T478 Y479 P490	F192-A475 HydrophobicContact CB-CB 4.31Å; F347-A475 HydrophobicContact CE2-CB 4.45Å; Y471-A475 HydrophobicContact CD1-CB 4.32Å; Y471-A475 HydrophobicContact CE1-CB 4.16Å; Y471-A475 WeakPolarHBondContact O-CB 2.99Å; Y471-A475 PolarHBondContact O-N 3.49Å; A475-W477 VanDerWaalsContact C-N 3.33Å; A475-W477 PolarHBondContact O-N 3Å; A475-T478 PolarHBondContact O-N 2.93Å; A475-Y479 PolarHBondContact O-N 3.31Å; A475-Y479 VanDerWaalsContact O-N 3.15Å; A475-P490 HydrophobicContact CB-CB 4.17Å
476	C	94.4	Very high	92.7	Very high	4 Å²	4	22.9 Å²	22.9	3%	0.027	12%	0.122	C	C	.	.	H	α-helix	trans	-61.8	-40.9	175.4	-173.2	0	0	0	0	111.9	F347 N351 F472 L473 L474	F347-C476 HydrophobicContact CD2-CB 3.94Å; F347-C476 VanDerWaalsContact CE2-CA 3.48Å; F347-C476 HydrophobicContact CE2-CB 3.51Å; F347-C476 HydrophobicContact CZ-CB 4.03Å; N351-C476 PolarHBondContact ND2-O 3.33Å; F472-C476 WeakPolarHBondContact O-CB 2.93Å; F472-C476 PolarHBondContact O-N 2.87Å; L473-C476 PolarHBondContact O-N 3.05Å; L474-C476 VanDerWaalsContact C-N 3.35Å
477	W	94.2	Very high	92.7	Very high	70 Å²	70	20.3 Å²	20.3	27%	0.265	11%	0.109	S	C	.	.	H	α-helix	trans	-71.7	-36	179.2	-171.3	27.5	0	0	0	112.5	R358 V377 V380 L473 L474 A475	R358-W477 PolarHBondContact NH2-O 2.91Å; V377-W477 HydrophobicContact CG1-CE3 4.49Å; V377-W477 HydrophobicContact CG2-CD2 4.02Å; V377-W477 HydrophobicContact CG2-CE3 4.45Å; V377-W477 HydrophobicContact CG2-CH2 4.24Å; V377-W477 HydrophobicContact CG2-CZ2 3.78Å; V380-W477 HydrophobicContact CB-CH2 4Å; V380-W477 HydrophobicContact CB-CZ3 3.71Å; V380-W477 HydrophobicContact CG1-CH2 4.24Å; V380-W477 HydrophobicContact CG1-CZ3 3.67Å; V380-W477 HydrophobicContact CG2-CH2 4.02Å; V380-W477 HydrophobicContact CG2-CZ3 4.24Å; L473-W477 PolarHBondContact O-N 3.45Å; L474-W477 HydrophobicContact CD2-CE3 4.32Å; L474-W477 PolarHBondContact O-N 3.17Å; A475-W477 VanDerWaalsContact C-N 3.33Å; A475-W477 PolarHBondContact O-N 3Å
478	T	93.8	Very high	92.7	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-68.9	-35.4	-179.2	-56.3	0	0	0	0	112	L191 V193 L474 A475 G480 V481	L191-T478 HydrophobicContact CB-CG2 4.03Å; L191-T478 HydrophobicContact CD2-CG2 4.3Å; V193-T478 HydrophobicContact CG1-CG2 3.54Å; L474-T478 WeakPolarHBondContact O-CB 3.35Å; L474-T478 PolarHBondContact O-N 2.97Å; L474-T478 PolarHBondContact O-OG1 3.15Å; A475-T478 PolarHBondContact O-N 2.93Å; T478-G480 PolarHBondContact O-N 3.35Å; T478-V481 WeakPolarHBondContact O-CB 3.23Å; T478-V481 VanDerWaalsContact O-CG2 3.25Å; T478-V481 WeakPolarHBondContact O-CG2 3.39Å; T478-V481 PolarHBondContact O-N 3.39Å
479	Y	90.8	Very high	92.7	Very high	14 Å²	14	19.2 Å²	19.2	6%	0.055	11%	0.105	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.5	127.6	177.7	-173.9	-100.6	0	0	0	111.2	N351 R358 A475 L487 I573 H577	N351-Y479 VanDerWaalsContact ND2-CD1 3.29Å; N351-Y479 WeakPolarHBondContact ND2-CD1 3.3Å; N351-Y479 WeakPolarHBondContact OD1-CD1 3.18Å; R358-Y479 PolarHBondContact NH1-O 3.47Å; A475-Y479 PolarHBondContact O-N 3.31Å; A475-Y479 VanDerWaalsContact O-N 3.15Å; Y479-L487 HydrophobicContact CD2-CB 4.14Å; Y479-L487 HydrophobicContact CD2-CD1 3.98Å; Y479-L487 HydrophobicContact CD2-CD2 4.37Å; Y479-L487 HydrophobicContact CD2-CG 4.39Å; Y479-L487 HydrophobicContact CE2-CB 4.1Å; Y479-L487 HydrophobicContact CE2-CD2 4.3Å; Y479-L487 HydrophobicContact CG-CD1 4.2Å; Y479-I573 HydrophobicContact CD1-CG1 4.49Å; Y479-I573 HydrophobicContact CE1-CD1 4.06Å; Y479-I573 HydrophobicContact CE1-CG1 3.76Å; Y479-H577 AromaticContact CE1-CE1 3.39Å; Y479-H577 WeakPolarHBondContact CE1-CE1 3.49Å; Y479-H577 AromaticContact CE1-ND1 3.86Å; Y479-H577 AromaticContact CE1-NE2 3.51Å
480	G	87.1	Confident	92.6	Very high	31 Å²	31	14.6 Å²	14.6	32%	0.32	8%	0.081	S	C	.	.	T	Hydrogen-bonded Turn	trans	95.9	-0.9	-176.6	0	0	0	0	0	115	T478	T478-G480 PolarHBondContact O-N 3.35Å
481	V	91	Very high	92.7	Very high	3 Å²	3	12.9 Å²	12.9	2%	0.018	7%	0.072	C	C	.	.	S	Bend	trans	-67.2	154.1	166.7	176.2	0	0	0	0	110.1	V377 T478 V483	V377-V481 HydrophobicContact CB-CG2 4.48Å; V377-V481 HydrophobicContact CG1-CG2 4.5Å; V377-V481 HydrophobicContact CG2-CG2 3.96Å; T478-V481 WeakPolarHBondContact O-CB 3.23Å; T478-V481 VanDerWaalsContact O-CG2 3.25Å; T478-V481 WeakPolarHBondContact O-CG2 3.39Å; T478-V481 PolarHBondContact O-N 3.39Å; V481-V483 HydrophobicContact CB-CG2 4.3Å; V481-V483 HydrophobicContact CG1-CG1 4.43Å; V481-V483 HydrophobicContact CG1-CG2 4.13Å; V481-V483 PolarHBondContact O-N 2.87Å
482	S	90.3	Very high	92.7	Very high	16 Å²	16	12.9 Å²	12.9	11%	0.112	7%	0.072	C	C	.	.	S	Bend	trans	-73	52.2	179.5	60.4	0	0	0	0	114.5	S141 V144 R370	S141-S482 PolarHBondContact OG-O 2.94Å; S141-S482 PolarHBondContact OG-OG 3.27Å; V144-S482 WeakPolarHBondContact CB-O 3.16Å; R370-S482 PolarHBondContact O-OG 2.93Å
483	V	93.1	Very high	92.6	Very high	0 Å²	0	12.3 Å²	12.3	0%	0	7%	0.07	C	C	.	.	S	Bend	trans	-133.2	151.8	173.7	-65.9	0	0	0	0	109.8	V137 A140 G152 L191 V481 S485	V137-V483 HydrophobicContact CG1-CG1 4.46Å; A140-V483 HydrophobicContact CB-CG1 4.18Å; G152-V483 PolarHBondContact N-O 3.42Å; L191-V483 HydrophobicContact CD1-CG2 3.98Å; V481-V483 HydrophobicContact CB-CG2 4.3Å; V481-V483 HydrophobicContact CG1-CG1 4.43Å; V481-V483 HydrophobicContact CG1-CG2 4.13Å; V481-V483 PolarHBondContact O-N 2.87Å; V483-S485 PolarHBondContact O-N 3.25Å; V483-S485 PolarHBondContact O-OG 3.38Å
484	P	93.8	Very high	92.6	Very high	0 Å²	0	8.7 Å²	8.7	0%	0	5%	0.051	C	C	.	.			trans	-65	123.3	171	-17.8	34.5	0	0	0	108.7	V144 K179 V183 S186	V144-P484 HydrophobicContact CG2-CG 3.92Å; K179-P484 HydrophobicContact CG-CB 4.26Å; V183-P484 HydrophobicContact CB-CB 4.38Å; S186-P484 WeakPolarHBondContact CB-O 3.2Å; S186-P484 PolarHBondContact OG-O 3.01Å
485	S	90.6	Very high	92.7	Very high	1 Å²	1	8 Å²	8	1%	0.007	5%	0.047	C	C	.	.			trans	-150.4	130.6	-171.7	49.7	0	0	0	0	112.1	G152 S153 V483	G152-S485 CarbonylContact C-O 3.41Å; G152-S485 PolarHBondContact O-N 2.88Å; S153-S485 WeakPolarHBondContact CA-O 3.34Å; S153-S485 VanDerWaalsContact CB-O 3.32Å; S153-S485 WeakPolarHBondContact CB-O 3.24Å; S153-S485 PolarHBondContact N-O 3.14Å; V483-S485 PolarHBondContact O-N 3.25Å; V483-S485 PolarHBondContact O-OG 3.38Å
486	G	91.1	Very high	92.7	Very high	3 Å²	3	7.8 Å²	7.8	3%	0.031	5%	0.045	C	C	.	.	B	Isolated β-bridge	trans	-98.4	147.2	170.7	0	0	0	0	0	112	G194	G194-G486 PolarHBondContact N-O 3.05Å; G194-G486 VanDerWaalsContact O-CA 3.25Å; G194-G486 WeakPolarHBondContact O-CA 3.33Å; G194-G486 PolarHBondContact O-N 2.02Å
487	L	91.6	Very high	92.7	Very high	4 Å²	4	7.6 Å²	7.6	2%	0.021	4%	0.044	C	C	.	.	S	Bend	trans	-101.6	-12.8	-177.8	-169.8	66.8	0	0	0	113.8	F347 Y479 P490 S491 V531 I573	F347-L487 HydrophobicContact CE1-CD1 4.01Å; F347-L487 HydrophobicContact CE1-CD2 4.09Å; F347-L487 HydrophobicContact CZ-CD1 3.81Å; Y479-L487 HydrophobicContact CD2-CB 4.14Å; Y479-L487 HydrophobicContact CD2-CD1 3.98Å; Y479-L487 HydrophobicContact CD2-CD2 4.37Å; Y479-L487 HydrophobicContact CD2-CG 4.39Å; Y479-L487 HydrophobicContact CE2-CB 4.1Å; Y479-L487 HydrophobicContact CE2-CD2 4.3Å; Y479-L487 HydrophobicContact CG-CD1 4.2Å; L487-P490 WeakPolarHBondContact O-CD 3.24Å; L487-S491 WeakPolarHBondContact O-CB 3.48Å; L487-S491 PolarHBondContact O-N 3.47Å; L487-S491 VanDerWaalsContact O-N 3.09Å; L487-S491 PolarHBondContact O-OG 2.8Å; L487-V531 HydrophobicContact CD2-CG1 3.69Å; L487-I573 HydrophobicContact CD2-CB 4.41Å; L487-I573 HydrophobicContact CD2-CG1 4.01Å; L487-I573 HydrophobicContact CD2-CG2 3.84Å
488	F	91.9	Very high	92.7	Very high	3 Å²	3	5.2 Å²	5.2	1%	0.013	4%	0.036	C	C	.	.	H	α-helix	trans	-58.5	-57.2	-177.1	-85.3	-91.4	0	0	0	112.8	I155 F250 S491 L492 L528 M534 Y574	I155-F488 HydrophobicContact CD1-CD2 4.27Å; I155-F488 HydrophobicContact CD1-CE2 3.62Å; F250-F488 HydrophobicContact CE1-CB 4.42Å; F250-F488 HydrophobicContact CE1-CD1 4.25Å; F250-F488 HydrophobicContact CE2-CD1 4.42Å; F250-F488 HydrophobicContact CZ-CB 3.99Å; F250-F488 AromaticContact CZ-CD1 3.59Å; F250-F488 HydrophobicContact CZ-CD1 3.59Å; F250-F488 HydrophobicContact CZ-CD2 4.4Å; F250-F488 HydrophobicContact CZ-CE1 4.14Å; F250-F488 AromaticContact CZ-CG 3.74Å; F250-F488 HydrophobicContact CZ-CG 3.74Å; F488-S491 PolarHBondContact O-N 3.48Å; F488-L492 WeakPolarHBondContact O-CG 3.47Å; F488-L492 PolarHBondContact O-N 2.88Å; F488-L528 HydrophobicContact CD1-CD1 3.94Å; F488-L528 HydrophobicContact CD1-CD2 4.03Å; F488-L528 HydrophobicContact CE1-CD1 4.39Å; F488-L528 HydrophobicContact CE1-CD2 4.39Å; F488-M534 HydrophobicContact CZ-SD 4.1Å; F488-Y574 HydrophobicContact CE2-CE2 4.38Å; F488-Y574 WeakPolarHBondContact CE2-OH 3.49Å
489	V	92.4	Very high	92.7	Very high	4 Å²	4	5.2 Å²	5.2	2%	0.024	4%	0.036	C	C	.	.	H	α-helix	trans	-62.6	-46.4	-177.1	178.2	0	0	0	0	112.2	E196 L308 Q445 I449 S491 L492 L493	E196-V489 HydrophobicContact CG-CG2 3.9Å; L308-V489 HydrophobicContact CD2-CG2 4.49Å; Q445-V489 HydrophobicContact CB-CG1 3.74Å; I449-V489 HydrophobicContact CD1-CG1 3.94Å; V489-S491 VanDerWaalsContact C-N 3.3Å; V489-S491 PolarHBondContact O-N 3.44Å; V489-L492 PolarHBondContact O-N 3.41Å; V489-L493 PolarHBondContact O-N 3.45Å
490	P	93.9	Very high	92.7	Very high	2 Å²	2	4.7 Å²	4.7	1%	0.013	3%	0.034	C	C	.	.	H	α-helix	trans	-59.1	-39.2	175	-26.7	34.6	0	0	0	113.8	F192 Y471 A475 L487 L493 C494	F192-P490 WeakPolarHBondContact O-CG 3.44Å; Y471-P490 HydrophobicContact CE1-CB 3.99Å; Y471-P490 WeakPolarHBondContact CE1-O 3.45Å; Y471-P490 WeakPolarHBondContact OH-CA 3.25Å; A475-P490 HydrophobicContact CB-CB 4.17Å; L487-P490 WeakPolarHBondContact O-CD 3.24Å; P490-L493 PolarHBondContact O-N 2.97Å; P490-C494 VanDerWaalsContact O-CB 3.28Å; P490-C494 WeakPolarHBondContact O-CB 3.46Å; P490-C494 PolarHBondContact O-N 3.15Å
491	S	94.4	Very high	92.9	Very high	2 Å²	2	4.3 Å²	4.3	1%	0.014	2%	0.024	C	C	.	.	H	α-helix	trans	-69.1	-42	178	-54.7	0	0	0	0	111.6	L487 F488 V489 L493 C494 G495 F527	L487-S491 WeakPolarHBondContact O-CB 3.48Å; L487-S491 PolarHBondContact O-N 3.47Å; L487-S491 VanDerWaalsContact O-N 3.09Å; L487-S491 PolarHBondContact O-OG 2.8Å; F488-S491 PolarHBondContact O-N 3.48Å; V489-S491 VanDerWaalsContact C-N 3.3Å; V489-S491 PolarHBondContact O-N 3.44Å; S491-L493 PolarHBondContact O-N 3.27Å; S491-C494 PolarHBondContact O-N 3.49Å; S491-G495 PolarHBondContact O-N 2.69Å; S491-F527 VanDerWaalsContact O-CD1 3.23Å; S491-F527 WeakPolarHBondContact O-CD1 3.23Å
492	L	94.1	Very high	93	Very high	2 Å²	2	5.7 Å²	5.7	1%	0.01	3%	0.033	C	C	.	.	H	α-helix	trans	-59.7	-45.4	174.6	-75	169.5	0	0	0	111.7	L308 F310 I449 F488 V489 G495 A496 A524 L528 L542	L308-L492 HydrophobicContact CD2-CD1 3.86Å; F310-L492 HydrophobicContact CE1-CD1 4.28Å; F310-L492 HydrophobicContact CZ-CD1 3.86Å; I449-L492 HydrophobicContact CD1-CB 4.03Å; F488-L492 WeakPolarHBondContact O-CG 3.47Å; F488-L492 PolarHBondContact O-N 2.88Å; V489-L492 PolarHBondContact O-N 3.41Å; L492-G495 PolarHBondContact O-N 3.12Å; L492-A496 VanDerWaalsContact O-CB 3.23Å; L492-A496 WeakPolarHBondContact O-CB 3.37Å; L492-A496 PolarHBondContact O-N 3.27Å; L492-A524 HydrophobicContact CD2-CB 3.93Å; L492-A524 WeakPolarHBondContact O-CB 3.3Å; L492-L528 HydrophobicContact CD2-CB 4.36Å; L492-L528 HydrophobicContact CD2-CD2 3.6Å; L492-L528 HydrophobicContact CG-CD2 3.9Å; L492-L542 HydrophobicContact CD2-CD2 4.32Å
493	L	94.3	Very high	92.9	Very high	2 Å²	2	5 Å²	5	1%	0.01	3%	0.027	C	C	.	.	H	α-helix	trans	-66.9	-42.2	-179.7	-176	60.8	0	0	0	111.9	Q445 A448 I449 L452 F467 Y471 V489 P490 S491 A496 A497	Q445-L493 HydrophobicContact CB-CD2 4.35Å; Q445-L493 HydrophobicContact CG-CD2 4.45Å; A448-L493 HydrophobicContact CB-CD1 3.96Å; A448-L493 HydrophobicContact CB-CD2 4.41Å; I449-L493 HydrophobicContact CD1-CB 4.25Å; I449-L493 HydrophobicContact CG1-CB 3.94Å; I449-L493 HydrophobicContact CG1-CD1 3.72Å; I449-L493 HydrophobicContact CG1-CG 4.38Å; L452-L493 HydrophobicContact CD1-CD1 3.61Å; F467-L493 HydrophobicContact CE1-CG 4.39Å; F467-L493 HydrophobicContact CZ-CD2 4.14Å; F467-L493 HydrophobicContact CZ-CG 4.27Å; Y471-L493 HydrophobicContact CD2-CD2 4.34Å; Y471-L493 HydrophobicContact CE1-CB 4.34Å; Y471-L493 HydrophobicContact CE1-CD2 4.3Å; Y471-L493 HydrophobicContact CE2-CD2 3.65Å; V489-L493 PolarHBondContact O-N 3.45Å; P490-L493 PolarHBondContact O-N 2.97Å; S491-L493 PolarHBondContact O-N 3.27Å; L493-A496 PolarHBondContact O-N 2.79Å; L493-A497 WeakPolarHBondContact O-CB 3.48Å; L493-A497 PolarHBondContact O-N 3.38Å
494	C	95	Very high	92.7	Very high	2 Å²	2	5.5 Å²	5.5	1%	0.014	3%	0.03	C	C	.	.	H	α-helix	trans	-60.8	-45.8	175.6	-170.3	0	0	0	0	111.4	F468 Y471 P490 S491 A497 F498 F527	F468-C494 WeakPolarHBondContact CD2-O 3.31Å; F468-C494 WeakPolarHBondContact CE2-SG 3.42Å; Y471-C494 HydrophobicContact CD1-CB 4.15Å; P490-C494 VanDerWaalsContact O-CB 3.28Å; P490-C494 WeakPolarHBondContact O-CB 3.46Å; P490-C494 PolarHBondContact O-N 3.15Å; S491-C494 PolarHBondContact O-N 3.49Å; C494-A497 PolarHBondContact O-N 3.1Å; C494-F498 PolarHBondContact O-N 2.74Å; C494-F527 HydrophobicContact CB-CD1 4.09Å; C494-F527 HydrophobicContact CB-CE1 3.85Å; C494-F527 HydrophobicContact CB-CZ 4.43Å
495	G	95.4	Very high	92.4	Very high	0 Å²	0	8.7 Å²	8.7	0%	0	5%	0.047	C	C	.	.	H	α-helix	trans	-68.5	-36.2	175.9	0	0	0	0	0	113.7	S491 L492 F498 G499 G523 A524	S491-G495 PolarHBondContact O-N 2.69Å; L492-G495 PolarHBondContact O-N 3.12Å; G495-F498 PolarHBondContact O-N 3.15Å; G495-G499 PolarHBondContact O-N 3.4Å; G495-G523 CarbonylContact C-O 3.55Å; G495-G523 VanDerWaalsContact CA-O 3.3Å; G495-G523 WeakPolarHBondContact CA-O 3.31Å; G495-G523 CarbonylContact O-C 3.21Å; G495-G523 WeakPolarHBondContact O-CA 3.35Å; G495-A524 VanDerWaalsContact C-N 3.28Å; G495-A524 PolarHBondContact O-N 3.33Å
496	A	94.1	Very high	92.2	Very high	0 Å²	0	9.5 Å²	9.5	0%	0	5%	0.051	C	C	.	.	H	α-helix	trans	-63.6	-43	175.5	0	0	0	0	0	111.5	L452 F453 L492 L493 G499 R500 A520 A524	L452-A496 HydrophobicContact CB-CB 4.34Å; L452-A496 HydrophobicContact CD1-CB 3.88Å; F453-A496 HydrophobicContact CD1-CB 4.5Å; F453-A496 HydrophobicContact CE1-CB 3.75Å; F453-A496 HydrophobicContact CZ-CB 4.44Å; L492-A496 VanDerWaalsContact O-CB 3.23Å; L492-A496 WeakPolarHBondContact O-CB 3.37Å; L492-A496 PolarHBondContact O-N 3.27Å; L493-A496 PolarHBondContact O-N 2.79Å; A496-G499 PolarHBondContact O-N 3.47Å; A496-R500 VanDerWaalsContact O-CB 3.3Å; A496-R500 WeakPolarHBondContact O-CB 3.26Å; A496-R500 PolarHBondContact O-N 2.99Å; A496-A520 WeakPolarHBondContact CA-O 3.21Å; A496-A524 HydrophobicContact CB-CB 4.18Å
497	A	93.7	Very high	91.9	Very high	0 Å²	0	14 Å²	14	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-62.9	-43.4	174.6	0	0	0	0	0	111.7	L452 F467 F468 L493 C494 R500 L501	L452-A497 HydrophobicContact CD1-CB 4.39Å; F467-A497 HydrophobicContact CD1-CB 3.84Å; F467-A497 HydrophobicContact CE1-CB 3.92Å; F468-A497 HydrophobicContact CB-CB 4.43Å; L493-A497 WeakPolarHBondContact O-CB 3.48Å; L493-A497 PolarHBondContact O-N 3.38Å; C494-A497 PolarHBondContact O-N 3.1Å; A497-R500 PolarHBondContact O-N 3.4Å; A497-L501 WeakPolarHBondContact O-CB 3.44Å; A497-L501 PolarHBondContact O-N 2.94Å
498	F	94.4	Very high	91.5	Very high	20 Å²	20	19.4 Å²	19.4	9%	0.088	10%	0.102	C	C	.	.	H	α-helix	trans	-60.7	-48.3	174.3	165.5	-109.2	0	0	0	112.3	M336 V339 L343 F468 C494 G495 R500 L501 V502	M336-F498 HydrophobicContact CB-CE1 4.49Å; M336-F498 HydrophobicContact CE-CE1 4.48Å; M336-F498 HydrophobicContact CG-CE1 4.45Å; V339-F498 HydrophobicContact CB-CZ 3.84Å; V339-F498 HydrophobicContact CG1-CE1 4.37Å; V339-F498 HydrophobicContact CG1-CE2 3.71Å; V339-F498 HydrophobicContact CG1-CZ 3.44Å; V339-F498 VanDerWaalsContact CG1-CZ 3.44Å; L343-F498 HydrophobicContact CD1-CD2 4.22Å; L343-F498 HydrophobicContact CD1-CE2 4.29Å; L343-F498 HydrophobicContact CD1-CG 4.47Å; F468-F498 HydrophobicContact CD2-CB 3.98Å; F468-F498 HydrophobicContact CE2-CB 3.79Å; C494-F498 PolarHBondContact O-N 2.74Å; G495-F498 PolarHBondContact O-N 3.15Å; F498-R500 VanDerWaalsContact C-N 3.35Å; F498-R500 PolarHBondContact O-N 3.28Å; F498-L501 WeakPolarHBondContact O-CB 3.31Å; F498-L501 PolarHBondContact O-N 2.95Å; F498-V502 HydrophobicContact CD2-CG2 4.27Å; F498-V502 HydrophobicContact CE2-CG2 3.77Å; F498-V502 HydrophobicContact CZ-CG2 3.9Å; F498-V502 WeakPolarHBondContact O-CG2 2.69Å; F498-V502 PolarHBondContact O-N 3.34Å
499	G	93.9	Very high	90.9	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-62.8	-41	178.7	0	0	0	0	0	112.6	G495 A496 V502 A503 F519	G495-G499 PolarHBondContact O-N 3.4Å; A496-G499 PolarHBondContact O-N 3.47Å; G499-V502 PolarHBondContact O-N 2.96Å; G499-A503 PolarHBondContact O-N 3.48Å; G499-F519 VanDerWaalsContact CA-O 3.25Å; G499-F519 WeakPolarHBondContact CA-O 3.28Å
500	R	91.4	Very high	90.3	Very high	4 Å²	4	32.3 Å²	32.3	2%	0.015	16%	0.162	C	C	.	.	H	α-helix	trans	-65.1	-39.5	175.2	-166.8	72	-176.9	-154.5	1.3	112.2	L452 Q455 L464 A496 A497 F498 A503 N504 S516 A520	L452-R500 HydrophobicContact CD2-CB 4.21Å; L452-R500 HydrophobicContact CD2-CG 4.13Å; L452-R500 PolarHBondContact O-NH1 2.65Å; Q455-R500 VanDerWaalsContact O-CZ 3.32Å; Q455-R500 PolarHBondContact O-NH1 2.97Å; Q455-R500 PolarHBondContact O-NH2 3.34Å; L464-R500 HydrophobicContact CD1-CB 4.38Å; L464-R500 HydrophobicContact CD1-CG 3.96Å; A496-R500 VanDerWaalsContact O-CB 3.3Å; A496-R500 WeakPolarHBondContact O-CB 3.26Å; A496-R500 PolarHBondContact O-N 2.99Å; A497-R500 PolarHBondContact O-N 3.4Å; F498-R500 VanDerWaalsContact C-N 3.35Å; F498-R500 PolarHBondContact O-N 3.28Å; R500-A503 WeakPolarHBondContact O-CB 3.18Å; R500-A503 PolarHBondContact O-N 3.01Å; R500-N504 PolarHBondContact O-N 2.93Å; R500-S516 VanDerWaalsContact NH1-CB 3.34Å; R500-A520 HydrophobicContact CB-CB 4.21Å
501	L	91.6	Very high	89.2	Confident	23 Å²	23	34.9 Å²	34.9	12%	0.12	19%	0.189	C	C	.	.	H	α-helix	trans	-59.8	-47.5	174.5	-179.7	71.9	0	0	0	110.9	P461 L464 A497 F498 A503 N504 I505	P461-L501 HydrophobicContact CB-CD1 4.22Å; P461-L501 VanDerWaalsContact O-CD1 3.22Å; P461-L501 WeakPolarHBondContact O-CD1 3.22Å; L464-L501 HydrophobicContact CB-CD1 4.09Å; A497-L501 WeakPolarHBondContact O-CB 3.44Å; A497-L501 PolarHBondContact O-N 2.94Å; F498-L501 WeakPolarHBondContact O-CB 3.31Å; F498-L501 PolarHBondContact O-N 2.95Å; L501-A503 PolarHBondContact O-N 3.47Å; L501-N504 PolarHBondContact O-N 3.47Å; L501-I505 HydrophobicContact CD1-CD1 4.37Å; L501-I505 HydrophobicContact CG-CD1 4.04Å; L501-I505 VanDerWaalsContact O-CG1 3.31Å; L501-I505 WeakPolarHBondContact O-CG1 3.25Å; L501-I505 PolarHBondContact O-N 2.85Å
502	V	91.8	Very high	88.2	Confident	32 Å²	32	38 Å²	38	19%	0.194	21%	0.206	C	C	.	.	H	α-helix	trans	-59.7	-46.5	176.4	173.5	0	0	0	0	110.6	M336 F498 G499 N504 I505 L506 F519	M336-V502 HydrophobicContact CG-CG1 4.28Å; M336-V502 HydrophobicContact SD-CB 4.41Å; M336-V502 HydrophobicContact SD-CG1 4Å; F498-V502 HydrophobicContact CD2-CG2 4.27Å; F498-V502 HydrophobicContact CE2-CG2 3.77Å; F498-V502 HydrophobicContact CZ-CG2 3.9Å; F498-V502 WeakPolarHBondContact O-CG2 2.69Å; F498-V502 PolarHBondContact O-N 3.34Å; G499-V502 PolarHBondContact O-N 2.96Å; V502-N504 VanDerWaalsContact C-N 3.34Å; V502-N504 PolarHBondContact O-N 3.42Å; V502-I505 PolarHBondContact O-N 2.82Å; V502-L506 HydrophobicContact CG1-CD1 3.91Å; V502-L506 HydrophobicContact CG1-CG 4.26Å; V502-L506 VanDerWaalsContact O-CG 3.32Å; V502-L506 WeakPolarHBondContact O-CG 3.41Å; V502-L506 PolarHBondContact O-N 3.01Å; V502-F519 HydrophobicContact CG1-CD1 4.42Å
503	A	89.4	Confident	87	Confident	0 Å²	0	47.5 Å²	47.5	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-57.3	-45.7	178.4	0	0	0	0	0	112.6	G499 R500 L501 I505 L506 K507 F519	G499-A503 PolarHBondContact O-N 3.48Å; R500-A503 WeakPolarHBondContact O-CB 3.18Å; R500-A503 PolarHBondContact O-N 3.01Å; L501-A503 PolarHBondContact O-N 3.47Å; A503-I505 PolarHBondContact O-N 3.44Å; A503-L506 PolarHBondContact O-N 3.37Å; A503-K507 WeakPolarHBondContact O-CB 3.22Å; A503-K507 PolarHBondContact O-N 2.94Å; A503-F519 HydrophobicContact CB-CB 3.66Å; A503-F519 HydrophobicContact CB-CG 4.12Å
504	N	87.6	Confident	86.2	Confident	11 Å²	11	48.5 Å²	48.5	6%	0.059	26%	0.255	C	S	.	.	H	α-helix	trans	-65.7	-39.2	179.2	-72.9	-4	0	0	0	111.7	F459 P461 R500 L501 V502 K507 V508	F459-N504 PolarHBondContact O-ND2 3.2Å; P461-N504 HydrophobicContact CG-CB 4.34Å; R500-N504 PolarHBondContact O-N 2.93Å; L501-N504 PolarHBondContact O-N 3.47Å; V502-N504 VanDerWaalsContact C-N 3.34Å; V502-N504 PolarHBondContact O-N 3.42Å; N504-K507 PolarHBondContact O-N 3.42Å; N504-V508 WeakPolarHBondContact O-CB 3.38Å; N504-V508 VanDerWaalsContact O-CG2 3.3Å; N504-V508 WeakPolarHBondContact O-CG2 3.36Å; N504-V508 PolarHBondContact O-N 3.24Å
505	I	87.7	Confident	85.5	Confident	67 Å²	67	52.2 Å²	52.2	34%	0.344	27%	0.269	S	S	.	.	H	α-helix	trans	-63.4	-44.4	175.5	-68.4	167	0	0	0	110.7	L501 V502 A503 V508 K509	L501-I505 HydrophobicContact CD1-CD1 4.37Å; L501-I505 HydrophobicContact CG-CD1 4.04Å; L501-I505 VanDerWaalsContact O-CG1 3.31Å; L501-I505 WeakPolarHBondContact O-CG1 3.25Å; L501-I505 PolarHBondContact O-N 2.85Å; V502-I505 PolarHBondContact O-N 2.82Å; A503-I505 PolarHBondContact O-N 3.44Å; I505-V508 PolarHBondContact O-N 2.89Å; I505-K509 HydrophobicContact CG2-CD 4.02Å; I505-K509 HydrophobicContact CG2-CG 4.44Å; I505-K509 WeakPolarHBondContact O-CB 3.46Å; I505-K509 PolarHBondContact O-N 3.43Å
506	L	86.6	Confident	84.9	Confident	18 Å²	18	52.6 Å²	52.6	9%	0.094	27%	0.272	C	S	.	.	H	α-helix	trans	-63.9	-42.2	177.4	-65.5	173.9	0	0	0	111.2	F332 V502 A503 V508 L510 I514 F519	F332-L506 HydrophobicContact CD1-CD1 4.34Å; F332-L506 HydrophobicContact CD1-CD2 4.27Å; F332-L506 HydrophobicContact CE1-CD2 3.93Å; F332-L506 HydrophobicContact CG-CD1 4.35Å; F332-L506 HydrophobicContact CZ-CD2 4.34Å; V502-L506 HydrophobicContact CG1-CD1 3.91Å; V502-L506 HydrophobicContact CG1-CG 4.26Å; V502-L506 VanDerWaalsContact O-CG 3.32Å; V502-L506 WeakPolarHBondContact O-CG 3.41Å; V502-L506 PolarHBondContact O-N 3.01Å; A503-L506 PolarHBondContact O-N 3.37Å; L506-V508 PolarHBondContact O-N 3.45Å; L506-L510 HydrophobicContact CB-CD1 4.48Å; L506-L510 HydrophobicContact CD2-CD1 3.43Å; L506-L510 VanDerWaalsContact CD2-CD1 3.43Å; L506-L510 WeakPolarHBondContact O-CA 3.22Å; L506-L510 WeakPolarHBondContact O-CB 3.37Å; L506-L510 PolarHBondContact O-N 3.02Å; L506-I514 HydrophobicContact CB-CD1 3.98Å; L506-I514 HydrophobicContact CD1-CD1 4.17Å; L506-F519 HydrophobicContact CD1-CD1 4.16Å; L506-F519 HydrophobicContact CD1-CE1 3.54Å; L506-F519 HydrophobicContact CD1-CZ 4.19Å
507	K	84.3	Confident	84.5	Confident	97 Å²	97	52.7 Å²	52.7	42%	0.422	27%	0.272	S	S	.	.	H	α-helix	trans	-62.2	-42.9	177.3	-169.4	173.1	-177.3	173.5	0	112.3	A503 N504 G511	A503-K507 WeakPolarHBondContact O-CB 3.22Å; A503-K507 PolarHBondContact O-N 2.94Å; N504-K507 PolarHBondContact O-N 3.42Å; K507-G511 WeakPolarHBondContact O-CA 3.28Å; K507-G511 PolarHBondContact O-N 3.41Å
508	V	82.8	Confident	84.3	Confident	118 Å²	118	52.7 Å²	52.7	72%	0.715	27%	0.273	S	S	*	.	H	α-helix	trans	-76.3	-43.2	-178.9	173.8	0	0	0	0	112.4	N504 I505 L506	N504-V508 WeakPolarHBondContact O-CB 3.38Å; N504-V508 VanDerWaalsContact O-CG2 3.3Å; N504-V508 WeakPolarHBondContact O-CG2 3.36Å; N504-V508 PolarHBondContact O-N 3.24Å; I505-V508 PolarHBondContact O-N 2.89Å; L506-V508 PolarHBondContact O-N 3.45Å
509	K	80.9	Confident	84.2	Confident	175 Å²	175	51.9 Å²	51.9	76%	0.761	27%	0.269	S	S	*	.	H	α-helix	trans	-85.3	-34.9	-174.5	-72.2	-171.1	176.4	-178.1	0	114.3	I505	I505-K509 HydrophobicContact CG2-CD 4.02Å; I505-K509 HydrophobicContact CG2-CG 4.44Å; I505-K509 WeakPolarHBondContact O-CB 3.46Å; I505-K509 PolarHBondContact O-N 3.43Å
510	L	78.4	Confident	84.1	Confident	103 Å²	103	51.9 Å²	51.9	54%	0.539	27%	0.269	S	S	.	.	H	α-helix	trans	-109.3	-8.8	-173.8	-66.6	155.3	0	0	0	113.1	F332 L506 L512	F332-L510 HydrophobicContact CZ-CD1 4.5Å; L506-L510 HydrophobicContact CB-CD1 4.48Å; L506-L510 HydrophobicContact CD2-CD1 3.43Å; L506-L510 VanDerWaalsContact CD2-CD1 3.43Å; L506-L510 WeakPolarHBondContact O-CA 3.22Å; L506-L510 WeakPolarHBondContact O-CB 3.37Å; L506-L510 PolarHBondContact O-N 3.02Å; L510-L512 HydrophobicContact CB-CD1 4.08Å; L510-L512 HydrophobicContact CB-CG 4Å; L510-L512 HydrophobicContact CD1-CD1 4.42Å; L510-L512 PolarHBondContact O-N 3.45Å; L510-L512 VanDerWaalsContact O-N 3.14Å
511	G	72.3	Confident	84.2	Confident	56 Å²	56	51.7 Å²	51.7	58%	0.577	27%	0.268	S	S	*	.			trans	63.8	16.5	178.7	0	0	0	0	0	114.5	K507	K507-G511 WeakPolarHBondContact O-CA 3.28Å; K507-G511 PolarHBondContact O-N 3.41Å
512	L	72.8	Confident	84.4	Confident	69 Å²	69	50.6 Å²	50.6	36%	0.361	26%	0.263	S	S	.	.			trans	-74.7	132	-178.6	-64.5	171.4	0	0	0	110.4	F332 L510 I514	F332-L512 HydrophobicContact CE2-CD1 4.48Å; L510-L512 HydrophobicContact CB-CD1 4.08Å; L510-L512 HydrophobicContact CB-CG 4Å; L510-L512 HydrophobicContact CD1-CD1 4.42Å; L510-L512 PolarHBondContact O-N 3.45Å; L510-L512 VanDerWaalsContact O-N 3.14Å; L512-I514 VanDerWaalsContact C-N 3.28Å; L512-I514 HydrophobicContact CB-CD1 3.68Å; L512-I514 HydrophobicContact CB-CG1 3.76Å; L512-I514 HydrophobicContact CD1-CD1 4.08Å; L512-I514 PolarHBondContact O-N 3.25Å
513	H	68.5	Low	84.5	Confident	201 Å²	201	49.1 Å²	49.1	93%	0.931	25%	0.253	S	S	*	.			trans	-74.5	82.7	171.6	-75.9	-79.8	0	0	0	109.8
514	I	77.4	Confident	84.8	Confident	22 Å²	22	49.1 Å²	49.1	11%	0.113	25%	0.253	C	S	.	.			trans	-105.4	140.5	-179	-66.7	169.5	0	0	0	109.9	L506 L512 S516 F519	L506-I514 HydrophobicContact CB-CD1 3.98Å; L506-I514 HydrophobicContact CD1-CD1 4.17Å; L512-I514 VanDerWaalsContact C-N 3.28Å; L512-I514 HydrophobicContact CB-CD1 3.68Å; L512-I514 HydrophobicContact CB-CG1 3.76Å; L512-I514 HydrophobicContact CD1-CD1 4.08Å; L512-I514 PolarHBondContact O-N 3.25Å; I514-S516 PolarHBondContact O-N 2.88Å; I514-F519 HydrophobicContact CB-CE2 4.39Å; I514-F519 HydrophobicContact CD1-CE2 4.4Å; I514-F519 HydrophobicContact CD1-CZ 4.18Å; I514-F519 HydrophobicContact CG1-CE2 4.5Å; I514-F519 HydrophobicContact CG2-CD2 3.25Å; I514-F519 HydrophobicContact CG2-CE2 3.1Å; I514-F519 HydrophobicContact CG2-CG 4.21Å; I514-F519 HydrophobicContact CG2-CZ 3.91Å
515	Y	79.8	Confident	85.2	Confident	81 Å²	81	48.6 Å²	48.6	32%	0.318	25%	0.251	S	S	.	.			trans	-75.5	106.5	168.5	-168.8	-105.6	0	0	0	110.2	F313 G517 T518	F313-Y515 HydrophobicContact CD1-CE1 4.39Å; Y515-G517 PolarHBondContact O-N 3.37Å; Y515-T518 WeakPolarHBondContact CD1-OG1 3.32Å; Y515-T518 PolarHBondContact O-N 2.92Å
516	S	83.8	Confident	85.7	Confident	8 Å²	8	45.4 Å²	45.4	6%	0.056	23%	0.234	C	C	.	.	H	α-helix	trans	-61.7	-25.9	-175.3	-61.3	0	0	0	0	113.6	R500 I514 A520	R500-S516 VanDerWaalsContact NH1-CB 3.34Å; I514-S516 PolarHBondContact O-N 2.88Å; S516-A520 PolarHBondContact O-N 2.92Å; S516-A520 VanDerWaalsContact O-N 3.14Å
517	G	85.9	Confident	86.1	Confident	1 Å²	1	44.6 Å²	44.6	1%	0.01	23%	0.23	C	C	.	.	H	α-helix	trans	-66.7	-39	176.8	0	0	0	0	0	113.9	F453 Y515 F519 A520 L521	F453-G517 WeakPolarHBondContact O-CA 3.35Å; Y515-G517 PolarHBondContact O-N 3.37Å; G517-F519 VanDerWaalsContact C-N 3.35Å; G517-F519 PolarHBondContact O-N 2.79Å; G517-A520 WeakPolarHBondContact O-CB 3.4Å; G517-A520 PolarHBondContact O-N 3.48Å; G517-L521 PolarHBondContact O-N 3.22Å
518	T	89.1	Confident	86.6	Confident	1 Å²	1	40 Å²	40	1%	0.006	21%	0.21	C	C	.	.	H	α-helix	trans	-63.6	-44.2	178.8	-60.6	0	0	0	0	110.3	L324 F333 Y515 A520 L521 I522 Y551	L324-T518 PolarHBondContact O-OG1 3.16Å; F333-T518 HydrophobicContact CE1-CG2 4.41Å; F333-T518 HydrophobicContact CZ-CG2 3.8Å; Y515-T518 WeakPolarHBondContact CD1-OG1 3.32Å; Y515-T518 PolarHBondContact O-N 2.92Å; T518-A520 VanDerWaalsContact C-N 3.33Å; T518-A520 PolarHBondContact O-N 2.96Å; T518-L521 PolarHBondContact O-N 3.44Å; T518-I522 HydrophobicContact CG2-CG1 4.42Å; T518-I522 WeakPolarHBondContact O-CG1 3.39Å; T518-I522 PolarHBondContact O-N 3.42Å; T518-Y551 HydrophobicContact CG2-CD1 4.35Å; T518-Y551 HydrophobicContact CG2-CE1 3.53Å; T518-Y551 PolarHBondContact OG1-OH 3.12Å
519	F	91.9	Very high	87.2	Confident	2 Å²	2	34.4 Å²	34.4	1%	0.009	18%	0.176	C	C	.	.	H	α-helix	trans	-66.4	-35.5	177.2	-81.6	-107.4	0	0	0	111.8	D329 F332 F333 M336 G499 V502 A503 L506 I514 G517 G523	D329-F519 HydrophobicContact CB-CE2 4.46Å; D329-F519 HydrophobicContact CB-CZ 4.29Å; F332-F519 HydrophobicContact CB-CE1 4Å; F332-F519 HydrophobicContact CB-CZ 4.37Å; F333-F519 HydrophobicContact CD1-CE1 4.36Å; F333-F519 HydrophobicContact CD1-CZ 4.41Å; F333-F519 HydrophobicContact CE1-CD1 4.24Å; F333-F519 HydrophobicContact CE1-CD2 4Å; F333-F519 AromaticContact CE1-CE1 4Å; F333-F519 HydrophobicContact CE1-CE1 4Å; F333-F519 AromaticContact CE1-CE2 3.7Å; F333-F519 HydrophobicContact CE1-CE2 3.7Å; F333-F519 HydrophobicContact CE1-CG 4.25Å; F333-F519 AromaticContact CE1-CZ 3.73Å; F333-F519 HydrophobicContact CE1-CZ 3.73Å; F333-F519 HydrophobicContact CZ-CE2 4.18Å; F333-F519 HydrophobicContact CZ-CZ 4.47Å; M336-F519 WeakPolarHBondContact CE-O 3.47Å; M336-F519 HydrophobicContact SD-CD1 3.7Å; M336-F519 HydrophobicContact SD-CE1 4.25Å; G499-F519 VanDerWaalsContact CA-O 3.25Å; G499-F519 WeakPolarHBondContact CA-O 3.28Å; V502-F519 HydrophobicContact CG1-CD1 4.42Å; A503-F519 HydrophobicContact CB-CB 3.66Å; A503-F519 HydrophobicContact CB-CG 4.12Å; L506-F519 HydrophobicContact CD1-CD1 4.16Å; L506-F519 HydrophobicContact CD1-CE1 3.54Å; L506-F519 HydrophobicContact CD1-CZ 4.19Å; I514-F519 HydrophobicContact CB-CE2 4.39Å; I514-F519 HydrophobicContact CD1-CE2 4.4Å; I514-F519 HydrophobicContact CD1-CZ 4.18Å; I514-F519 HydrophobicContact CG1-CE2 4.5Å; I514-F519 HydrophobicContact CG2-CD2 3.25Å; I514-F519 HydrophobicContact CG2-CE2 3.1Å; I514-F519 HydrophobicContact CG2-CG 4.21Å; I514-F519 HydrophobicContact CG2-CZ 3.91Å; G517-F519 VanDerWaalsContact C-N 3.35Å; G517-F519 PolarHBondContact O-N 2.79Å; F519-G523 PolarHBondContact O-N 3.23Å
520	A	92.6	Very high	87.9	Confident	0 Å²	0	26.1 Å²	26.1	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-62.5	-44.8	172	0	0	0	0	0	111.7	F453 A496 R500 S516 G517 T518 G523 A524	F453-A520 HydrophobicContact CD1-CB 3.8Å; F453-A520 HydrophobicContact CE1-CB 4.08Å; A496-A520 WeakPolarHBondContact CA-O 3.21Å; R500-A520 HydrophobicContact CB-CB 4.21Å; S516-A520 PolarHBondContact O-N 2.92Å; S516-A520 VanDerWaalsContact O-N 3.14Å; G517-A520 WeakPolarHBondContact O-CB 3.4Å; G517-A520 PolarHBondContact O-N 3.48Å; T518-A520 VanDerWaalsContact C-N 3.33Å; T518-A520 PolarHBondContact O-N 2.96Å; A520-G523 PolarHBondContact O-N 2.92Å; A520-A524 WeakPolarHBondContact O-CB 3.42Å; A520-A524 PolarHBondContact O-N 2.93Å
521	L	93.1	Very high	88.7	Confident	1 Å²	1	21.2 Å²	21.2	1%	0.005	12%	0.115	C	C	.	.	H	α-helix	trans	-61.8	-46.4	176.5	178.9	66	0	0	0	112.1	F313 F453 G517 T518 G523 A524 A525 T546 Y551 I555	F313-L521 HydrophobicContact CE1-CB 4.43Å; F313-L521 HydrophobicContact CE1-CD2 4.37Å; F313-L521 HydrophobicContact CE2-CD2 4.46Å; F313-L521 HydrophobicContact CZ-CB 4.38Å; F313-L521 HydrophobicContact CZ-CD1 4.49Å; F313-L521 HydrophobicContact CZ-CD2 4.21Å; F453-L521 HydrophobicContact CE1-CB 4.37Å; F453-L521 HydrophobicContact CE2-CD1 4.21Å; F453-L521 HydrophobicContact CZ-CD1 4.03Å; G517-L521 PolarHBondContact O-N 3.22Å; T518-L521 PolarHBondContact O-N 3.44Å; L521-G523 VanDerWaalsContact C-N 3.33Å; L521-G523 PolarHBondContact O-N 2.89Å; L521-A524 WeakPolarHBondContact O-CB 3.29Å; L521-A524 PolarHBondContact O-N 3.43Å; L521-A525 PolarHBondContact O-N 3.2Å; L521-T546 HydrophobicContact CD1-CG2 3.87Å; L521-T546 HydrophobicContact CD2-CG2 3.77Å; L521-T546 HydrophobicContact CG-CG2 4.49Å; L521-Y551 HydrophobicContact CD2-CD2 4.18Å; L521-Y551 HydrophobicContact CD2-CE2 4.24Å; L521-Y551 HydrophobicContact CD2-CG 4.42Å; L521-I555 HydrophobicContact CD2-CD1 4.38Å
522	I	94.9	Very high	89.7	Confident	0 Å²	0	18.8 Å²	18.8	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-66.1	-36.2	177.9	-63.5	-63	0	0	0	111.4	F333 M336 T518 A525 A526 P554 I555 T558	F333-I522 HydrophobicContact CB-CG2 4.15Å; F333-I522 HydrophobicContact CD1-CB 4.2Å; F333-I522 HydrophobicContact CD1-CG1 4.07Å; F333-I522 HydrophobicContact CD1-CG2 3.81Å; F333-I522 HydrophobicContact CE1-CB 4.38Å; F333-I522 HydrophobicContact CE1-CG1 3.97Å; F333-I522 HydrophobicContact CE1-CG2 4.47Å; F333-I522 HydrophobicContact CE2-CG1 4.44Å; F333-I522 HydrophobicContact CG-CG1 4.37Å; F333-I522 HydrophobicContact CG-CG2 4.05Å; F333-I522 HydrophobicContact CZ-CG1 4.17Å; M336-I522 HydrophobicContact CE-CB 4.2Å; M336-I522 HydrophobicContact CE-CG2 3.98Å; T518-I522 HydrophobicContact CG2-CG1 4.42Å; T518-I522 WeakPolarHBondContact O-CG1 3.39Å; T518-I522 PolarHBondContact O-N 3.42Å; I522-A525 PolarHBondContact O-N 2.91Å; I522-A526 VanDerWaalsContact O-CB 3.31Å; I522-A526 WeakPolarHBondContact O-CB 3.4Å; I522-A526 PolarHBondContact O-N 3.03Å; I522-P554 HydrophobicContact CD1-CB 3.83Å; I522-I555 HydrophobicContact CD1-CG1 3.74Å; I522-T558 HydrophobicContact CG2-CG2 3.39Å
523	G	95.8	Very high	90.7	Very high	0 Å²	0	16.2 Å²	16.2	0%	0	7%	0.074	C	C	.	.	H	α-helix	trans	-64.7	-41.3	173.2	0	0	0	0	0	112.5	M336 G495 F519 A520 L521 A526 F527	M336-G523 VanDerWaalsContact CE-CA 3.42Å; M336-G523 VanDerWaalsContact CE-N 3.28Å; G495-G523 CarbonylContact C-O 3.55Å; G495-G523 VanDerWaalsContact CA-O 3.3Å; G495-G523 WeakPolarHBondContact CA-O 3.31Å; G495-G523 CarbonylContact O-C 3.21Å; G495-G523 WeakPolarHBondContact O-CA 3.35Å; F519-G523 PolarHBondContact O-N 3.23Å; A520-G523 PolarHBondContact O-N 2.92Å; L521-G523 VanDerWaalsContact C-N 3.33Å; L521-G523 PolarHBondContact O-N 2.89Å; G523-A526 PolarHBondContact O-N 3.5Å; G523-F527 PolarHBondContact O-N 3.38Å
524	A	95.3	Very high	91.7	Very high	0 Å²	0	6.9 Å²	6.9	0%	0	3%	0.031	C	C	.	.	H	α-helix	trans	-60.3	-46	174	0	0	0	0	0	111.2	F453 L492 G495 A496 A520 L521 L528	F453-A524 HydrophobicContact CE1-CB 4.4Å; F453-A524 HydrophobicContact CZ-CB 4.22Å; L492-A524 HydrophobicContact CD2-CB 3.93Å; L492-A524 WeakPolarHBondContact O-CB 3.3Å; G495-A524 VanDerWaalsContact C-N 3.28Å; G495-A524 PolarHBondContact O-N 3.33Å; A496-A524 HydrophobicContact CB-CB 4.18Å; A520-A524 WeakPolarHBondContact O-CB 3.42Å; A520-A524 PolarHBondContact O-N 2.93Å; L521-A524 WeakPolarHBondContact O-CB 3.29Å; L521-A524 PolarHBondContact O-N 3.43Å; A524-L528 WeakPolarHBondContact O-CB 3.4Å; A524-L528 PolarHBondContact O-N 3.34Å
525	A	95.8	Very high	92.2	Very high	0 Å²	0	6.8 Å²	6.8	0%	0	3%	0.032	C	C	.	.	H	α-helix	trans	-61.4	-50.3	175.4	0	0	0	0	0	111.7	L521 I522 F527 L528 G529 L542 I555 L559	L521-A525 PolarHBondContact O-N 3.2Å; I522-A525 PolarHBondContact O-N 2.91Å; A525-F527 PolarHBondContact O-N 3.34Å; A525-L528 PolarHBondContact O-N 3.25Å; A525-G529 PolarHBondContact O-N 3.45Å; A525-L542 HydrophobicContact CB-CD1 3.58Å; A525-I555 HydrophobicContact CB-CG2 4.37Å; A525-L559 HydrophobicContact CB-CD2 4.27Å; A525-L559 HydrophobicContact CB-CG 4.41Å; A525-L559 WeakPolarHBondContact O-CD2 3.38Å
526	A	96.9	Very high	92.8	Very high	0 Å²	0	8 Å²	8	0%	0	4%	0.042	C	C	.	.	H	α-helix	trans	-60.1	-45.8	-177.3	0	0	0	0	0	112.7	I522 G523 G530 A562	I522-A526 VanDerWaalsContact O-CB 3.31Å; I522-A526 WeakPolarHBondContact O-CB 3.4Å; I522-A526 PolarHBondContact O-N 3.03Å; G523-A526 PolarHBondContact O-N 3.5Å; A526-G530 PolarHBondContact O-N 3.06Å; A526-A562 WeakPolarHBondContact O-CB 3.46Å
527	F	96.4	Very high	93.2	Very high	1 Å²	1	7.6 Å²	7.6	0%	0.004	4%	0.04	C	C	.	.	H	α-helix	trans	-70.5	-43.9	178.7	-173.9	-99.5	0	0	0	112.1	L343 F347 F472 S491 C494 G523 A525 G529 G530 V531	L343-F527 HydrophobicContact CB-CD2 3.89Å; L343-F527 HydrophobicContact CB-CE2 3.85Å; F347-F527 HydrophobicContact CB-CZ 4.33Å; F347-F527 HydrophobicContact CD2-CZ 4.13Å; F347-F527 HydrophobicContact CG-CZ 4.34Å; F472-F527 HydrophobicContact CD2-CE2 4.01Å; F472-F527 AromaticContact CD2-CZ 3.82Å; F472-F527 HydrophobicContact CD2-CZ 3.82Å; F472-F527 AromaticContact CE2-CE2 3.78Å; F472-F527 HydrophobicContact CE2-CE2 3.78Å; F472-F527 AromaticContact CE2-CZ 3.79Å; F472-F527 HydrophobicContact CE2-CZ 3.79Å; S491-F527 VanDerWaalsContact O-CD1 3.23Å; S491-F527 WeakPolarHBondContact O-CD1 3.23Å; C494-F527 HydrophobicContact CB-CD1 4.09Å; C494-F527 HydrophobicContact CB-CE1 3.85Å; C494-F527 HydrophobicContact CB-CZ 4.43Å; G523-F527 PolarHBondContact O-N 3.38Å; A525-F527 PolarHBondContact O-N 3.34Å; F527-G529 PolarHBondContact O-N 3.48Å; F527-G530 PolarHBondContact O-N 3.32Å; F527-G530 VanDerWaalsContact O-N 3.17Å; F527-V531 HydrophobicContact CD1-CG2 4.15Å; F527-V531 HydrophobicContact CE1-CG2 3.71Å; F527-V531 HydrophobicContact CE2-CG2 4.22Å; F527-V531 HydrophobicContact CZ-CG2 3.75Å; F527-V531 WeakPolarHBondContact O-CG2 3.38Å; F527-V531 PolarHBondContact O-N 3.01Å
528	L	95.1	Very high	93.5	Very high	1 Å²	1	7.8 Å²	7.8	1%	0.005	4%	0.04	C	C	.	.	H	α-helix	trans	-62	-44.2	177.7	179.2	66	0	0	0	111.6	F488 L492 A524 A525 G530 V531 V532 L538	F488-L528 HydrophobicContact CD1-CD1 3.94Å; F488-L528 HydrophobicContact CD1-CD2 4.03Å; F488-L528 HydrophobicContact CE1-CD1 4.39Å; F488-L528 HydrophobicContact CE1-CD2 4.39Å; L492-L528 HydrophobicContact CD2-CB 4.36Å; L492-L528 HydrophobicContact CD2-CD2 3.6Å; L492-L528 HydrophobicContact CG-CD2 3.9Å; A524-L528 WeakPolarHBondContact O-CB 3.4Å; A524-L528 PolarHBondContact O-N 3.34Å; A525-L528 PolarHBondContact O-N 3.25Å; L528-G530 VanDerWaalsContact C-N 3.31Å; L528-G530 PolarHBondContact O-N 3.49Å; L528-V531 PolarHBondContact O-N 2.58Å; L528-V532 HydrophobicContact CD1-CG2 3.8Å; L528-V532 WeakPolarHBondContact O-CB 3.37Å; L528-V532 PolarHBondContact O-N 2.93Å; L528-L538 HydrophobicContact CB-CD2 4.43Å; L528-L538 HydrophobicContact CD2-CD1 3.46Å; L528-L538 VanDerWaalsContact CD2-CD1 3.46Å; L528-L538 HydrophobicContact CD2-CD2 3.83Å; L528-L538 HydrophobicContact CD2-CG 4.28Å; L528-L538 HydrophobicContact CG-CD1 4.36Å; L528-L538 HydrophobicContact CG-CD2 3.85Å
529	G	94.6	Very high	93.8	Very high	1 Å²	1	8.3 Å²	8.3	1%	0.01	4%	0.044	C	C	.	.	H	α-helix	trans	-62.6	-36.4	173.4	0	0	0	0	0	112.7	A525 F527 R533	A525-G529 PolarHBondContact O-N 3.45Å; F527-G529 PolarHBondContact O-N 3.48Å; G529-R533 VanDerWaalsContact O-CA 3.22Å; G529-R533 WeakPolarHBondContact O-CA 3.5Å; G529-R533 PolarHBondContact O-N 2.97Å
530	G	95.6	Very high	93.9	Very high	0 Å²	0	9.8 Å²	9.8	0%	0	5%	0.053	C	C	.	.	H	α-helix	trans	-66	-38.9	174.6	0	0	0	0	0	114.1	A526 F527 L528 R533	A526-G530 PolarHBondContact O-N 3.06Å; F527-G530 PolarHBondContact O-N 3.32Å; F527-G530 VanDerWaalsContact O-N 3.17Å; L528-G530 VanDerWaalsContact C-N 3.31Å; L528-G530 PolarHBondContact O-N 3.49Å; G530-R533 PolarHBondContact O-NH1 3.4Å; G530-R533 VanDerWaalsContact O-NH1 3.15Å; G530-R533 PolarHBondContact O-NH2 3Å; G530-R533 VanDerWaalsContact O-NH2 3.15Å
531	V	95.6	Very high	93.9	Very high	0 Å²	0	10 Å²	10	0%	0	5%	0.054	C	C	.	.	H	α-helix	trans	-77.9	-48.2	179.5	171.4	0	0	0	0	111.4	F347 N348 L487 F527 L528 I573	F347-V531 HydrophobicContact CB-CG2 4.17Å; F347-V531 HydrophobicContact CD1-CG1 3.98Å; F347-V531 HydrophobicContact CD1-CG2 4.05Å; F347-V531 HydrophobicContact CE1-CG1 4.24Å; F347-V531 HydrophobicContact CG-CG2 4.18Å; N348-V531 PolarHBondContact ND2-O 2.89Å; N348-V531 PolarHBondContact OD1-O 3.38Å; L487-V531 HydrophobicContact CD2-CG1 3.69Å; F527-V531 HydrophobicContact CD1-CG2 4.15Å; F527-V531 HydrophobicContact CE1-CG2 3.71Å; F527-V531 HydrophobicContact CE2-CG2 4.22Å; F527-V531 HydrophobicContact CZ-CG2 3.75Å; F527-V531 WeakPolarHBondContact O-CG2 3.38Å; F527-V531 PolarHBondContact O-N 3.01Å; L528-V531 PolarHBondContact O-N 2.58Å; V531-I573 HydrophobicContact CG1-CB 4.19Å; V531-I573 HydrophobicContact CG1-CG2 3.97Å; V531-I573 PolarHBondContact O-N 3.28Å; V531-I573 VanDerWaalsContact O-N 3.1Å
532	V	92.9	Very high	93.9	Very high	6 Å²	6	10 Å²	10	4%	0.036	5%	0.054	C	C	.	.	H	α-helix	trans	-92.8	-27.2	-168.7	-179.4	0	0	0	0	113.3	L528 M534 I573 Y574	L528-V532 HydrophobicContact CD1-CG2 3.8Å; L528-V532 WeakPolarHBondContact O-CB 3.37Å; L528-V532 PolarHBondContact O-N 2.93Å; V532-M534 VanDerWaalsContact C-N 3.29Å; V532-M534 HydrophobicContact CG1-CB 4.23Å; V532-M534 HydrophobicContact CG1-CE 3.41Å; V532-M534 VanDerWaalsContact CG1-CE 3.41Å; V532-M534 HydrophobicContact CG1-CG 3.7Å; V532-M534 HydrophobicContact CG1-SD 3.42Å; V532-M534 WeakPolarHBondContact CG1-SD 3.41Å; V532-M534 PolarHBondContact O-N 3.48Å; V532-I573 HydrophobicContact CG2-CG2 4.43Å; V532-Y574 HydrophobicContact CG1-CD2 3.89Å; V532-Y574 HydrophobicContact CG1-CE2 3.51Å; V532-Y574 HydrophobicContact CG2-CE2 4.36Å
533	R	93.3	Very high	93.7	Very high	15 Å²	15	11.5 Å²	11.5	6%	0.057	6%	0.061	C	C	.	.			trans	66.6	15.4	-176.5	-52.2	-67.4	-171.7	-140.3	-24.5	116.4	G529 G530 A562 K563 G566 D567 N570 G572	G529-R533 VanDerWaalsContact O-CA 3.22Å; G529-R533 WeakPolarHBondContact O-CA 3.5Å; G529-R533 PolarHBondContact O-N 2.97Å; G530-R533 PolarHBondContact O-NH1 3.4Å; G530-R533 VanDerWaalsContact O-NH1 3.15Å; G530-R533 PolarHBondContact O-NH2 3Å; G530-R533 VanDerWaalsContact O-NH2 3.15Å; R533-A562 PolarHBondContact NH1-O 2.89Å; R533-K563 PolarHBondContact NH1-O 2.99Å; R533-G566 PolarHBondContact NH2-O 3.33Å; R533-D567 WeakPolarHBondContact CD-OD1 3.29Å; R533-D567 IonicContact NE-OD1 2.69Å; R533-D567 PolarHBondContact NE-OD1 3.48Å; R533-N570 PolarHBondContact NH2-O 3.5Å; R533-G572 VanDerWaalsContact CG-CA 3.48Å
534	M	89.4	Confident	93.5	Very high	4 Å²	4	13.8 Å²	13.8	2%	0.02	7%	0.072	C	C	.	.			trans	-80.6	140.7	172.6	-73.8	165.9	-163.9	0	0	111.2	F259 E263 F488 V532 L538 Y574	F259-M534 HydrophobicContact CD2-CE 4.35Å; F259-M534 HydrophobicContact CD2-SD 3.97Å; F259-M534 HydrophobicContact CE2-CE 3.56Å; F259-M534 HydrophobicContact CE2-SD 3.69Å; F259-M534 HydrophobicContact CZ-CE 4.4Å; E263-M534 HydrophobicContact CG-CE 3.73Å; E263-M534 HydrophobicContact CG-CG 4.44Å; E263-M534 HydrophobicContact CG-SD 4.43Å; E263-M534 WeakPolarHBondContact OE1-CG 3.3Å; F488-M534 HydrophobicContact CZ-SD 4.1Å; V532-M534 VanDerWaalsContact C-N 3.29Å; V532-M534 HydrophobicContact CG1-CB 4.23Å; V532-M534 HydrophobicContact CG1-CE 3.41Å; V532-M534 VanDerWaalsContact CG1-CE 3.41Å; V532-M534 HydrophobicContact CG1-CG 3.7Å; V532-M534 HydrophobicContact CG1-SD 3.42Å; V532-M534 WeakPolarHBondContact CG1-SD 3.41Å; V532-M534 PolarHBondContact O-N 3.48Å; M534-L538 HydrophobicContact CB-CB 4.02Å; M534-Y574 HydrophobicContact CE-CD2 3.7Å; M534-Y574 HydrophobicContact CE-CE2 3.61Å
535	T	89.1	Confident	93.1	Very high	21 Å²	21	14.1 Å²	14.1	13%	0.129	8%	0.075	C	C	.	.			trans	-120.7	-74.2	-173.9	51.4	0	0	0	0	113.3	E262 L538 T539 K563	E262-T535 PolarHBondContact OE1-N 3.34Å; E262-T535 VanDerWaalsContact OE1-N 3.08Å; E262-T535 PolarHBondContact OE1-OG1 2.9Å; T535-L538 PolarHBondContact O-N 2.97Å; T535-T539 WeakPolarHBondContact O-CB 3.38Å; T535-T539 PolarHBondContact O-N 3.47Å; T535-T539 PolarHBondContact O-OG1 2.91Å; T535-K563 HydrophobicContact CG2-CB 4.16Å; T535-K563 HydrophobicContact CG2-CD 3.4Å; T535-K563 VanDerWaalsContact CG2-CD 3.4Å; T535-K563 HydrophobicContact CG2-CG 4.36Å
536	I	91.6	Very high	92.7	Very high	106 Å²	106	14.1 Å²	14.1	54%	0.544	8%	0.075	S	C	.	.	H	α-helix	trans	-68.6	-50.7	-170.1	-62.1	172.6	0	0	0	110	L258 L538 T539 V540	L258-I536 HydrophobicContact CD1-CG2 4.36Å; I536-L538 VanDerWaalsContact C-N 3.34Å; I536-L538 PolarHBondContact O-N 3.41Å; I536-T539 PolarHBondContact O-N 2.82Å; I536-V540 PolarHBondContact O-N 3.34Å; I536-V540 VanDerWaalsContact O-N 3.16Å
537	S	92.3	Very high	92.1	Very high	0 Å²	0	19 Å²	19	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-59.6	-45.2	177.5	56	0	0	0	0	111.7	E262 T539 V540 I541	E262-S537 WeakPolarHBondContact OE2-CB 3.42Å; E262-S537 PolarHBondContact OE2-N 2.79Å; E262-S537 PolarHBondContact OE2-OG 3.5Å; S537-T539 PolarHBondContact O-N 3.26Å; S537-V540 PolarHBondContact O-N 3.42Å; S537-I541 WeakPolarHBondContact O-CG1 3.23Å; S537-I541 PolarHBondContact O-N 2.94Å
538	L	92.9	Very high	91.5	Very high	4 Å²	4	21.2 Å²	21.2	2%	0.021	11%	0.111	C	C	.	.	H	α-helix	trans	-65.5	-39	-179.4	-178.1	57.7	0	0	0	112.6	L528 M534 T535 I536 V540 I541 L542 L559	L528-L538 HydrophobicContact CB-CD2 4.43Å; L528-L538 HydrophobicContact CD2-CD1 3.46Å; L528-L538 VanDerWaalsContact CD2-CD1 3.46Å; L528-L538 HydrophobicContact CD2-CD2 3.83Å; L528-L538 HydrophobicContact CD2-CG 4.28Å; L528-L538 HydrophobicContact CG-CD1 4.36Å; L528-L538 HydrophobicContact CG-CD2 3.85Å; M534-L538 HydrophobicContact CB-CB 4.02Å; T535-L538 PolarHBondContact O-N 2.97Å; I536-L538 VanDerWaalsContact C-N 3.34Å; I536-L538 PolarHBondContact O-N 3.41Å; L538-V540 VanDerWaalsContact C-N 3.34Å; L538-V540 PolarHBondContact O-N 3.47Å; L538-I541 PolarHBondContact O-N 3.5Å; L538-L542 HydrophobicContact CD1-CD1 4.3Å; L538-L542 HydrophobicContact CD1-CG 4.18Å; L538-L542 HydrophobicContact CG-CD1 4.26Å; L538-L542 WeakPolarHBondContact O-CG 3.38Å; L538-L542 PolarHBondContact O-N 2.93Å; L538-L559 HydrophobicContact CB-CD1 4.36Å; L538-L559 HydrophobicContact CD2-CD1 4.31Å; L538-L559 HydrophobicContact CD2-CD2 3.7Å; L538-L559 HydrophobicContact CG-CD1 4.13Å; L538-L559 HydrophobicContact CG-CD2 4.38Å
539	T	94.1	Very high	91.1	Very high	12 Å²	12	27.9 Å²	27.9	7%	0.074	15%	0.145	C	C	.	.	H	α-helix	trans	-58.6	-48.4	174.8	-57.5	0	0	0	0	110.5	T535 I536 S537 L542 I543 I555 M556 L559	T535-T539 WeakPolarHBondContact O-CB 3.38Å; T535-T539 PolarHBondContact O-N 3.47Å; T535-T539 PolarHBondContact O-OG1 2.91Å; I536-T539 PolarHBondContact O-N 2.82Å; S537-T539 PolarHBondContact O-N 3.26Å; T539-L542 PolarHBondContact O-N 3.34Å; T539-I543 HydrophobicContact CG2-CD1 3.83Å; T539-I543 VanDerWaalsContact O-CG1 3.26Å; T539-I543 WeakPolarHBondContact O-CG1 3.32Å; T539-I543 PolarHBondContact O-N 3.26Å; T539-I555 HydrophobicContact CG2-CG2 4.1Å; T539-M556 HydrophobicContact CG2-CB 4.07Å; T539-L559 VanDerWaalsContact OG1-CD1 3.26Å; T539-L559 WeakPolarHBondContact OG1-CD1 3.33Å
540	V	94.3	Very high	90.8	Very high	33 Å²	33	31.4 Å²	31.4	20%	0.2	17%	0.167	C	C	.	.	H	α-helix	trans	-67.7	-39.5	-179.7	177.1	0	0	0	0	111.6	I254 L258 I536 S537 L538 L542 I543 E544	I254-V540 HydrophobicContact CB-CG1 4.08Å; I254-V540 HydrophobicContact CG2-CG1 3.95Å; L258-V540 HydrophobicContact CD1-CB 3.98Å; L258-V540 HydrophobicContact CD1-CG1 4.14Å; L258-V540 HydrophobicContact CD1-CG2 3.61Å; I536-V540 PolarHBondContact O-N 3.34Å; I536-V540 VanDerWaalsContact O-N 3.16Å; S537-V540 PolarHBondContact O-N 3.42Å; L538-V540 VanDerWaalsContact C-N 3.34Å; L538-V540 PolarHBondContact O-N 3.47Å; V540-L542 VanDerWaalsContact C-N 3.33Å; V540-L542 PolarHBondContact O-N 2.92Å; V540-I543 PolarHBondContact O-N 3.21Å; V540-E544 HydrophobicContact CG1-CG 4.2Å; V540-E544 WeakPolarHBondContact O-CB 3.49Å; V540-E544 WeakPolarHBondContact O-CG 3.25Å; V540-E544 PolarHBondContact O-N 3.43Å
541	I	93.2	Very high	90.4	Very high	4 Å²	4	31.4 Å²	31.4	2%	0.021	17%	0.167	C	C	.	.	H	α-helix	trans	-56.5	-49.1	174.3	-70.2	165.3	0	0	0	110.4	V246 F250 A252 S537 L538 I543 E544 S545	V246-I541 HydrophobicContact CG1-CD1 3.86Å; V246-I541 HydrophobicContact CG1-CG1 4.45Å; F250-I541 HydrophobicContact CB-CG2 3.67Å; F250-I541 HydrophobicContact CD1-CG2 4.07Å; F250-I541 HydrophobicContact CD2-CG2 4.14Å; F250-I541 HydrophobicContact CG-CG2 3.69Å; A252-I541 HydrophobicContact CB-CB 4.32Å; A252-I541 HydrophobicContact CB-CG1 4.18Å; A252-I541 HydrophobicContact CB-CG2 4.25Å; S537-I541 WeakPolarHBondContact O-CG1 3.23Å; S537-I541 PolarHBondContact O-N 2.94Å; L538-I541 PolarHBondContact O-N 3.5Å; I541-I543 PolarHBondContact O-N 3.14Å; I541-E544 PolarHBondContact O-N 2.8Å; I541-S545 WeakPolarHBondContact O-CB 3.2Å; I541-S545 PolarHBondContact O-N 3.25Å; I541-S545 PolarHBondContact O-OG 3.09Å
542	L	92	Very high	90.2	Very high	3 Å²	3	32 Å²	32	2%	0.016	17%	0.173	C	C	.	.	H	α-helix	trans	-66.4	-36.7	-179.5	-67.5	174.6	0	0	0	112.5	F310 L492 A525 L538 T539 V540 T546 I555	F310-L542 HydrophobicContact CE2-CD2 3.84Å; F310-L542 HydrophobicContact CZ-CD2 4.33Å; L492-L542 HydrophobicContact CD2-CD2 4.32Å; A525-L542 HydrophobicContact CB-CD1 3.58Å; L538-L542 HydrophobicContact CD1-CD1 4.3Å; L538-L542 HydrophobicContact CD1-CG 4.18Å; L538-L542 HydrophobicContact CG-CD1 4.26Å; L538-L542 WeakPolarHBondContact O-CG 3.38Å; L538-L542 PolarHBondContact O-N 2.93Å; T539-L542 PolarHBondContact O-N 3.34Å; V540-L542 VanDerWaalsContact C-N 3.33Å; V540-L542 PolarHBondContact O-N 2.92Å; L542-T546 WeakPolarHBondContact O-CB 3.29Å; L542-T546 WeakPolarHBondContact O-CG2 3.43Å; L542-T546 PolarHBondContact O-N 3.43Å; L542-T546 VanDerWaalsContact O-N 3.12Å; L542-T546 PolarHBondContact O-OG1 3.36Å; L542-I555 HydrophobicContact CB-CD1 4.13Å; L542-I555 HydrophobicContact CB-CG2 4.39Å; L542-I555 HydrophobicContact CD1-CG2 3.89Å
543	I	91.5	Very high	90.1	Very high	30 Å²	30	35.6 Å²	35.6	15%	0.154	19%	0.191	C	C	.	.	H	α-helix	trans	-66	-48	175.4	-66.7	164.1	0	0	0	111.1	T539 V540 I541 S545 T546 N547 I549	T539-I543 HydrophobicContact CG2-CD1 3.83Å; T539-I543 VanDerWaalsContact O-CG1 3.26Å; T539-I543 WeakPolarHBondContact O-CG1 3.32Å; T539-I543 PolarHBondContact O-N 3.26Å; V540-I543 PolarHBondContact O-N 3.21Å; I541-I543 PolarHBondContact O-N 3.14Å; I543-S545 PolarHBondContact O-N 3.18Å; I543-T546 PolarHBondContact O-N 3.25Å; I543-T546 PolarHBondContact O-OG1 2.7Å; I543-N547 PolarHBondContact O-N 3.47Å; I543-N547 VanDerWaalsContact O-N 3.09Å; I543-I549 HydrophobicContact CG2-CG1 4.2Å
544	E	91.1	Very high	90.1	Very high	48 Å²	48	34.9 Å²	34.9	22%	0.224	19%	0.189	C	C	.	.	H	α-helix	trans	-64.1	-40.5	-179.7	-73.7	-169.3	130.1	0	0	111.5	A252 I254 G255 V540 I541 T546 N547	A252-E544 WeakPolarHBondContact CA-OE2 3.04Å; A252-E544 HydrophobicContact CB-CB 3.78Å; A252-E544 HydrophobicContact CB-CG 4.49Å; A252-E544 WeakPolarHBondContact CB-OE2 3.33Å; I254-E544 WeakPolarHBondContact CB-OE1 3.39Å; I254-E544 WeakPolarHBondContact CD1-OE1 3.37Å; I254-E544 WeakPolarHBondContact CG1-OE1 3.42Å; I254-E544 PolarHBondContact N-OE1 3.37Å; I254-E544 PolarHBondContact N-OE2 3.18Å; I254-E544 VanDerWaalsContact N-OE2 3.09Å; G255-E544 PolarHBondContact N-OE2 3.38Å; V540-E544 HydrophobicContact CG1-CG 4.2Å; V540-E544 WeakPolarHBondContact O-CB 3.49Å; V540-E544 WeakPolarHBondContact O-CG 3.25Å; V540-E544 PolarHBondContact O-N 3.43Å; I541-E544 PolarHBondContact O-N 2.8Å; E544-T546 VanDerWaalsContact C-N 3.34Å; E544-T546 PolarHBondContact O-N 3.4Å; E544-N547 PolarHBondContact O-N 3.08Å
545	S	87.6	Confident	90.3	Very high	8 Å²	8	34.7 Å²	34.7	6%	0.056	19%	0.188	C	C	.	.	H	α-helix	trans	-73.9	-21.1	179.5	-57.9	0	0	0	0	114	F250 I541 I543	F250-S545 PolarHBondContact O-OG 3.48Å; I541-S545 WeakPolarHBondContact O-CB 3.2Å; I541-S545 PolarHBondContact O-N 3.25Å; I541-S545 PolarHBondContact O-OG 3.09Å; I543-S545 PolarHBondContact O-N 3.18Å
546	T	86.6	Confident	90.6	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-94.3	-10.5	176.8	54.8	0	0	0	0	113.4	F310 F313 L521 L542 I543 E544 E548	F310-T546 HydrophobicContact CB-CG2 4.34Å; F310-T546 HydrophobicContact CD2-CG2 4.16Å; F313-T546 HydrophobicContact CD2-CG2 3.89Å; F313-T546 HydrophobicContact CE2-CG2 3.66Å; L521-T546 HydrophobicContact CD1-CG2 3.87Å; L521-T546 HydrophobicContact CD2-CG2 3.77Å; L521-T546 HydrophobicContact CG-CG2 4.49Å; L542-T546 WeakPolarHBondContact O-CB 3.29Å; L542-T546 WeakPolarHBondContact O-CG2 3.43Å; L542-T546 PolarHBondContact O-N 3.43Å; L542-T546 VanDerWaalsContact O-N 3.12Å; L542-T546 PolarHBondContact O-OG1 3.36Å; I543-T546 PolarHBondContact O-N 3.25Å; I543-T546 PolarHBondContact O-OG1 2.7Å; E544-T546 VanDerWaalsContact C-N 3.34Å; E544-T546 PolarHBondContact O-N 3.4Å; T546-E548 PolarHBondContact O-N 3.48Å
547	N	84.5	Confident	90.7	Very high	103 Å²	103	34.8 Å²	34.8	55%	0.551	19%	0.187	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.2	29	-178.4	-161.2	24.7	0	0	0	114	E312 I543 E544	E312-N547 PolarHBondContact OE1-ND2 3.05Å; I543-N547 PolarHBondContact O-N 3.47Å; I543-N547 VanDerWaalsContact O-N 3.09Å; E544-N547 PolarHBondContact O-N 3.08Å
548	E	85.1	Confident	90.9	Very high	46 Å²	46	34.8 Å²	34.8	22%	0.215	19%	0.187	C	C	.	.			trans	-142	107.3	-176	-177.7	50.4	-109.5	0	0	110.7	L324 T546 T550 Y551	L324-E548 HydrophobicContact CD2-CG 3.95Å; T546-E548 PolarHBondContact O-N 3.48Å; E548-T550 VanDerWaalsContact C-N 3.3Å; E548-T550 VanDerWaalsContact CG-OG1 3.29Å; E548-T550 WeakPolarHBondContact CG-OG1 3.44Å; E548-T550 PolarHBondContact O-N 3.15Å; E548-T550 VanDerWaalsContact OE1-CB 3.32Å; E548-T550 WeakPolarHBondContact OE1-CB 3.46Å; E548-T550 WeakPolarHBondContact OE1-CG2 3.02Å; E548-T550 PolarHBondContact OE1-N 3.14Å; E548-T550 VanDerWaalsContact OE1-N 3.08Å; E548-T550 PolarHBondContact OE1-OG1 3.08Å; E548-Y551 HydrophobicContact CB-CD2 3.97Å; E548-Y551 HydrophobicContact CB-CE2 4.31Å; E548-Y551 HydrophobicContact CG-CD2 3.82Å; E548-Y551 HydrophobicContact CG-CE2 4.05Å
549	I	85.9	Confident	91	Very high	141 Å²	141	34.7 Å²	34.7	72%	0.723	19%	0.186	S	C	*	.	G	3₁₀ helix	trans	-74.8	-23.5	-172.9	-56.2	171.9	0	0	0	111.1	I543 Y551 G552	I543-I549 HydrophobicContact CG2-CG1 4.2Å; I549-Y551 PolarHBondContact O-N 3.31Å; I549-Y551 VanDerWaalsContact O-N 3.11Å; I549-G552 PolarHBondContact O-N 3.37Å
550	T	87.5	Confident	91.1	Very high	75 Å²	75	37.9 Å²	37.9	46%	0.46	20%	0.201	S	C	.	.	G	3₁₀ helix	trans	-62.6	-19.9	-179.1	57.4	0	0	0	0	113.6	W325 E548 G552	W325-T550 PolarHBondContact NE1-O 2.9Å; E548-T550 VanDerWaalsContact C-N 3.3Å; E548-T550 VanDerWaalsContact CG-OG1 3.29Å; E548-T550 WeakPolarHBondContact CG-OG1 3.44Å; E548-T550 PolarHBondContact O-N 3.15Å; E548-T550 VanDerWaalsContact OE1-CB 3.32Å; E548-T550 WeakPolarHBondContact OE1-CB 3.46Å; E548-T550 WeakPolarHBondContact OE1-CG2 3.02Å; E548-T550 PolarHBondContact OE1-N 3.14Å; E548-T550 VanDerWaalsContact OE1-N 3.08Å; E548-T550 PolarHBondContact OE1-OG1 3.08Å; T550-G552 VanDerWaalsContact C-N 3.29Å; T550-G552 PolarHBondContact O-N 3.3Å
551	Y	88.5	Confident	91.2	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	20%	0.197	C	C	.	.	G	3₁₀ helix	trans	-78.3	-7.1	172.4	-71.4	-55.6	0	0	0	114.9	F313 L324 T518 L521 E548 I549 L553 P554 I555	F313-Y551 HydrophobicContact CB-CE2 3.59Å; F313-Y551 HydrophobicContact CD1-CE2 4.19Å; F313-Y551 AromaticContact CG-CE2 3.93Å; F313-Y551 HydrophobicContact CG-CE2 3.93Å; L324-Y551 HydrophobicContact CB-CE1 4.19Å; L324-Y551 HydrophobicContact CD2-CD2 4.16Å; L324-Y551 HydrophobicContact CD2-CE1 3.72Å; L324-Y551 HydrophobicContact CD2-CE2 3.32Å; L324-Y551 WeakPolarHBondContact CD2-OH 3.17Å; L324-Y551 HydrophobicContact CG-CE1 4.06Å; L324-Y551 HydrophobicContact CG-CE2 4.31Å; L324-Y551 WeakPolarHBondContact CG-OH 3.2Å; T518-Y551 HydrophobicContact CG2-CD1 4.35Å; T518-Y551 HydrophobicContact CG2-CE1 3.53Å; T518-Y551 PolarHBondContact OG1-OH 3.12Å; L521-Y551 HydrophobicContact CD2-CD2 4.18Å; L521-Y551 HydrophobicContact CD2-CE2 4.24Å; L521-Y551 HydrophobicContact CD2-CG 4.42Å; E548-Y551 HydrophobicContact CB-CD2 3.97Å; E548-Y551 HydrophobicContact CB-CE2 4.31Å; E548-Y551 HydrophobicContact CG-CD2 3.82Å; E548-Y551 HydrophobicContact CG-CE2 4.05Å; I549-Y551 PolarHBondContact O-N 3.31Å; I549-Y551 VanDerWaalsContact O-N 3.11Å; Y551-L553 PolarHBondContact O-N 2.87Å; Y551-P554 VanDerWaalsContact O-CD 3.32Å; Y551-P554 WeakPolarHBondContact O-CD 3.27Å; Y551-I555 WeakPolarHBondContact O-CB 3.26Å; Y551-I555 VanDerWaalsContact O-CG1 3.28Å; Y551-I555 WeakPolarHBondContact O-CG1 3.35Å; Y551-I555 PolarHBondContact O-N 3.47Å
552	G	89.8	Confident	91.4	Very high	12 Å²	12	37.1 Å²	37.1	12%	0.124	20%	0.196	C	C	.	.	H	α-helix	trans	-59.7	-43.4	-173.9	0	0	0	0	0	113.7	I549 T550 M556	I549-G552 PolarHBondContact O-N 3.37Å; T550-G552 VanDerWaalsContact C-N 3.29Å; T550-G552 PolarHBondContact O-N 3.3Å; G552-M556 WeakPolarHBondContact O-CB 3.37Å; G552-M556 PolarHBondContact O-N 3Å
553	L	91.3	Very high	91.5	Very high	82 Å²	82	39.4 Å²	39.4	43%	0.429	21%	0.206	S	C	.	.	H	α-helix	trans	-66.2	-50.4	178.6	178.5	148.3	0	0	0	112.5	W325 L330 Y551 I555 M556 I557	W325-L553 HydrophobicContact CH2-CD2 3.97Å; L330-L553 HydrophobicContact CD1-CD2 4.08Å; L330-L553 HydrophobicContact CD2-CD2 4.2Å; Y551-L553 PolarHBondContact O-N 2.87Å; L553-I555 PolarHBondContact O-N 3.4Å; L553-M556 PolarHBondContact O-N 2.68Å; L553-I557 HydrophobicContact CD2-CD1 3.65Å; L553-I557 HydrophobicContact CG-CD1 3.89Å; L553-I557 WeakPolarHBondContact O-CG1 3.38Å; L553-I557 PolarHBondContact O-N 3.05Å
554	P	92.8	Very high	91.7	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-54.4	-48.1	172.9	-30.7	35.7	0	0	0	114.1	W325 F333 I522 Y551 I557 T558	W325-P554 HydrophobicContact CD2-CG 3.73Å; W325-P554 HydrophobicContact CE3-CG 4.15Å; W325-P554 HydrophobicContact CG-CG 4.12Å; W325-P554 HydrophobicContact CH2-CG 4.35Å; W325-P554 HydrophobicContact CZ2-CG 3.92Å; W325-P554 HydrophobicContact CZ3-CG 4.44Å; F333-P554 HydrophobicContact CD2-CB 3.79Å; F333-P554 HydrophobicContact CD2-CG 4.41Å; F333-P554 HydrophobicContact CE2-CB 3.9Å; F333-P554 HydrophobicContact CE2-CG 4.24Å; I522-P554 HydrophobicContact CD1-CB 3.83Å; Y551-P554 VanDerWaalsContact O-CD 3.32Å; Y551-P554 WeakPolarHBondContact O-CD 3.27Å; P554-I557 PolarHBondContact O-N 2.97Å; P554-T558 WeakPolarHBondContact O-CB 3.36Å; P554-T558 VanDerWaalsContact O-CG2 3.22Å; P554-T558 WeakPolarHBondContact O-CG2 3.45Å; P554-T558 PolarHBondContact O-N 3.19Å; P554-T558 PolarHBondContact O-OG1 3.36Å
555	I	94.5	Very high	92	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-64.3	-45.3	-178.6	-67.7	170.1	0	0	0	110.3	L521 I522 A525 T539 L542 Y551 L553 I557 T558 L559	L521-I555 HydrophobicContact CD2-CD1 4.38Å; I522-I555 HydrophobicContact CD1-CG1 3.74Å; A525-I555 HydrophobicContact CB-CG2 4.37Å; T539-I555 HydrophobicContact CG2-CG2 4.1Å; L542-I555 HydrophobicContact CB-CD1 4.13Å; L542-I555 HydrophobicContact CB-CG2 4.39Å; L542-I555 HydrophobicContact CD1-CG2 3.89Å; Y551-I555 WeakPolarHBondContact O-CB 3.26Å; Y551-I555 VanDerWaalsContact O-CG1 3.28Å; Y551-I555 WeakPolarHBondContact O-CG1 3.35Å; Y551-I555 PolarHBondContact O-N 3.47Å; L553-I555 PolarHBondContact O-N 3.4Å; I555-I557 PolarHBondContact O-N 3.34Å; I555-T558 WeakPolarHBondContact CA-OG1 3.05Å; I555-T558 PolarHBondContact O-N 3.44Å; I555-T558 PolarHBondContact O-OG1 3.01Å; I555-L559 HydrophobicContact CG2-CD1 3.65Å; I555-L559 HydrophobicContact CG2-CG 4.26Å; I555-L559 WeakPolarHBondContact O-CB 3.38Å; I555-L559 VanDerWaalsContact O-CG 3.29Å; I555-L559 WeakPolarHBondContact O-CG 3.23Å; I555-L559 PolarHBondContact O-N 3.23Å
556	M	94.6	Very high	92.4	Very high	83 Å²	83	45 Å²	45	41%	0.409	23%	0.226	S	C	.	.	H	α-helix	trans	-60.8	-47.1	179.7	-174.9	177.1	66.1	0	0	112.1	T539 G552 L553 L559 M560	T539-M556 HydrophobicContact CG2-CB 4.07Å; G552-M556 WeakPolarHBondContact O-CB 3.37Å; G552-M556 PolarHBondContact O-N 3Å; L553-M556 PolarHBondContact O-N 2.68Å; M556-L559 PolarHBondContact O-N 3.44Å; M556-M560 HydrophobicContact CG-CE 4.36Å; M556-M560 WeakPolarHBondContact O-CG 3.19Å; M556-M560 PolarHBondContact O-N 3.48Å
557	I	94.8	Very high	92.7	Very high	47 Å²	47	48.4 Å²	48.4	24%	0.241	24%	0.244	C	C	.	.	H	α-helix	trans	-64.7	-45.7	-179.4	-70.4	170	0	0	0	110.6	L330 V334 L553 P554 I555 L559 M560 V561	L330-I557 HydrophobicContact CD1-CD1 3.93Å; L330-I557 HydrophobicContact CD1-CG2 4.49Å; L330-I557 HydrophobicContact CD2-CD1 4.2Å; V334-I557 HydrophobicContact CG2-CG2 3.73Å; L553-I557 HydrophobicContact CD2-CD1 3.65Å; L553-I557 HydrophobicContact CG-CD1 3.89Å; L553-I557 WeakPolarHBondContact O-CG1 3.38Å; L553-I557 PolarHBondContact O-N 3.05Å; P554-I557 PolarHBondContact O-N 2.97Å; I555-I557 PolarHBondContact O-N 3.34Å; I557-L559 PolarHBondContact O-N 3.37Å; I557-M560 PolarHBondContact O-N 3.19Å; I557-V561 HydrophobicContact CG2-CG2 4.47Å; I557-V561 VanDerWaalsContact O-CG2 3.31Å; I557-V561 WeakPolarHBondContact O-CG2 3.35Å; I557-V561 PolarHBondContact O-N 3.33Å
558	T	95.7	Very high	93.2	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-62.4	-41.8	178.8	53.5	0	0	0	0	112.8	F333 I522 P554 I555 V561 A562	F333-T558 HydrophobicContact CB-CG2 3.49Å; F333-T558 VanDerWaalsContact CB-CG2 3.49Å; F333-T558 HydrophobicContact CG-CG2 4.41Å; F333-T558 WeakPolarHBondContact O-CG2 3.22Å; I522-T558 HydrophobicContact CG2-CG2 3.39Å; P554-T558 WeakPolarHBondContact O-CB 3.36Å; P554-T558 VanDerWaalsContact O-CG2 3.22Å; P554-T558 WeakPolarHBondContact O-CG2 3.45Å; P554-T558 PolarHBondContact O-N 3.19Å; P554-T558 PolarHBondContact O-OG1 3.36Å; I555-T558 WeakPolarHBondContact CA-OG1 3.05Å; I555-T558 PolarHBondContact O-N 3.44Å; I555-T558 PolarHBondContact O-OG1 3.01Å; T558-V561 PolarHBondContact O-N 3.01Å; T558-A562 VanDerWaalsContact O-CB 3.24Å; T558-A562 WeakPolarHBondContact O-CB 2.96Å; T558-A562 PolarHBondContact O-N 3.44Å
559	L	95.9	Very high	93.7	Very high	1 Å²	1	55 Å²	55	1%	0.005	27%	0.267	C	S	.	.	H	α-helix	trans	-65.4	-42.3	175.9	-74.9	174	0	0	0	112.4	A525 L538 T539 I555 M556 I557 A562 K563	A525-L559 HydrophobicContact CB-CD2 4.27Å; A525-L559 HydrophobicContact CB-CG 4.41Å; A525-L559 WeakPolarHBondContact O-CD2 3.38Å; L538-L559 HydrophobicContact CB-CD1 4.36Å; L538-L559 HydrophobicContact CD2-CD1 4.31Å; L538-L559 HydrophobicContact CD2-CD2 3.7Å; L538-L559 HydrophobicContact CG-CD1 4.13Å; L538-L559 HydrophobicContact CG-CD2 4.38Å; T539-L559 VanDerWaalsContact OG1-CD1 3.26Å; T539-L559 WeakPolarHBondContact OG1-CD1 3.33Å; I555-L559 HydrophobicContact CG2-CD1 3.65Å; I555-L559 HydrophobicContact CG2-CG 4.26Å; I555-L559 WeakPolarHBondContact O-CB 3.38Å; I555-L559 VanDerWaalsContact O-CG 3.29Å; I555-L559 WeakPolarHBondContact O-CG 3.23Å; I555-L559 PolarHBondContact O-N 3.23Å; M556-L559 PolarHBondContact O-N 3.44Å; I557-L559 PolarHBondContact O-N 3.37Å; L559-A562 PolarHBondContact O-N 3.4Å; L559-K563 VanDerWaalsContact O-CB 3.32Å; L559-K563 WeakPolarHBondContact O-CB 3.27Å; L559-K563 PolarHBondContact O-N 3.43Å
560	M	95.4	Very high	94	Very high	79 Å²	79	49.8 Å²	49.8	39%	0.389	24%	0.241	S	C	.	.	H	α-helix	trans	-61.4	-46.6	176.1	-77.9	-173	169.2	0	0	111.7	M556 I557 K563 W564	M556-M560 HydrophobicContact CG-CE 4.36Å; M556-M560 WeakPolarHBondContact O-CG 3.19Å; M556-M560 PolarHBondContact O-N 3.48Å; I557-M560 PolarHBondContact O-N 3.19Å; M560-K563 PolarHBondContact O-N 2.89Å; M560-W564 PolarHBondContact O-N 2.98Å
561	V	96.8	Very high	94.2	Very high	21 Å²	21	49.7 Å²	49.7	13%	0.127	23%	0.234	C	C	.	.	H	α-helix	trans	-64.6	-44.1	178	175	0	0	0	0	111	V334 V338 I557 T558 K563 W564 T565	V334-V561 HydrophobicContact CG1-CG1 4.4Å; V334-V561 HydrophobicContact CG1-CG2 4.26Å; V338-V561 HydrophobicContact CG2-CG1 3.59Å; I557-V561 HydrophobicContact CG2-CG2 4.47Å; I557-V561 VanDerWaalsContact O-CG2 3.31Å; I557-V561 WeakPolarHBondContact O-CG2 3.35Å; I557-V561 PolarHBondContact O-N 3.33Å; T558-V561 PolarHBondContact O-N 3.01Å; V561-K563 VanDerWaalsContact C-N 3.33Å; V561-K563 PolarHBondContact O-N 3.01Å; V561-W564 PolarHBondContact O-N 3.47Å; V561-T565 HydrophobicContact CG1-CG2 4.15Å; V561-T565 WeakPolarHBondContact O-CB 3.05Å; V561-T565 WeakPolarHBondContact O-CG2 3.14Å; V561-T565 PolarHBondContact O-N 3.45Å; V561-T565 PolarHBondContact O-OG1 3.28Å
562	A	96.9	Very high	94.5	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-64.3	-35.9	177.5	0	0	0	0	0	112.9	G337 G341 A526 R533 T558 L559 T565 G566	G337-A562 VanDerWaalsContact O-CA 3.24Å; G337-A562 WeakPolarHBondContact O-CA 3.49Å; G337-A562 WeakPolarHBondContact O-CB 3.44Å; G341-A562 WeakPolarHBondContact CA-O 3.37Å; A526-A562 WeakPolarHBondContact O-CB 3.46Å; R533-A562 PolarHBondContact NH1-O 2.89Å; T558-A562 VanDerWaalsContact O-CB 3.24Å; T558-A562 WeakPolarHBondContact O-CB 2.96Å; T558-A562 PolarHBondContact O-N 3.44Å; L559-A562 PolarHBondContact O-N 3.4Å; A562-T565 PolarHBondContact O-OG1 2.93Å; A562-G566 PolarHBondContact O-N 3.45Å
563	K	95.3	Very high	94.6	Very high	52 Å²	52	49.2 Å²	49.2	23%	0.226	23%	0.229	C	C	.	.	H	α-helix	trans	-63.4	-58.2	172.9	176.3	179.6	171	-168.6	0	110.3	R533 T535 L559 M560 V561 T565 G566 D567	R533-K563 PolarHBondContact NH1-O 2.99Å; T535-K563 HydrophobicContact CG2-CB 4.16Å; T535-K563 HydrophobicContact CG2-CD 3.4Å; T535-K563 VanDerWaalsContact CG2-CD 3.4Å; T535-K563 HydrophobicContact CG2-CG 4.36Å; L559-K563 VanDerWaalsContact O-CB 3.32Å; L559-K563 WeakPolarHBondContact O-CB 3.27Å; L559-K563 PolarHBondContact O-N 3.43Å; M560-K563 PolarHBondContact O-N 2.89Å; V561-K563 VanDerWaalsContact C-N 3.33Å; V561-K563 PolarHBondContact O-N 3.01Å; K563-T565 VanDerWaalsContact C-N 3.33Å; K563-T565 PolarHBondContact O-N 3.43Å; K563-G566 PolarHBondContact O-N 2.76Å; K563-D567 WeakPolarHBondContact CE-OD2 3.45Å; K563-D567 WeakPolarHBondContact CG-OD2 3.26Å; K563-D567 WeakPolarHBondContact O-CB 3.26Å; K563-D567 PolarHBondContact O-N 3.18Å
564	W	95.6	Very high	94.7	Very high	174 Å²	174	45.4 Å²	45.4	66%	0.659	21%	0.209	S	C	*	.	H	α-helix	trans	-56.2	-45.4	-177.3	-68.9	-21.9	0	0	0	112.7	M560 V561 G566 D567 F568	M560-W564 PolarHBondContact O-N 2.98Å; V561-W564 PolarHBondContact O-N 3.47Å; W564-G566 VanDerWaalsContact C-N 3.27Å; W564-G566 PolarHBondContact O-N 3.17Å; W564-D567 PolarHBondContact O-N 3.21Å; W564-F568 PolarHBondContact O-N 3.39Å
565	T	96.7	Very high	94.6	Very high	30 Å²	30	47.3 Å²	47.3	18%	0.184	22%	0.219	C	C	.	.	H	α-helix	trans	-64.6	-32.5	-176	54.1	0	0	0	0	112.6	V338 G341 V561 A562 K563 F569	V338-T565 HydrophobicContact CB-CG2 4.19Å; V338-T565 HydrophobicContact CG1-CG2 4.11Å; V338-T565 HydrophobicContact CG2-CG2 3.94Å; G341-T565 WeakPolarHBondContact CA-OG1 3.4Å; V561-T565 HydrophobicContact CG1-CG2 4.15Å; V561-T565 WeakPolarHBondContact O-CB 3.05Å; V561-T565 WeakPolarHBondContact O-CG2 3.14Å; V561-T565 PolarHBondContact O-N 3.45Å; V561-T565 PolarHBondContact O-OG1 3.28Å; A562-T565 PolarHBondContact O-OG1 2.93Å; K563-T565 VanDerWaalsContact C-N 3.33Å; K563-T565 PolarHBondContact O-N 3.43Å; T565-F569 VanDerWaalsContact O-CD2 3.27Å; T565-F569 WeakPolarHBondContact O-CD2 3.47Å
566	G	95.6	Very high	94.5	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-98.9	-20.4	178.2	0	0	0	0	0	115.1	R533 A562 K563 W564 F568 F569 N570	R533-G566 PolarHBondContact NH2-O 3.33Å; A562-G566 PolarHBondContact O-N 3.45Å; K563-G566 PolarHBondContact O-N 2.76Å; W564-G566 VanDerWaalsContact C-N 3.27Å; W564-G566 PolarHBondContact O-N 3.17Å; G566-F568 PolarHBondContact O-N 2.95Å; G566-F569 PolarHBondContact O-N 3.5Å; G566-N570 PolarHBondContact O-N 3.3Å
567	D	93.8	Very high	94.3	Very high	70 Å²	70	44.5 Å²	44.5	37%	0.374	21%	0.205	S	C	.	.	H	α-helix	trans	-59.2	-28.5	166.9	-80.4	-15	0	0	0	110.7	R533 K563 W564 F569	R533-D567 WeakPolarHBondContact CD-OD1 3.29Å; R533-D567 IonicContact NE-OD1 2.69Å; R533-D567 PolarHBondContact NE-OD1 3.48Å; K563-D567 WeakPolarHBondContact CE-OD2 3.45Å; K563-D567 WeakPolarHBondContact CG-OD2 3.26Å; K563-D567 WeakPolarHBondContact O-CB 3.26Å; K563-D567 PolarHBondContact O-N 3.18Å; W564-D567 PolarHBondContact O-N 3.21Å; D567-F569 PolarHBondContact O-N 2.99Å
568	F	94.9	Very high	94.1	Very high	169 Å²	169	42.4 Å²	42.4	74%	0.741	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-30.6	171.3	-176.1	-98.9	0	0	0	113.8	W564 G566	W564-F568 PolarHBondContact O-N 3.39Å; G566-F568 PolarHBondContact O-N 2.95Å
569	F	94.7	Very high	93.7	Very high	118 Å²	118	46 Å²	46	52%	0.518	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.1	-49.5	-178.4	-64.6	-88.2	0	0	0	112.4	L342 A345 T565 G566 D567	L342-F569 HydrophobicContact CD2-CD2 4.24Å; L342-F569 HydrophobicContact CD2-CE2 3.4Å; L342-F569 HydrophobicContact CD2-CZ 3.84Å; A345-F569 HydrophobicContact CB-CB 4.01Å; A345-F569 HydrophobicContact CB-CD2 4.4Å; A345-F569 HydrophobicContact CB-CG 4.45Å; T565-F569 VanDerWaalsContact O-CD2 3.27Å; T565-F569 WeakPolarHBondContact O-CD2 3.47Å; G566-F569 PolarHBondContact O-N 3.5Å; D567-F569 PolarHBondContact O-N 2.99Å
570	N	93.6	Very high	93.3	Very high	33 Å²	33	46.8 Å²	46.8	18%	0.176	22%	0.216	C	C	.	.			trans	-147.6	147.3	-168.2	-51.9	39.9	0	0	0	111.5	A345 C349 R533 G566	A345-N570 PolarHBondContact O-ND2 2.97Å; C349-N570 WeakPolarHBondContact CB-ND2 3.32Å; C349-N570 PolarHBondContact N-ND2 3.25Å; R533-N570 PolarHBondContact NH2-O 3.5Å; G566-N570 PolarHBondContact O-N 3.3Å
571	K	91.7	Very high	92.7	Very high	72 Å²	72	46.3 Å²	46.3	31%	0.313	21%	0.211	S	C	.	.			trans	-62.2	163.9	164.4	-62.2	-169.3	-179.7	-173	0	111.7	N348 D575 I576 E587	N348-K571 PolarHBondContact ND2-O 2.96Å; K571-D575 HydrophobicContact CB-CB 4.34Å; K571-I576 HydrophobicContact CB-CG1 4.23Å; K571-I576 WeakPolarHBondContact O-CD1 3.39Å; K571-E587 IonicContact NZ-OE1 3.7Å; K571-E587 PolarHBondContact NZ-OE1 3.43Å
572	G	93.3	Very high	92.1	Very high	2 Å²	2	46.5 Å²	46.5	2%	0.021	22%	0.218	C	C	.	.			trans	-62.3	156.4	175.9	0	0	0	0	0	112.9	R533 Y574 D575 I576	R533-G572 VanDerWaalsContact CG-CA 3.48Å; G572-Y574 VanDerWaalsContact C-N 3.26Å; G572-Y574 PolarHBondContact O-N 2.89Å; G572-D575 PolarHBondContact O-N 2.9Å; G572-I576 WeakPolarHBondContact O-CG1 3.2Å; G572-I576 PolarHBondContact O-N 2.89Å
573	I	93.5	Very high	91.6	Very high	0 Å²	0	47 Å²	47	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-57.7	-37.3	-175.6	-168.9	64.1	0	0	0	113.2	N348 N351 Y479 L487 V531 V532 H577	N348-I573 PolarHBondContact ND2-N 3.31Å; N348-I573 WeakPolarHBondContact OD1-CB 3.49Å; N351-I573 HydrophobicContact CB-CD1 3.84Å; Y479-I573 HydrophobicContact CD1-CG1 4.49Å; Y479-I573 HydrophobicContact CE1-CD1 4.06Å; Y479-I573 HydrophobicContact CE1-CG1 3.76Å; L487-I573 HydrophobicContact CD2-CB 4.41Å; L487-I573 HydrophobicContact CD2-CG1 4.01Å; L487-I573 HydrophobicContact CD2-CG2 3.84Å; V531-I573 HydrophobicContact CG1-CB 4.19Å; V531-I573 HydrophobicContact CG1-CG2 3.97Å; V531-I573 PolarHBondContact O-N 3.28Å; V531-I573 VanDerWaalsContact O-N 3.1Å; V532-I573 HydrophobicContact CG2-CG2 4.43Å; I573-H577 PolarHBondContact O-N 3.06Å; I573-H577 VanDerWaalsContact O-N 3.14Å; I573-H577 PolarHBondContact O-ND1 2.98Å
574	Y	91.8	Very high	91.2	Very high	3 Å²	3	46 Å²	46	1%	0.012	22%	0.219	C	C	.	.	H	α-helix	trans	-69.8	-43.9	179.8	-62.9	-39.1	0	0	0	111.3	I155 P156 F488 V532 M534 G572 I576 H577 I578	I155-Y574 HydrophobicContact CB-CE1 4.3Å; I155-Y574 HydrophobicContact CB-CE2 4.48Å; I155-Y574 HydrophobicContact CD1-CE1 4.37Å; I155-Y574 HydrophobicContact CD1-CE2 4.2Å; I155-Y574 WeakPolarHBondContact CD1-OH 3.32Å; I155-Y574 HydrophobicContact CG2-CD2 3.97Å; I155-Y574 HydrophobicContact CG2-CE1 4.5Å; I155-Y574 HydrophobicContact CG2-CE2 3.9Å; I155-Y574 HydrophobicContact CG2-CG 4.31Å; P156-Y574 HydrophobicContact CG-CD1 3.76Å; P156-Y574 HydrophobicContact CG-CG 4.34Å; F488-Y574 HydrophobicContact CE2-CE2 4.38Å; F488-Y574 WeakPolarHBondContact CE2-OH 3.49Å; V532-Y574 HydrophobicContact CG1-CD2 3.89Å; V532-Y574 HydrophobicContact CG1-CE2 3.51Å; V532-Y574 HydrophobicContact CG2-CE2 4.36Å; M534-Y574 HydrophobicContact CE-CD2 3.7Å; M534-Y574 HydrophobicContact CE-CE2 3.61Å; G572-Y574 VanDerWaalsContact C-N 3.26Å; G572-Y574 PolarHBondContact O-N 2.89Å; Y574-I576 PolarHBondContact O-N 3.47Å; Y574-H577 PolarHBondContact O-N 3.45Å; Y574-I578 VanDerWaalsContact O-CG1 3.28Å; Y574-I578 WeakPolarHBondContact O-CG1 3.22Å; Y574-I578 PolarHBondContact O-N 3.32Å
575	D	91.6	Very high	90.8	Very high	39 Å²	39	39.5 Å²	39.5	21%	0.209	20%	0.197	C	C	.	.	H	α-helix	trans	-66.1	-39.4	178.6	-58.5	-34.3	0	0	0	111.3	K159 K571 G572 H577 I578 Q579	K159-D575 WeakPolarHBondContact CE-OD1 3.4Å; K159-D575 IonicContact NZ-OD1 3.48Å; K159-D575 PolarHBondContact NZ-OD1 3.22Å; K159-D575 IonicContact NZ-OD2 3.35Å; K571-D575 HydrophobicContact CB-CB 4.34Å; G572-D575 PolarHBondContact O-N 2.9Å; D575-H577 VanDerWaalsContact C-N 3.31Å; D575-H577 PolarHBondContact O-N 3.37Å; D575-I578 PolarHBondContact O-N 2.92Å; D575-Q579 WeakPolarHBondContact O-CG 3.36Å; D575-Q579 PolarHBondContact O-N 3.27Å
576	I	92.2	Very high	90.4	Very high	5 Å²	5	38.4 Å²	38.4	3%	0.026	19%	0.19	C	C	.	.	H	α-helix	trans	-56.9	-44.9	172.2	-68.7	168.9	0	0	0	110.8	N348 K352 K571 G572 Y574 Q579 L580	N348-I576 HydrophobicContact CB-CD1 3.95Å; K352-I576 HydrophobicContact CB-CG2 4.02Å; K352-I576 HydrophobicContact CD-CG2 4.15Å; K352-I576 HydrophobicContact CG-CG2 3.91Å; K571-I576 HydrophobicContact CB-CG1 4.23Å; K571-I576 WeakPolarHBondContact O-CD1 3.39Å; G572-I576 WeakPolarHBondContact O-CG1 3.2Å; G572-I576 PolarHBondContact O-N 2.89Å; Y574-I576 PolarHBondContact O-N 3.47Å; I576-Q579 PolarHBondContact O-N 2.88Å; I576-L580 HydrophobicContact CG2-CD1 3.92Å; I576-L580 HydrophobicContact CG2-CG 4.31Å; I576-L580 WeakPolarHBondContact O-CB 3.34Å; I576-L580 VanDerWaalsContact O-CG 3.28Å; I576-L580 WeakPolarHBondContact O-CG 3.3Å; I576-L580 PolarHBondContact O-N 3.49Å
577	H	90.3	Very high	90	Very high	19 Å²	19	41.9 Å²	41.9	9%	0.088	21%	0.207	C	C	.	.	H	α-helix	trans	-71.9	-27.5	-179.8	-80.6	70.1	0	0	0	113.6	P156 N351 Y479 I573 Y574 D575 K581	P156-H577 HydrophobicContact CG-CB 4.48Å; N351-H577 PolarHBondContact OD1-CE1 2.86Å; Y479-H577 AromaticContact CE1-CE1 3.39Å; Y479-H577 WeakPolarHBondContact CE1-CE1 3.49Å; Y479-H577 AromaticContact CE1-ND1 3.86Å; Y479-H577 AromaticContact CE1-NE2 3.51Å; I573-H577 PolarHBondContact O-N 3.06Å; I573-H577 VanDerWaalsContact O-N 3.14Å; I573-H577 PolarHBondContact O-ND1 2.98Å; Y574-H577 PolarHBondContact O-N 3.45Å; D575-H577 VanDerWaalsContact C-N 3.31Å; D575-H577 PolarHBondContact O-N 3.37Å; H577-K581 VanDerWaalsContact O-CG 3.29Å; H577-K581 WeakPolarHBondContact O-CG 3.4Å; H577-K581 PolarHBondContact O-N 3.36Å
578	I	90.1	Very high	89.4	Confident	3 Å²	3	44.9 Å²	44.9	2%	0.015	21%	0.213	C	C	.	.	H	α-helix	trans	-67.8	-47.1	171.8	-68.1	171.2	0	0	0	109.4	P156 K159 Y574 D575 K581 G582 V583 L585	P156-I578 HydrophobicContact CB-CD1 4.35Å; P156-I578 HydrophobicContact CB-CG1 3.79Å; K159-I578 HydrophobicContact CB-CD1 4.33Å; K159-I578 HydrophobicContact CD-CD1 3.87Å; K159-I578 HydrophobicContact CG-CD1 4.12Å; Y574-I578 VanDerWaalsContact O-CG1 3.28Å; Y574-I578 WeakPolarHBondContact O-CG1 3.22Å; Y574-I578 PolarHBondContact O-N 3.32Å; D575-I578 PolarHBondContact O-N 2.92Å; I578-K581 PolarHBondContact O-N 3.3Å; I578-K581 VanDerWaalsContact O-N 3.14Å; I578-G582 PolarHBondContact O-N 2.71Å; I578-V583 HydrophobicContact CG2-CB 3.82Å; I578-V583 HydrophobicContact CG2-CG1 4.25Å; I578-V583 PolarHBondContact O-N 3.3Å; I578-L585 HydrophobicContact CD1-CD2 4.12Å; I578-L585 HydrophobicContact CG2-CB 3.89Å; I578-L585 HydrophobicContact CG2-CD2 4.28Å; I578-L585 HydrophobicContact CG2-CG 4.49Å
579	Q	88	Confident	88.8	Confident	77 Å²	77	44.2 Å²	44.2	36%	0.36	21%	0.212	S	C	.	.	H	α-helix	trans	-61.5	-46.5	176.5	-71.1	-177.8	-28.1	0	0	111.8	L39 D575 I576 K581 G582	L39-Q579 VanDerWaalsContact CD2-O 3.24Å; L39-Q579 WeakPolarHBondContact CD2-O 3.35Å; D575-Q579 WeakPolarHBondContact O-CG 3.36Å; D575-Q579 PolarHBondContact O-N 3.27Å; I576-Q579 PolarHBondContact O-N 2.88Å; Q579-K581 PolarHBondContact O-N 3.48Å; Q579-K581 VanDerWaalsContact O-N 3.11Å; Q579-G582 PolarHBondContact O-N 3.15Å
580	L	87.4	Confident	88.2	Confident	17 Å²	17	40 Å²	40	9%	0.089	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-18.3	176.3	-71.4	175.4	0	0	0	113.7	L39 A355 K356 M359 I576	L39-L580 VanDerWaalsContact CD2-C 3.42Å; L39-L580 WeakPolarHBondContact CD2-O 3.37Å; A355-L580 HydrophobicContact CB-CD1 3.74Å; K356-L580 HydrophobicContact CG-CD2 3.87Å; M359-L580 HydrophobicContact CE-CB 3.98Å; M359-L580 HydrophobicContact SD-CB 4.27Å; I576-L580 HydrophobicContact CG2-CD1 3.92Å; I576-L580 HydrophobicContact CG2-CG 4.31Å; I576-L580 WeakPolarHBondContact O-CB 3.34Å; I576-L580 VanDerWaalsContact O-CG 3.28Å; I576-L580 WeakPolarHBondContact O-CG 3.3Å; I576-L580 PolarHBondContact O-N 3.49Å
581	K	83.8	Confident	87.8	Confident	69 Å²	69	42.7 Å²	42.7	30%	0.3	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.7	-6.4	173.7	-75.2	173.2	-179.3	166.8	0	113.2	Y44 E157 H577 I578 Q579 V583	Y44-K581 PolarHBondContact OH-O 3.38Å; E157-K581 IonicContact OE1-NZ 3.31Å; E157-K581 PolarHBondContact OE1-NZ 2.8Å; H577-K581 VanDerWaalsContact O-CG 3.29Å; H577-K581 WeakPolarHBondContact O-CG 3.4Å; H577-K581 PolarHBondContact O-N 3.36Å; I578-K581 PolarHBondContact O-N 3.3Å; I578-K581 VanDerWaalsContact O-N 3.14Å; Q579-K581 PolarHBondContact O-N 3.48Å; Q579-K581 VanDerWaalsContact O-N 3.11Å; K581-V583 VanDerWaalsContact C-N 3.31Å; K581-V583 HydrophobicContact CB-CG2 3.96Å
582	G	83.9	Confident	87.4	Confident	25 Å²	25	45.3 Å²	45.3	26%	0.258	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	69.8	26.1	-178.2	0	0	0	0	0	113.4	I578 Q579	I578-G582 PolarHBondContact O-N 2.71Å; Q579-G582 PolarHBondContact O-N 3.15Å
583	V	86.9	Confident	87	Confident	11 Å²	11	50.6 Å²	50.6	7%	0.067	25%	0.253	C	S	.	.			trans	-80.9	126.2	-180	179.2	0	0	0	0	109.4	Y44 V165 I578 K581 L585	Y44-V583 HydrophobicContact CD2-CG2 4.45Å; Y44-V583 HydrophobicContact CE1-CG2 4.12Å; Y44-V583 HydrophobicContact CE2-CB 4.42Å; Y44-V583 HydrophobicContact CE2-CG2 3.79Å; V165-V583 HydrophobicContact CB-CG1 4.28Å; V165-V583 HydrophobicContact CG1-CG1 3.99Å; V165-V583 HydrophobicContact CG2-CG1 4.34Å; I578-V583 HydrophobicContact CG2-CB 3.82Å; I578-V583 HydrophobicContact CG2-CG1 4.25Å; I578-V583 PolarHBondContact O-N 3.3Å; K581-V583 VanDerWaalsContact C-N 3.31Å; K581-V583 HydrophobicContact CB-CG2 3.96Å; V583-L585 VanDerWaalsContact C-N 3.34Å; V583-L585 PolarHBondContact O-N 3.28Å
584	P	86.8	Confident	86.7	Confident	30 Å²	30	50.8 Å²	50.8	20%	0.195	25%	0.254	C	S	.	.			trans	-75.4	82.5	-179.5	30.6	-35.4	0	0	0	111.4	V165 T853	V165-P584 HydrophobicContact CG2-CG 4.41Å; V165-P584 WeakPolarHBondContact CG2-O 3.28Å; P584-T853 HydrophobicContact CB-CG2 3.76Å
585	L	87	Confident	86.4	Confident	38 Å²	38	53.1 Å²	53.1	20%	0.199	27%	0.267	C	S	.	.	P	Polyproline II helix	trans	-85.7	131.5	176.7	-169.3	79.8	0	0	0	110.5	N163 I578 V583	N163-L585 HydrophobicContact CB-CD1 3.55Å; N163-L585 VanDerWaalsContact CG-CD1 3.44Å; I578-L585 HydrophobicContact CD1-CD2 4.12Å; I578-L585 HydrophobicContact CG2-CB 3.89Å; I578-L585 HydrophobicContact CG2-CD2 4.28Å; I578-L585 HydrophobicContact CG2-CG 4.49Å; V583-L585 VanDerWaalsContact C-N 3.34Å; V583-L585 PolarHBondContact O-N 3.28Å
586	L	88.4	Confident	86.2	Confident	6 Å²	6	56.2 Å²	56.2	3%	0.031	28%	0.279	C	S	.	.	P	Polyproline II helix	trans	-86.6	133.7	168.9	-60.3	175.6	0	0	0	109.3	N163 F823 F826 R827 R849 L852	N163-L586 PolarHBondContact ND2-O 2.92Å; N163-L586 PolarHBondContact OD1-N 3.03Å; N163-L586 VanDerWaalsContact OD1-N 3.13Å; L586-F823 HydrophobicContact CB-CE2 4.44Å; L586-F823 HydrophobicContact CB-CZ 4.26Å; L586-F823 HydrophobicContact CD2-CE2 4.06Å; L586-F826 HydrophobicContact CD1-CD1 3.75Å; L586-F826 HydrophobicContact CD1-CE1 3.88Å; L586-R827 PolarHBondContact O-NH1 3.08Å; L586-R849 HydrophobicContact CD1-CG 4.35Å; L586-R849 HydrophobicContact CD2-CG 4.34Å; L586-R849 HydrophobicContact CG-CG 4.27Å; L586-L852 HydrophobicContact CD2-CB 3.85Å; L586-L852 WeakPolarHBondContact CD2-O 3.37Å
587	E	85.6	Confident	86.2	Confident	74 Å²	74	56 Å²	56	35%	0.346	28%	0.277	S	S	.	.	P	Polyproline II helix	trans	-80.4	169.4	175.3	-62.1	-171.5	168.1	0	0	111.9	K571 F823 R827	K571-E587 IonicContact NZ-OE1 3.7Å; K571-E587 PolarHBondContact NZ-OE1 3.43Å; E587-F823 VanDerWaalsContact O-CE1 3.29Å; E587-F823 WeakPolarHBondContact O-CE1 3.45Å; E587-F823 WeakPolarHBondContact O-CZ 3.02Å; E587-R827 WeakPolarHBondContact O-CD 3.12Å; E587-R827 PolarHBondContact O-NE 3.1Å; E587-R827 PolarHBondContact O-NH1 3.47Å
588	W	81.8	Confident	86.2	Confident	133 Å²	133	56.2 Å²	56.2	50%	0.504	28%	0.28	S	S	.	.	S	Bend	trans	-63.7	-41	-177	-72.2	-67.3	0	0	0	113	E262	E262-W588 HydrophobicContact CG-CZ2 4.34Å; E262-W588 VanDerWaalsContact O-CZ2 3.31Å; E262-W588 WeakPolarHBondContact O-CZ2 3.12Å
589	E	81.4	Confident	86.3	Confident	154 Å²	154	56.1 Å²	56.1	72%	0.72	28%	0.279	S	S	*	.	S	Bend	trans	-136.3	165.3	-176.2	-65.8	179.5	175.4	0	0	109.4
590	T	83.8	Confident	86.4	Confident	30 Å²	30	54.5 Å²	54.5	18%	0.184	28%	0.277	C	S	.	.			trans	-97.3	152	173.4	41.3	0	0	0	0	109.7	I819 F823 L857	T590-I819 HydrophobicContact CG2-CG2 4.49Å; T590-F823 HydrophobicContact CG2-CB 3.79Å; T590-F823 HydrophobicContact CG2-CD1 3.73Å; T590-F823 HydrophobicContact CG2-CD2 3.46Å; T590-F823 VanDerWaalsContact CG2-CD2 3.46Å; T590-F823 HydrophobicContact CG2-CE1 4.1Å; T590-F823 HydrophobicContact CG2-CE2 3.86Å; T590-F823 HydrophobicContact CG2-CG 3.38Å; T590-F823 HydrophobicContact CG2-CZ 4.14Å; T590-L857 HydrophobicContact CG2-CD1 4.45Å
591	E	84.4	Confident	86.5	Confident	90 Å²	90	56.2 Å²	56.2	42%	0.421	29%	0.286	S	S	.	.			trans	-66	143.7	171.5	-67.9	173	-172.9	0	0	110.4	E593 M594 H854	E591-E593 PolarHBondContact O-N 3.32Å; E591-E593 VanDerWaalsContact O-N 3.11Å; E591-M594 HydrophobicContact CB-CG 4.15Å; E591-M594 VanDerWaalsContact O-CB 3.32Å; E591-M594 WeakPolarHBondContact O-CB 3.38Å; E591-M594 PolarHBondContact O-N 3.32Å; E591-H854 IonicContact OE1-CD2 3.17Å; E591-H854 IonicContact OE1-CE1 2.96Å; E591-H854 IonicContact OE1-NE2 2.83Å; E591-H854 PolarHBondContact OE1-NE2 3.05Å; E591-H854 IonicContact OE2-NE2 3.27Å
592	V	84.2	Confident	86.9	Confident	127 Å²	127	53 Å²	53	77%	0.77	27%	0.272	S	S	*	.	G	3₁₀ helix	trans	-58.8	-28.9	-176.3	-177.1	0	0	0	0	112.2	M594 D595	V592-M594 VanDerWaalsContact C-N 3.27Å; V592-M594 PolarHBondContact O-N 2.96Å; V592-D595 PolarHBondContact O-N 2.99Å
593	E	84.4	Confident	87.2	Confident	112 Å²	112	53 Å²	53	52%	0.523	27%	0.266	S	S	.	.	G	3₁₀ helix	trans	-67.1	-28.7	177.7	-59.5	-170.6	178.6	0	0	113	E591 D595 K596 L861	E591-E593 PolarHBondContact O-N 3.32Å; E591-E593 VanDerWaalsContact O-N 3.11Å; E593-D595 PolarHBondContact O-N 2.86Å; E593-K596 WeakPolarHBondContact O-CG 3.2Å; E593-K596 PolarHBondContact O-N 2.86Å; E593-L861 HydrophobicContact CB-CD2 4.07Å; E593-L861 WeakPolarHBondContact O-CD1 3.3Å
594	M	86.1	Confident	87.3	Confident	4 Å²	4	56.5 Å²	56.5	2%	0.02	28%	0.281	C	S	.	.	G	3₁₀ helix	trans	-70.1	-18.3	-179.4	-58	-61.3	172.9	0	0	112.5	E591 V592 K596 L597 L857 V858 L861	E591-M594 HydrophobicContact CB-CG 4.15Å; E591-M594 VanDerWaalsContact O-CB 3.32Å; E591-M594 WeakPolarHBondContact O-CB 3.38Å; E591-M594 PolarHBondContact O-N 3.32Å; V592-M594 VanDerWaalsContact C-N 3.27Å; V592-M594 PolarHBondContact O-N 2.96Å; M594-K596 PolarHBondContact O-N 2.96Å; M594-L597 PolarHBondContact O-N 2.81Å; M594-L857 HydrophobicContact CE-CB 4.36Å; M594-L857 HydrophobicContact SD-CB 3.76Å; M594-V858 HydrophobicContact CE-CB 4.18Å; M594-V858 HydrophobicContact CE-CG2 3.35Å; M594-L861 HydrophobicContact CE-CD2 4.27Å; M594-L861 HydrophobicContact SD-CB 4.2Å; M594-L861 HydrophobicContact SD-CD2 4Å
595	D	86.3	Confident	87.2	Confident	53 Å²	53	58.7 Å²	58.7	28%	0.283	30%	0.295	S	S	.	.	G	3₁₀ helix	trans	-68.6	-10	176.4	-87.1	-23.2	0	0	0	114.2	V592 E593 L597 R818 S820	V592-D595 PolarHBondContact O-N 2.99Å; E593-D595 PolarHBondContact O-N 2.86Å; D595-L597 VanDerWaalsContact C-N 3.25Å; D595-L597 PolarHBondContact O-N 2.85Å; D595-R818 WeakPolarHBondContact O-CD 3.36Å; D595-R818 PolarHBondContact O-NH1 2.88Å; D595-S820 VanDerWaalsContact CG-OG 3.3Å; D595-S820 WeakPolarHBondContact OD1-CA 3.47Å; D595-S820 WeakPolarHBondContact OD1-CB 3.37Å; D595-S820 PolarHBondContact OD1-N 3.28Å; D595-S820 PolarHBondContact OD1-OG 3.27Å; D595-S820 PolarHBondContact OD2-OG 3.02Å
596	K	88.1	Confident	87.2	Confident	104 Å²	104	62.8 Å²	62.8	45%	0.452	32%	0.318	S	S	.	.	G	3₁₀ helix	trans	-66.6	-31.4	172.7	-66.3	-178.5	-176	-177.7	0	112.1	E593 M594 R818 L861 Y865	E593-K596 WeakPolarHBondContact O-CG 3.2Å; E593-K596 PolarHBondContact O-N 2.86Å; M594-K596 PolarHBondContact O-N 2.96Å; K596-R818 PolarHBondContact O-NH1 2.9Å; K596-L861 HydrophobicContact CB-CD1 4.32Å; K596-Y865 PolarHBondContact NZ-OH 2.91Å
597	L	90.8	Very high	87	Confident	0 Å²	0	64.2 Å²	64.2	0%	0	33%	0.325	C	S	.	.	S	Bend	trans	-79.2	158.8	-179.6	-61.9	170.1	0	0	0	112	M594 D595 D601 I819 K860 L861 H864	M594-L597 PolarHBondContact O-N 2.81Å; D595-L597 VanDerWaalsContact C-N 3.25Å; D595-L597 PolarHBondContact O-N 2.85Å; L597-D601 HydrophobicContact CD2-CB 4.22Å; L597-I819 HydrophobicContact CB-CD1 3.21Å; L597-I819 HydrophobicContact CB-CG1 3.72Å; L597-I819 HydrophobicContact CD1-CD1 3.64Å; L597-I819 HydrophobicContact CG-CD1 4.06Å; L597-I819 PolarHBondContact O-N 3.27Å; L597-K860 HydrophobicContact CD1-CB 4.19Å; L597-L861 HydrophobicContact CD1-CB 4.14Å; L597-L861 HydrophobicContact CD1-CD1 4.13Å; L597-L861 HydrophobicContact CD2-CD1 4.4Å; L597-L861 HydrophobicContact CG-CD1 3.93Å; L597-H864 HydrophobicContact CD2-CB 3.68Å
598	T	91.8	Very high	87.2	Confident	24 Å²	24	63 Å²	63	15%	0.147	32%	0.323	C	S	.	.	B	Isolated β-bridge	trans	-118.4	171	173.9	63.5	0	0	0	0	112	S600 D601 T817	T598-S600 PolarHBondContact O-N 3.05Å; T598-S600 PolarHBondContact OG1-OG 3.15Å; T598-D601 PolarHBondContact N-OD2 3.43Å; T598-D601 PolarHBondContact O-N 3.06Å; T598-D601 VanDerWaalsContact O-N 3.12Å; T598-D601 PolarHBondContact OG1-OD1 2.68Å; T598-D601 PolarHBondContact OG1-OD2 2.98Å; T598-T817 CarbonylContact C-O 3.51Å; T598-T817 WeakPolarHBondContact CA-O 3.41Å
599	A	90.8	Very high	87.6	Confident	0 Å²	0	59.6 Å²	59.6	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-57	-34.5	175.5	0	0	0	0	0	112.7	D601 I602 M603 V813 P815 T817 V822 V836 I847	A599-D601 VanDerWaalsContact C-N 3.26Å; A599-D601 PolarHBondContact O-N 3.15Å; A599-I602 WeakPolarHBondContact O-CG1 3.43Å; A599-I602 PolarHBondContact O-N 3.02Å; A599-M603 WeakPolarHBondContact O-CB 3.45Å; A599-M603 PolarHBondContact O-N 3.27Å; A599-M603 VanDerWaalsContact O-N 3.08Å; A599-V813 HydrophobicContact CB-CG2 4.38Å; A599-P815 PolarHBondContact N-O 2.76Å; A599-T817 PolarHBondContact N-O 3.36Å; A599-V822 HydrophobicContact CB-CG2 4.06Å; A599-V836 HydrophobicContact CB-CG2 4.48Å; A599-I847 HydrophobicContact CB-CD1 3.97Å
600	S	90	Very high	88	Confident	44 Å²	44	52.3 Å²	52.3	31%	0.308	28%	0.276	S	S	.	.	H	α-helix	trans	-64.1	-28.3	177	54.7	0	0	0	0	113.8	T598 P815	T598-S600 PolarHBondContact O-N 3.05Å; T598-S600 PolarHBondContact OG1-OG 3.15Å; S600-P815 PolarHBondContact N-O 2.95Å
601	D	90.3	Very high	88.3	Confident	53 Å²	53	54.3 Å²	54.3	28%	0.283	28%	0.281	S	S	.	.	H	α-helix	trans	-78.7	-25	-175.5	-54.8	-26.2	0	0	0	112.2	L597 T598 A599 K860 H864	L597-D601 HydrophobicContact CD2-CB 4.22Å; T598-D601 PolarHBondContact N-OD2 3.43Å; T598-D601 PolarHBondContact O-N 3.06Å; T598-D601 VanDerWaalsContact O-N 3.12Å; T598-D601 PolarHBondContact OG1-OD1 2.68Å; T598-D601 PolarHBondContact OG1-OD2 2.98Å; A599-D601 VanDerWaalsContact C-N 3.26Å; A599-D601 PolarHBondContact O-N 3.15Å; D601-K860 WeakPolarHBondContact O-CD 3.42Å; D601-K860 WeakPolarHBondContact O-CE 3.45Å; D601-H864 IonicContact OD2-CD2 3.77Å
602	I	91.9	Very high	88.4	Confident	1 Å²	1	51 Å²	51	1%	0.005	27%	0.267	C	S	.	.	H	α-helix	trans	-109.5	-19	-173.4	61.3	163	0	0	0	114.5	A599 I819 I847 N851 L852 F856 L857 K860	A599-I602 WeakPolarHBondContact O-CG1 3.43Å; A599-I602 PolarHBondContact O-N 3.02Å; I602-I819 HydrophobicContact CD1-CD1 4.05Å; I602-I819 HydrophobicContact CD1-CG1 4.26Å; I602-I819 HydrophobicContact CG1-CD1 4.42Å; I602-I819 HydrophobicContact CG2-CD1 3.55Å; I602-I847 HydrophobicContact CD1-CD1 3.94Å; I602-I847 HydrophobicContact CD1-CG1 4.43Å; I602-I847 HydrophobicContact CD1-CG2 4.28Å; I602-I847 HydrophobicContact CG1-CD1 4.06Å; I602-I847 HydrophobicContact CG1-CG1 4.39Å; I602-N851 PolarHBondContact O-ND2 3.44Å; I602-L852 HydrophobicContact CD1-CD2 3.71Å; I602-F856 HydrophobicContact CB-CE1 4.17Å; I602-F856 HydrophobicContact CG2-CE1 4.32Å; I602-L857 HydrophobicContact CG2-CD2 3.91Å; I602-K860 HydrophobicContact CG2-CG 4.4Å
603	M	90.6	Very high	88.7	Confident	26 Å²	26	48.5 Å²	48.5	13%	0.128	25%	0.247	C	C	.	.	S	Bend	trans	-67.2	151.8	-178.1	69.2	-176.2	-177.6	0	0	112	A599 P605 V836 V844 I847	A599-M603 WeakPolarHBondContact O-CB 3.45Å; A599-M603 PolarHBondContact O-N 3.27Å; A599-M603 VanDerWaalsContact O-N 3.08Å; M603-P605 WeakPolarHBondContact O-CD 3.33Å; M603-V836 HydrophobicContact CB-CG2 3.9Å; M603-V836 HydrophobicContact SD-CB 3.76Å; M603-V836 HydrophobicContact SD-CG1 3.74Å; M603-V836 HydrophobicContact SD-CG2 3.96Å; M603-V844 HydrophobicContact CE-CB 4.1Å; M603-V844 HydrophobicContact CE-CG1 3.55Å; M603-V844 HydrophobicContact SD-CB 4.33Å; M603-V844 HydrophobicContact SD-CG1 4.42Å; M603-I847 HydrophobicContact CB-CD1 4.42Å; M603-I847 HydrophobicContact CB-CG1 3.79Å
604	E	89.3	Confident	88.8	Confident	84 Å²	84	43.7 Å²	43.7	39%	0.393	23%	0.225	S	C	.	.	B	Isolated β-bridge	trans	-82.9	115.5	168.6	-170.3	61.5	-132.6	0	0	109.1	G845 I846	E604-G845 WeakPolarHBondContact O-CA 3.34Å; E604-I846 PolarHBondContact N-O 3.31Å; E604-I846 PolarHBondContact O-N 3.35Å
605	P	84.6	Confident	89	Confident	75 Å²	75	46 Å²	46	49%	0.487	23%	0.233	S	C	.	.			trans	-83	-24.7	-176.2	32.5	-35	0	0	0	113.1	M603 L607	M603-P605 WeakPolarHBondContact O-CD 3.33Å; P605-L607 PolarHBondContact O-N 3.02Å; P605-L607 VanDerWaalsContact O-N 3.1Å
606	N	85.9	Confident	89.1	Confident	124 Å²	124	43.6 Å²	43.6	66%	0.663	22%	0.221	S	C	*	.			trans	-84.5	88.2	-177.2	-68.4	-36.2	0	0	0	110.5
607	L	85.6	Confident	89.2	Confident	36 Å²	36	44.5 Å²	44.5	19%	0.188	23%	0.227	C	C	.	.			trans	-91	129.8	-174.3	-60.4	175.6	0	0	0	112.5	P605 Y609 I843 I846	P605-L607 PolarHBondContact O-N 3.02Å; P605-L607 VanDerWaalsContact O-N 3.1Å; L607-Y609 WeakPolarHBondContact O-CD1 3.27Å; L607-I843 HydrophobicContact CD1-CB 4.31Å; L607-I843 HydrophobicContact CD1-CD1 3.81Å; L607-I843 HydrophobicContact CD1-CG1 3.64Å; L607-I843 HydrophobicContact CD1-CG2 3.91Å; L607-I846 HydrophobicContact CD2-CB 3.99Å; L607-I846 HydrophobicContact CD2-CD1 3.88Å; L607-I846 HydrophobicContact CD2-CG1 3.67Å
608	T	89.4	Confident	89.1	Confident	48 Å²	48	47 Å²	47	29%	0.294	25%	0.245	S	C	.	.			trans	-91.3	122.7	160.6	56	0	0	0	0	108.9	T626 Y628 P632	T608-T626 HydrophobicContact CG2-CG2 4.03Å; T608-Y628 HydrophobicContact CG2-CD2 4.24Å; T608-Y628 HydrophobicContact CG2-CE2 3.91Å; T608-Y628 WeakPolarHBondContact OG1-CD2 3.33Å; T608-P632 WeakPolarHBondContact O-CD 3.41Å
609	Y	89.2	Confident	89.1	Confident	62 Å²	62	46 Å²	46	24%	0.243	24%	0.238	C	C	.	.			trans	-127.3	166.3	-172.6	55.5	-97.4	0	0	0	112.1	L607 Y611 P632 V634 L738	L607-Y609 WeakPolarHBondContact O-CD1 3.27Å; Y609-Y611 HydrophobicContact CE2-CE1 4.17Å; Y609-Y611 HydrophobicContact CE2-CE2 4.06Å; Y609-Y611 AromaticContact CE2-CZ 3.65Å; Y609-Y611 WeakPolarHBondContact CE2-OH 3.19Å; Y609-P632 WeakPolarHBondContact CA-O 3.37Å; Y609-P632 WeakPolarHBondContact CB-O 3.5Å; Y609-V634 HydrophobicContact CD1-CG2 4.49Å; Y609-V634 HydrophobicContact CD2-CG2 3.2Å; Y609-V634 HydrophobicContact CE2-CG2 3.87Å; Y609-V634 HydrophobicContact CG-CG2 3.56Å; Y609-L738 HydrophobicContact CD1-CD1 3.67Å; Y609-L738 HydrophobicContact CE1-CD1 3.45Å; Y609-L738 VanDerWaalsContact CE1-CD1 3.45Å; Y609-L738 HydrophobicContact CE1-CD2 4.38Å; Y609-L738 HydrophobicContact CE2-CD2 4.14Å; Y609-L738 HydrophobicContact CG-CD1 4.32Å
610	V	90.8	Very high	89	Confident	1 Å²	1	46.6 Å²	46.6	1%	0.006	24%	0.242	C	C	.	.	B	Isolated β-bridge	trans	-125.1	146.8	-179.8	175	0	0	0	0	109.1	T614 L619 I622 F631 P632 V633 V634 V802	V610-T614 WeakPolarHBondContact CG1-OG1 3.45Å; V610-L619 HydrophobicContact CG1-CD2 3.76Å; V610-L619 HydrophobicContact CG2-CD2 4.16Å; V610-I622 HydrophobicContact CG2-CD1 4.4Å; V610-F631 HydrophobicContact CB-CB 4.48Å; V610-F631 HydrophobicContact CG2-CB 3.76Å; V610-F631 HydrophobicContact CG2-CG 4.12Å; V610-P632 PolarHBondContact N-O 3.48Å; V610-V633 VanDerWaalsContact O-CA 3.26Å; V610-V633 WeakPolarHBondContact O-CA 3.14Å; V610-V634 PolarHBondContact O-N 3.48Å; V610-V802 HydrophobicContact CG1-CG2 4.28Å
611	Y	89.9	Confident	89	Confident	73 Å²	73	47.7 Å²	47.7	29%	0.286	25%	0.249	S	C	.	.			trans	-90.3	152.3	174.2	-66.1	-72	0	0	0	110.8	Y609 H613 T614 V634 E636	Y609-Y611 HydrophobicContact CE2-CE1 4.17Å; Y609-Y611 HydrophobicContact CE2-CE2 4.06Å; Y609-Y611 AromaticContact CE2-CZ 3.65Å; Y609-Y611 WeakPolarHBondContact CE2-OH 3.19Å; Y611-H613 PolarHBondContact O-N 2.9Å; Y611-H613 VanDerWaalsContact O-N 3.16Å; Y611-T614 PolarHBondContact N-OG1 3.49Å; Y611-T614 PolarHBondContact O-OG1 3.42Å; Y611-V634 VanDerWaalsContact CD1-O 3.23Å; Y611-V634 WeakPolarHBondContact CD1-O 3.47Å; Y611-V634 HydrophobicContact CE1-CG2 4.44Å; Y611-E636 HydrophobicContact CE1-CG 4.13Å; Y611-E636 PolarHBondContact OH-OE1 3.47Å
612	P	87.6	Confident	89	Confident	19 Å²	19	47.1 Å²	47.1	12%	0.123	25%	0.246	C	C	.	.	S	Bend	trans	-49.8	-41.6	176.2	-29.7	34.5	0	0	0	113.3	V633 V634 T635 D801 V802	P612-V633 HydrophobicContact CB-CG1 4.49Å; P612-V633 HydrophobicContact CG-CG1 3.87Å; P612-V634 VanDerWaalsContact CD-O 3.28Å; P612-V634 WeakPolarHBondContact CD-O 3.26Å; P612-T635 HydrophobicContact CG-CG2 3.75Å; P612-D801 WeakPolarHBondContact O-CA 3.06Å; P612-V802 PolarHBondContact O-N 3.42Å
613	H	88.8	Confident	88.8	Confident	76 Å²	76	47.1 Å²	47.1	35%	0.352	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	107.4	173.9	-57	-76.7	0	0	0	108.5	Y611 Y759 I799 D801	Y611-H613 PolarHBondContact O-N 2.9Å; Y611-H613 VanDerWaalsContact O-N 3.16Å; H613-Y759 PolarHBondContact ND1-OH 3.35Å; H613-I799 HydrophobicContact CB-CG2 3.98Å; H613-D801 VanDerWaalsContact CE1-CG 3.45Å; H613-D801 IonicContact CE1-OD1 3.98Å; H613-D801 IonicContact CE1-OD2 2.78Å; H613-D801 PolarHBondContact CE1-OD2 3.45Å; H613-D801 IonicContact ND1-OD1 3.7Å; H613-D801 IonicContact ND1-OD2 3.38Å
614	T	86.8	Confident	88.7	Confident	10 Å²	10	51.2 Å²	51.2	6%	0.061	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	137.9	-177.6	-55.7	0	0	0	0	110.8	V610 Y611 L619 V800	V610-T614 WeakPolarHBondContact CG1-OG1 3.45Å; Y611-T614 PolarHBondContact N-OG1 3.49Å; Y611-T614 PolarHBondContact O-OG1 3.42Å; T614-L619 HydrophobicContact CG2-CD2 3.86Å; T614-L619 HydrophobicContact CG2-CG 3.73Å; T614-V800 PolarHBondContact N-O 2.98Å; T614-V800 VanDerWaalsContact N-O 3.11Å; T614-V800 PolarHBondContact O-N 2.84Å
615	R	90	Very high	88.6	Confident	52 Å²	52	52.1 Å²	52.1	20%	0.196	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.3	142.7	172.5	-78.8	176.9	172.5	168.4	3.7	111	Q617 S618 L619 Y720 E761 M798 I799	R615-Q617 VanDerWaalsContact C-N 3.26Å; R615-Q617 PolarHBondContact O-N 3.45Å; R615-S618 PolarHBondContact O-N 2.99Å; R615-S618 VanDerWaalsContact O-N 3.11Å; R615-L619 PolarHBondContact O-N 2.96Å; R615-L619 VanDerWaalsContact O-N 3.12Å; R615-Y720 HydrophobicContact CG-CE1 3.56Å; R615-Y720 WeakPolarHBondContact CG-OH 3.17Å; R615-Y720 PolarHBondContact NE-OH 3.06Å; R615-E761 IonicContact CZ-OE1 3.71Å; R615-E761 VanDerWaalsContact CZ-OE1 3.22Å; R615-E761 IonicContact NE-OE1 3.96Å; R615-E761 PolarHBondContact NE-OE1 3.08Å; R615-E761 IonicContact NH2-OE1 2.77Å; R615-E761 PolarHBondContact NH2-OE1 2.88Å; R615-E761 IonicContact NH2-OE2 2.81Å; R615-M798 WeakPolarHBondContact CA-O 2.99Å; R615-I799 HydrophobicContact CG-CG1 4.43Å
616	V	89.8	Confident	88.8	Confident	3 Å²	3	49.5 Å²	49.5	2%	0.018	25%	0.254	C	S	.	.	H	α-helix	trans	-55.8	-42	176.7	169.8	0	0	0	0	111.3	S618 L619 V620 L753 C758 L794 M798 V800	V616-S618 VanDerWaalsContact C-N 3.33Å; V616-S618 PolarHBondContact O-N 3.38Å; V616-L619 PolarHBondContact O-N 3.06Å; V616-V620 HydrophobicContact CG1-CG2 4.12Å; V616-V620 WeakPolarHBondContact O-CB 3.31Å; V616-V620 VanDerWaalsContact O-CG2 3.31Å; V616-V620 WeakPolarHBondContact O-CG2 3.24Å; V616-V620 PolarHBondContact O-N 3.44Å; V616-L753 HydrophobicContact CG1-CD2 4.03Å; V616-L753 HydrophobicContact CG2-CD2 4.24Å; V616-C758 HydrophobicContact CG2-CB 4.35Å; V616-L794 HydrophobicContact CG1-CB 4.31Å; V616-L794 HydrophobicContact CG1-CD2 4.07Å; V616-M798 HydrophobicContact CG2-CB 4.25Å; V616-M798 WeakPolarHBondContact CG2-O 3.49Å; V616-M798 PolarHBondContact N-O 3.17Å; V616-V800 HydrophobicContact CG2-CG2 3.71Å
617	Q	89.3	Confident	88.7	Confident	123 Å²	123	49.4 Å²	49.4	58%	0.575	26%	0.257	S	S	*	.	H	α-helix	trans	-57.1	-44	177.8	-177.2	177	-9	0	0	112.8	R615 S621 P796	R615-Q617 VanDerWaalsContact C-N 3.26Å; R615-Q617 PolarHBondContact O-N 3.45Å; Q617-S621 WeakPolarHBondContact O-CB 3.5Å; Q617-S621 PolarHBondContact O-N 3.05Å; Q617-P796 HydrophobicContact CB-CB 3.99Å; Q617-P796 PolarHBondContact N-O 2.94Å
618	S	89.7	Confident	88.8	Confident	54 Å²	54	53.5 Å²	53.5	38%	0.378	27%	0.271	S	S	.	.	H	α-helix	trans	-67.8	-42.7	179.4	-55.1	0	0	0	0	111.3	R615 V616 S621 I622	R615-S618 PolarHBondContact O-N 2.99Å; R615-S618 VanDerWaalsContact O-N 3.11Å; V616-S618 VanDerWaalsContact C-N 3.33Å; V616-S618 PolarHBondContact O-N 3.38Å; S618-S621 WeakPolarHBondContact O-CB 3.31Å; S618-S621 PolarHBondContact O-N 3.29Å; S618-I622 VanDerWaalsContact O-CG1 3.29Å; S618-I622 WeakPolarHBondContact O-CG1 3.47Å; S618-I622 PolarHBondContact O-N 3.32Å
619	L	89.9	Confident	88.8	Confident	2 Å²	2	54 Å²	54	1%	0.01	27%	0.27	C	S	.	.	H	α-helix	trans	-61.6	-46.8	175.8	-71.8	176.7	0	0	0	111.9	V610 T614 R615 V616 S621 I622 L623 L749 V800	V610-L619 HydrophobicContact CG1-CD2 3.76Å; V610-L619 HydrophobicContact CG2-CD2 4.16Å; T614-L619 HydrophobicContact CG2-CD2 3.86Å; T614-L619 HydrophobicContact CG2-CG 3.73Å; R615-L619 PolarHBondContact O-N 2.96Å; R615-L619 VanDerWaalsContact O-N 3.12Å; V616-L619 PolarHBondContact O-N 3.06Å; L619-S621 VanDerWaalsContact C-N 3.29Å; L619-S621 PolarHBondContact O-N 3.32Å; L619-I622 PolarHBondContact O-N 3.26Å; L619-L623 WeakPolarHBondContact O-CB 3.5Å; L619-L623 WeakPolarHBondContact O-CG 3.42Å; L619-L623 PolarHBondContact O-N 3.28Å; L619-L749 HydrophobicContact CD1-CD2 4.45Å; L619-L749 HydrophobicContact CD2-CD2 4.15Å; L619-V800 HydrophobicContact CD1-CB 3.88Å; L619-V800 HydrophobicContact CD1-CG1 4.33Å; L619-V800 HydrophobicContact CD1-CG2 4Å
620	V	89.8	Confident	88.9	Confident	13 Å²	13	51.5 Å²	51.5	8%	0.079	26%	0.262	C	S	.	.	H	α-helix	trans	-61.3	-40.5	177.1	170.5	0	0	0	0	110.8	V616 L623 R624 L753 L791	V616-V620 HydrophobicContact CG1-CG2 4.12Å; V616-V620 WeakPolarHBondContact O-CB 3.31Å; V616-V620 VanDerWaalsContact O-CG2 3.31Å; V616-V620 WeakPolarHBondContact O-CG2 3.24Å; V616-V620 PolarHBondContact O-N 3.44Å; V620-L623 PolarHBondContact O-N 3.1Å; V620-R624 HydrophobicContact CG1-CG 4.48Å; V620-R624 WeakPolarHBondContact O-CB 3.36Å; V620-R624 WeakPolarHBondContact O-CG 3.31Å; V620-R624 PolarHBondContact O-N 3.15Å; V620-L753 HydrophobicContact CG2-CD1 4.1Å; V620-L791 HydrophobicContact CB-CD2 4.38Å; V620-L791 HydrophobicContact CG1-CD1 4.16Å; V620-L791 HydrophobicContact CG1-CD2 3.69Å; V620-L791 HydrophobicContact CG2-CD2 3.77Å
621	S	89.7	Confident	89	Confident	67 Å²	67	51.4 Å²	51.4	47%	0.469	26%	0.262	S	S	.	.	H	α-helix	trans	-60.7	-52.4	175.3	-178.1	0	0	0	0	111.2	Q617 S618 L619 L623 R624 T625	Q617-S621 WeakPolarHBondContact O-CB 3.5Å; Q617-S621 PolarHBondContact O-N 3.05Å; S618-S621 WeakPolarHBondContact O-CB 3.31Å; S618-S621 PolarHBondContact O-N 3.29Å; L619-S621 VanDerWaalsContact C-N 3.29Å; L619-S621 PolarHBondContact O-N 3.32Å; S621-L623 VanDerWaalsContact C-N 3.34Å; S621-L623 PolarHBondContact O-N 2.91Å; S621-R624 PolarHBondContact O-N 2.7Å; S621-T625 WeakPolarHBondContact O-CG2 3.37Å; S621-T625 PolarHBondContact O-N 2.86Å; S621-T625 PolarHBondContact O-OG1 3.25Å
622	I	89.7	Confident	89.1	Confident	40 Å²	40	48 Å²	48	21%	0.205	25%	0.249	C	C	.	.	H	α-helix	trans	-57.4	-46.5	178.1	-67.3	164.4	0	0	0	110.9	V610 S618 L619 R624 T625 T626 F631	V610-I622 HydrophobicContact CG2-CD1 4.4Å; S618-I622 VanDerWaalsContact O-CG1 3.29Å; S618-I622 WeakPolarHBondContact O-CG1 3.47Å; S618-I622 PolarHBondContact O-N 3.32Å; L619-I622 PolarHBondContact O-N 3.26Å; I622-R624 VanDerWaalsContact C-N 3.31Å; I622-R624 PolarHBondContact O-N 2.69Å; I622-T625 PolarHBondContact O-N 3.02Å; I622-T625 PolarHBondContact O-OG1 3.36Å; I622-T626 HydrophobicContact CG2-CG2 4.43Å; I622-T626 WeakPolarHBondContact O-CB 3.16Å; I622-T626 WeakPolarHBondContact O-CG2 3.27Å; I622-T626 PolarHBondContact O-N 3.35Å; I622-T626 PolarHBondContact O-OG1 2.92Å; I622-F631 HydrophobicContact CG2-CD1 4.15Å; I622-F631 HydrophobicContact CG2-CE1 3.62Å; I622-F631 HydrophobicContact CG2-CZ 4.01Å
623	L	89.5	Confident	89.3	Confident	1 Å²	1	47.1 Å²	47.1	1%	0.005	24%	0.243	C	C	.	.	H	α-helix	trans	-66.8	-31.6	-178.5	-68.8	171.6	0	0	0	112.5	L619 V620 S621 F631 R746 L749 V750 L753 I786	L619-L623 WeakPolarHBondContact O-CB 3.5Å; L619-L623 WeakPolarHBondContact O-CG 3.42Å; L619-L623 PolarHBondContact O-N 3.28Å; V620-L623 PolarHBondContact O-N 3.1Å; S621-L623 VanDerWaalsContact C-N 3.34Å; S621-L623 PolarHBondContact O-N 2.91Å; L623-F631 HydrophobicContact CD2-CE2 3.96Å; L623-F631 HydrophobicContact CD2-CZ 4.3Å; L623-R746 HydrophobicContact CD2-CG 3.6Å; L623-R746 VanDerWaalsContact O-CZ 3.24Å; L623-R746 PolarHBondContact O-NH1 3.32Å; L623-R746 PolarHBondContact O-NH2 2.96Å; L623-L749 HydrophobicContact CD1-CB 4.24Å; L623-L749 HydrophobicContact CD2-CB 4.42Å; L623-L749 HydrophobicContact CD2-CD1 4.32Å; L623-V750 HydrophobicContact CD1-CG2 4.1Å; L623-V750 HydrophobicContact CD2-CG2 4.47Å; L623-L753 HydrophobicContact CD1-CD1 3.67Å; L623-I786 HydrophobicContact CB-CB 4.35Å; L623-I786 HydrophobicContact CB-CD1 4.3Å; L623-I786 HydrophobicContact CB-CG1 3.88Å; L623-I786 HydrophobicContact CD1-CD1 3.93Å; L623-I786 HydrophobicContact CD1-CG1 4.42Å
624	R	88.1	Confident	89.3	Confident	112 Å²	112	43.5 Å²	43.5	42%	0.423	23%	0.226	S	C	.	.	H	α-helix	trans	-82.5	-28.1	177.6	-75	-177.9	171	-166.9	-5.1	113.7	V620 S621 I622 I786 L791	V620-R624 HydrophobicContact CG1-CG 4.48Å; V620-R624 WeakPolarHBondContact O-CB 3.36Å; V620-R624 WeakPolarHBondContact O-CG 3.31Å; V620-R624 PolarHBondContact O-N 3.15Å; S621-R624 PolarHBondContact O-N 2.7Å; I622-R624 VanDerWaalsContact C-N 3.31Å; I622-R624 PolarHBondContact O-N 2.69Å; R624-I786 HydrophobicContact CG-CG1 4.13Å; R624-I786 HydrophobicContact CG-CG2 4.07Å; R624-L791 VanDerWaalsContact NH1-CD1 3.31Å
625	T	87.4	Confident	89.3	Confident	104 Å²	104	45.1 Å²	45.1	64%	0.638	24%	0.236	S	C	*	.	H	α-helix	trans	-88.3	-27.6	-179.7	56	0	0	0	0	112.9	S621 I622	S621-T625 WeakPolarHBondContact O-CG2 3.37Å; S621-T625 PolarHBondContact O-N 2.86Å; S621-T625 PolarHBondContact O-OG1 3.25Å; I622-T625 PolarHBondContact O-N 3.02Å; I622-T625 PolarHBondContact O-OG1 3.36Å
626	T	87.4	Confident	88.8	Confident	20 Å²	20	45.1 Å²	45.1	12%	0.123	24%	0.238	C	C	.	.			trans	-110.7	146.6	-174.9	68.8	0	0	0	0	112.9	T608 I622 Y628 F631 R746	T608-T626 HydrophobicContact CG2-CG2 4.03Å; I622-T626 HydrophobicContact CG2-CG2 4.43Å; I622-T626 WeakPolarHBondContact O-CB 3.16Å; I622-T626 WeakPolarHBondContact O-CG2 3.27Å; I622-T626 PolarHBondContact O-N 3.35Å; I622-T626 PolarHBondContact O-OG1 2.92Å; T626-Y628 HydrophobicContact CG2-CD2 4.13Å; T626-Y628 HydrophobicContact CG2-CE2 4.39Å; T626-F631 WeakPolarHBondContact OG1-CZ 3.4Å; T626-R746 PolarHBondContact O-NH1 3.47Å
627	V	84.6	Confident	87.6	Confident	121 Å²	121	46.7 Å²	46.7	73%	0.733	25%	0.247	S	C	*	.			trans	-97.1	-2.3	175	-166.2	0	0	0	0	111.4
628	Y	88.3	Confident	86	Confident	122 Å²	122	48.9 Å²	48.9	48%	0.478	25%	0.25	S	C	.	.			trans	-65.2	142.1	-176.9	-55	-50.6	0	0	0	112.4	T608 T626 F631 R746	T608-Y628 HydrophobicContact CG2-CD2 4.24Å; T608-Y628 HydrophobicContact CG2-CE2 3.91Å; T608-Y628 WeakPolarHBondContact OG1-CD2 3.33Å; T626-Y628 HydrophobicContact CG2-CD2 4.13Å; T626-Y628 HydrophobicContact CG2-CE2 4.39Å; Y628-F631 WeakPolarHBondContact O-CZ 3.32Å; Y628-R746 WeakPolarHBondContact O-CD 3.48Å
629	H	88.8	Confident	84.2	Confident	59 Å²	59	53.4 Å²	53.4	27%	0.273	27%	0.265	S	S	.	.	S	Bend	trans	-98.1	-6	-176.6	-70.6	-88.2	0	0	0	114.4	E45 L745 R746 R832	E45-H629 IonicContact OE1-CE1 3.63Å; E45-H629 PolarHBondContact OE1-CE1 3.35Å; E45-H629 VanDerWaalsContact OE1-CE1 3.31Å; E45-H629 IonicContact OE1-NE2 3.8Å; H629-L745 CarbonylContact O-C 3.58Å; H629-L745 WeakPolarHBondContact O-CA 3.33Å; H629-R746 WeakPolarHBondContact O-CB 3.42Å; H629-R746 PolarHBondContact O-N 3.49Å; H629-R832 PolarHBondContact CD2-NH2 3.41Å; H629-R832 PolarHBondContact ND1-NH2 2.88Å
630	A	91	Very high	82.2	Confident	9 Å²	9	54.6 Å²	54.6	7%	0.074	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	149.4	172.5	0	0	0	0	0	110.6	I744 L745 H833	A630-I744 CarbonylContact C-O 3.55Å; A630-I744 VanDerWaalsContact CA-O 3.26Å; A630-I744 WeakPolarHBondContact CA-O 3.28Å; A630-L745 HydrophobicContact CB-CD2 3.99Å; A630-H833 WeakPolarHBondContact CB-CE1 3.4Å; A630-H833 WeakPolarHBondContact CB-ND1 3.36Å
631	F	92.9	Very high	80	Confident	0 Å²	0	57.5 Å²	57.5	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	129.5	-179.5	-56.1	-82.9	0	0	0	109.3	V610 I622 L623 T626 Y628 I744 R746 L749	V610-F631 HydrophobicContact CB-CB 4.48Å; V610-F631 HydrophobicContact CG2-CB 3.76Å; V610-F631 HydrophobicContact CG2-CG 4.12Å; I622-F631 HydrophobicContact CG2-CD1 4.15Å; I622-F631 HydrophobicContact CG2-CE1 3.62Å; I622-F631 HydrophobicContact CG2-CZ 4.01Å; L623-F631 HydrophobicContact CD2-CE2 3.96Å; L623-F631 HydrophobicContact CD2-CZ 4.3Å; T626-F631 WeakPolarHBondContact OG1-CZ 3.4Å; Y628-F631 WeakPolarHBondContact O-CZ 3.32Å; F631-I744 HydrophobicContact CB-CG2 4.25Å; F631-I744 PolarHBondContact N-O 3.25Å; F631-I744 PolarHBondContact O-N 3Å; F631-R746 HydrophobicContact CE2-CB 4.05Å; F631-R746 HydrophobicContact CE2-CG 4.32Å; F631-L749 HydrophobicContact CD2-CD1 3.65Å; F631-L749 HydrophobicContact CE2-CD1 4.05Å
632	P	92.8	Very high	77.9	Confident	1 Å²	1	63.2 Å²	63.2	1%	0.006	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	134.6	169.2	29	-33	0	0	0	110.3	T608 Y609 V610 V634 F740 G742 L743 I843 I846	T608-P632 WeakPolarHBondContact O-CD 3.41Å; Y609-P632 WeakPolarHBondContact CA-O 3.37Å; Y609-P632 WeakPolarHBondContact CB-O 3.5Å; V610-P632 PolarHBondContact N-O 3.48Å; P632-V634 HydrophobicContact CB-CG1 4.27Å; P632-F740 HydrophobicContact CB-CD2 4.11Å; P632-F740 HydrophobicContact CB-CE2 3.81Å; P632-G742 WeakPolarHBondContact CA-O 3.48Å; P632-L743 HydrophobicContact CB-CD2 4.19Å; P632-I843 HydrophobicContact CB-CD1 3.47Å; P632-I843 VanDerWaalsContact CB-CD1 3.47Å; P632-I843 HydrophobicContact CG-CD1 3.87Å; P632-I846 HydrophobicContact CB-CD1 4.41Å; P632-I846 HydrophobicContact CG-CD1 3.98Å
633	V	91.1	Very high	75.7	Confident	0 Å²	0	64.3 Å²	64.3	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	120.1	172.3	-175.9	0	0	0	0	107.9	V610 P612 H741 G742 I744 V802 M806	V610-V633 VanDerWaalsContact O-CA 3.26Å; V610-V633 WeakPolarHBondContact O-CA 3.14Å; P612-V633 HydrophobicContact CB-CG1 4.49Å; P612-V633 HydrophobicContact CG-CG1 3.87Å; V633-H741 PolarHBondContact O-N 3.2Å; V633-G742 PolarHBondContact N-O 3.42Å; V633-I744 HydrophobicContact CG2-CB 4.28Å; V633-I744 HydrophobicContact CG2-CG2 3.91Å; V633-V802 HydrophobicContact CG2-CG1 4.32Å; V633-M806 HydrophobicContact CB-SD 3.7Å; V633-M806 HydrophobicContact CG1-SD 3.79Å; V633-M806 HydrophobicContact CG2-CB 4.13Å; V633-M806 HydrophobicContact CG2-SD 3.8Å
634	V	89	Confident	73.5	Confident	0 Å²	0	72.2 Å²	72.2	0%	0	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	158.2	-172.6	-57.9	0	0	0	0	111.5	Y609 V610 Y611 P612 P632 L738 T739 I843	Y609-V634 HydrophobicContact CD1-CG2 4.49Å; Y609-V634 HydrophobicContact CD2-CG2 3.2Å; Y609-V634 HydrophobicContact CE2-CG2 3.87Å; Y609-V634 HydrophobicContact CG-CG2 3.56Å; V610-V634 PolarHBondContact O-N 3.48Å; Y611-V634 VanDerWaalsContact CD1-O 3.23Å; Y611-V634 WeakPolarHBondContact CD1-O 3.47Å; Y611-V634 HydrophobicContact CE1-CG2 4.44Å; P612-V634 VanDerWaalsContact CD-O 3.28Å; P612-V634 WeakPolarHBondContact CD-O 3.26Å; P632-V634 HydrophobicContact CB-CG1 4.27Å; V634-L738 HydrophobicContact CB-CB 4.13Å; V634-L738 HydrophobicContact CB-CD2 4.49Å; V634-L738 HydrophobicContact CG1-CB 4.24Å; V634-L738 HydrophobicContact CG2-CB 4.37Å; V634-L738 HydrophobicContact CG2-CD2 3.93Å; V634-L738 HydrophobicContact CG2-CG 4.5Å; V634-T739 CarbonylContact C-O 3.54Å; V634-T739 WeakPolarHBondContact CA-O 3.38Å; V634-I843 HydrophobicContact CG1-CG2 3.77Å
635	T	86	Confident	71.3	Confident	45 Å²	45	74.2 Å²	74.2	28%	0.276	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	144.9	165.4	53.4	0	0	0	0	109.6	P612 T739 H741	P612-T635 HydrophobicContact CG-CG2 3.75Å; T635-T739 PolarHBondContact N-O 3.45Å; T635-T739 PolarHBondContact O-N 3.38Å; T635-T739 PolarHBondContact O-OG1 3.31Å; T635-T739 PolarHBondContact OG1-OG1 3.07Å; T635-H741 WeakPolarHBondContact CG2-NE2 3.34Å; T635-H741 PolarHBondContact OG1-NE2 2.86Å
636	E	79.2	Confident	69	Low	51 Å²	51	76.3 Å²	76.3	24%	0.238	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	127.5	172	-70.5	-174.8	164	0	0	109.5	Y611 R736 L738	Y611-E636 HydrophobicContact CE1-CG 4.13Å; Y611-E636 PolarHBondContact OH-OE1 3.47Å; E636-R736 WeakPolarHBondContact OE1-CD 3.24Å; E636-R736 IonicContact OE1-CZ 2.7Å; E636-R736 IonicContact OE1-NE 3.99Å; E636-R736 IonicContact OE1-NH1 3.91Å; E636-R736 PolarHBondContact OE1-NH1 2.95Å; E636-L738 HydrophobicContact CG-CD2 4.18Å
637	N	65.1	Low	66.5	Low	37 Å²	37	78.5 Å²	78.5	20%	0.198	38%	0.379	C	S	.	.			trans	-105.8	84.6	176.1	-170.8	-1.5	0	0	0	111.4	Q639 N640 P737 T739	N637-Q639 PolarHBondContact O-N 3.49Å; N637-Q639 PolarHBondContact OD1-N 3.02Å; N637-N640 PolarHBondContact ND2-ND2 2.68Å; N637-N640 PolarHBondContact ND2-OD1 2.72Å; N637-N640 PolarHBondContact O-N 3.38Å; N637-N640 PolarHBondContact OD1-N 2.99Å; N637-P737 PolarHBondContact N-O 3.38Å; N637-T739 HydrophobicContact CB-CG2 3.62Å
638	R	56.4	Low	64.1	Low	169 Å²	169	78.3 Å²	78.3	64%	0.638	37%	0.374	S	S	*	.	H	α-helix	trans	-64.4	-16.1	177.5	-72.5	-176	170.5	-175.1	-4.7	114.4
639	Q	50.7	Low	61.8	Low	148 Å²	148	80.2 Å²	80.2	69%	0.692	39%	0.391	S	S	*	.	H	α-helix	trans	-77.7	-42.8	178.8	-81.6	168	-25.7	0	0	111.7	N637 E641 R642 D643	N637-Q639 PolarHBondContact O-N 3.49Å; N637-Q639 PolarHBondContact OD1-N 3.02Å; Q639-E641 VanDerWaalsContact C-N 3.3Å; Q639-E641 PolarHBondContact O-N 2.91Å; Q639-R642 PolarHBondContact O-N 3.45Å; Q639-D643 PolarHBondContact O-N 3.22Å
640	N	48.9	Very low	59.5	Low	27 Å²	27	80.2 Å²	80.2	14%	0.144	39%	0.392	C	S	.	.	H	α-helix	trans	-63.6	-34.5	174.7	-81.4	5	0	0	0	112.6	N637 R642 D643 F644 L650 V840	N637-N640 PolarHBondContact ND2-ND2 2.68Å; N637-N640 PolarHBondContact ND2-OD1 2.72Å; N637-N640 PolarHBondContact O-N 3.38Å; N637-N640 PolarHBondContact OD1-N 2.99Å; N640-R642 VanDerWaalsContact C-N 3.28Å; N640-R642 PolarHBondContact O-N 3.24Å; N640-D643 PolarHBondContact O-N 2.86Å; N640-F644 WeakPolarHBondContact O-CB 3.35Å; N640-F644 PolarHBondContact O-N 3.15Å; N640-L650 HydrophobicContact CB-CD1 4.29Å; N640-V840 WeakPolarHBondContact ND2-CG1 3.04Å
641	E	43.2	Very low	57.1	Low	75 Å²	75	86.6 Å²	86.6	35%	0.35	42%	0.424	S	S	.	.	H	α-helix	trans	-55.1	-43.2	173.6	-114.7	168.2	-164.9	0	0	112	Q639 M645 P737	Q639-E641 VanDerWaalsContact C-N 3.3Å; Q639-E641 PolarHBondContact O-N 2.91Å; E641-M645 WeakPolarHBondContact O-CB 3.35Å; E641-M645 WeakPolarHBondContact O-CG 3.25Å; E641-M645 PolarHBondContact O-N 3.43Å; E641-P737 HydrophobicContact CB-CG 4.41Å; E641-P737 HydrophobicContact CG-CG 3.86Å; E641-P737 WeakPolarHBondContact OE1-CD 3.37Å
642	R	45.7	Very low	54.6	Low	186 Å²	186	88.6 Å²	88.6	70%	0.702	44%	0.438	S	S	*	.	H	α-helix	trans	-74.4	-30.6	179.8	-68.5	-179.7	178.2	-174.9	-1	113.1	Q639 N640 K646	Q639-R642 PolarHBondContact O-N 3.45Å; N640-R642 VanDerWaalsContact C-N 3.28Å; N640-R642 PolarHBondContact O-N 3.24Å; R642-K646 WeakPolarHBondContact O-CG 3.42Å
643	D	44.3	Very low	51.9	Low	64 Å²	64	95.5 Å²	95.5	34%	0.342	47%	0.474	S	S	.	.	H	α-helix	trans	-84.7	-32.6	-180	-70.3	-23.7	0	0	0	112.3	Q639 N640 K646 L650	Q639-D643 PolarHBondContact O-N 3.22Å; N640-D643 PolarHBondContact O-N 2.86Å; D643-K646 PolarHBondContact O-N 3.34Å; D643-K646 VanDerWaalsContact O-N 3.15Å; D643-L650 HydrophobicContact CB-CD2 3.93Å
644	F	43.4	Very low	49.3	Very low	166 Å²	166	98.5 Å²	98.5	73%	0.728	49%	0.49	S	S	*	.	H	α-helix	trans	-65.1	-42.1	170.2	-168	-94.3	0	0	0	111.3	N640 K646 G647	N640-F644 WeakPolarHBondContact O-CB 3.35Å; N640-F644 PolarHBondContact O-N 3.15Å; F644-K646 PolarHBondContact O-N 3.45Å; F644-K646 VanDerWaalsContact O-N 3.13Å; F644-G647 PolarHBondContact O-N 2.99Å
645	M	40.7	Very low	47	Very low	154 Å²	154	104 Å²	104	76%	0.759	52%	0.519	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-17.2	171.6	-77.5	-73.7	-136.9	0	0	113.9	E641	E641-M645 WeakPolarHBondContact O-CB 3.35Å; E641-M645 WeakPolarHBondContact O-CG 3.25Å; E641-M645 PolarHBondContact O-N 3.43Å
646	K	39.5	Very low	44.5	Very low	149 Å²	149	112.3 Å²	112.3	65%	0.648	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.8	1.2	179.3	-75.1	175.5	-178.9	177.6	0	114.2	R642 D643 F644 N648	R642-K646 WeakPolarHBondContact O-CG 3.42Å; D643-K646 PolarHBondContact O-N 3.34Å; D643-K646 VanDerWaalsContact O-N 3.15Å; F644-K646 PolarHBondContact O-N 3.45Å; F644-K646 VanDerWaalsContact O-N 3.13Å; K646-N648 VanDerWaalsContact C-N 3.28Å; K646-N648 PolarHBondContact O-N 3.05Å
647	G	34.7	Very low	42.4	Very low	66 Å²	66	112.6 Å²	112.6	68%	0.68	55%	0.546	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.5	13.2	175.1	0	0	0	0	0	115.6	F644	F644-G647 PolarHBondContact O-N 2.99Å
648	N	34.9	Very low	40.8	Very low	116 Å²	116	118.1 Å²	118.1	62%	0.62	57%	0.568	S	S	*	*			trans	-88.6	126.8	177.5	-74.7	-23.2	0	0	0	110.6	K646 L650	K646-N648 VanDerWaalsContact C-N 3.28Å; K646-N648 PolarHBondContact O-N 3.05Å; N648-L650 PolarHBondContact O-N 2.76Å
649	I	38.7	Very low	39.8	Very low	163 Å²	163	118.8 Å²	118.8	84%	0.836	58%	0.575	S	S	*	*			trans	-61.6	109.2	175.4	-60.4	169.2	0	0	0	108.5	I651	I649-I651 PolarHBondContact O-N 3.35Å
650	L	42	Very low	39.2	Very low	58 Å²	58	115.2 Å²	115.2	30%	0.304	57%	0.567	S	S	.	*			trans	-70.1	99.7	178.4	-75.6	162.4	0	0	0	110.3	N640 D643 N648 S652	N640-L650 HydrophobicContact CB-CD1 4.29Å; D643-L650 HydrophobicContact CB-CD2 3.93Å; N648-L650 PolarHBondContact O-N 2.76Å; L650-S652 PolarHBondContact O-N 2.71Å
651	I	38.8	Very low	38.6	Very low	143 Å²	143	116.3 Å²	116.3	73%	0.733	57%	0.573	S	S	*	*			trans	-79.4	107.1	161.7	-63.2	171.5	0	0	0	106.8	I649 N653	I649-I651 PolarHBondContact O-N 3.35Å; I651-N653 PolarHBondContact O-N 3.07Å
652	S	40.7	Very low	38.3	Very low	42 Å²	42	119.4 Å²	119.4	29%	0.294	59%	0.59	S	S	.	*			trans	-70.2	123.4	-174.9	76.1	0	0	0	0	112.3	L650 N654	L650-S652 PolarHBondContact O-N 2.71Å; S652-N654 PolarHBondContact O-N 3.23Å
653	N	35.9	Very low	38.1	Very low	146 Å²	146	115.4 Å²	115.4	78%	0.781	59%	0.586	S	S	*	*			trans	-85.4	37.3	169.3	-87.8	-15.3	0	0	0	111.9	I651 I655	I651-N653 PolarHBondContact O-N 3.07Å; N653-I655 VanDerWaalsContact C-N 3.3Å; N653-I655 PolarHBondContact O-N 3.04Å
654	N	38.4	Very low	37.9	Very low	63 Å²	63	115.2 Å²	115.2	34%	0.337	59%	0.59	S	S	.	*			trans	-86	72.5	-179	-135.1	-24.5	0	0	0	110.1	S652 R656 F657 K658	S652-N654 PolarHBondContact O-N 3.23Å; N654-R656 PolarHBondContact O-N 3.05Å; N654-R656 VanDerWaalsContact O-N 3.09Å; N654-F657 HydrophobicContact CB-CB 4.44Å; N654-F657 PolarHBondContact O-N 3.31Å; N654-F657 VanDerWaalsContact O-N 3.14Å; N654-K658 WeakPolarHBondContact O-CB 3.4Å; N654-K658 PolarHBondContact O-N 3.08Å
655	I	38.7	Very low	37.5	Very low	115 Å²	115	117.6 Å²	117.6	59%	0.59	59%	0.594	S	S	*	*	H	α-helix	trans	-57.6	-26.1	-175.3	-63	170.2	0	0	0	111.9	N653 K659	N653-I655 VanDerWaalsContact C-N 3.3Å; N653-I655 PolarHBondContact O-N 3.04Å; I655-K659 HydrophobicContact CG2-CD 4.36Å; I655-K659 PolarHBondContact O-N 3.48Å
656	R	34.2	Very low	37.1	Very low	220 Å²	220	112.7 Å²	112.7	83%	0.83	58%	0.578	S	S	*	*	H	α-helix	trans	-73.7	-41.3	178.5	-138.4	176.3	-167.6	179.7	2.3	112.5	N654 S660	N654-R656 PolarHBondContact O-N 3.05Å; N654-R656 VanDerWaalsContact O-N 3.09Å; R656-S660 PolarHBondContact O-OG 3.02Å
657	F	35.1	Very low	37.1	Very low	58 Å²	58	107.3 Å²	107.3	25%	0.254	56%	0.561	S	S	.	*	H	α-helix	trans	-79.6	-34.6	177.1	-91	-84.8	0	0	0	113.1	N654 K659 S660 N661 F740	N654-F657 HydrophobicContact CB-CB 4.44Å; N654-F657 PolarHBondContact O-N 3.31Å; N654-F657 VanDerWaalsContact O-N 3.14Å; F657-K659 PolarHBondContact O-N 3.26Å; F657-S660 PolarHBondContact O-N 3.38Å; F657-N661 PolarHBondContact O-N 2.87Å; F657-F740 VanDerWaalsContact CZ-O 3.28Å; F657-F740 WeakPolarHBondContact CZ-O 3.32Å
658	K	32.1	Very low	37.5	Very low	153 Å²	153	109 Å²	109	67%	0.665	55%	0.552	S	S	*	*	H	α-helix	trans	-64.5	-22.3	177.4	-146.7	174.2	-172.1	175.3	0	112.6	N654	N654-K658 WeakPolarHBondContact O-CB 3.4Å; N654-K658 PolarHBondContact O-N 3.08Å
659	K	34.9	Very low	37.6	Very low	182 Å²	182	109 Å²	109	79%	0.791	55%	0.548	S	S	*	.	H	α-helix	trans	-97.6	-17.7	178.2	-77.3	-175.3	175.9	-179.5	0	115	I655 F657	I655-K659 HydrophobicContact CG2-CD 4.36Å; I655-K659 PolarHBondContact O-N 3.48Å; F657-K659 PolarHBondContact O-N 3.26Å
660	S	37.6	Very low	37.7	Very low	74 Å²	74	110 Å²	110	52%	0.517	54%	0.541	S	S	.	.	H	α-helix	trans	-112.7	-33.5	-170.1	58.2	0	0	0	0	116.9	R656 F657	R656-S660 PolarHBondContact O-OG 3.02Å; F657-S660 PolarHBondContact O-N 3.38Å
661	N	37.3	Very low	37.9	Very low	49 Å²	49	116 Å²	116	26%	0.262	56%	0.559	S	S	.	*	S	Bend	trans	-128.1	8.5	-158.2	-78	-1.1	0	0	0	118.3	F657	F657-N661 PolarHBondContact O-N 2.87Å
662	I	36.8	Very low	38.1	Very low	140 Å²	140	117 Å²	117	72%	0.718	55%	0.554	S	S	*	*			trans	-95.7	101.3	164.6	-56.1	173	0	0	0	106.7	S664	I662-S664 PolarHBondContact O-N 3.42Å
663	V	40.9	Very low	38.1	Very low	103 Å²	103	117.8 Å²	117.8	62%	0.624	56%	0.559	S	S	*	*			trans	-65	82.5	164.2	-178	0	0	0	0	106.6	E668	V663-E668 HydrophobicContact CG1-CB 4.23Å
664	S	39.9	Very low	38.4	Very low	59 Å²	59	117.1 Å²	117.1	41%	0.413	55%	0.551	S	S	.	*			trans	-64.2	147.6	163.5	67.6	0	0	0	0	107.3	I662 A666 A667 E668	I662-S664 PolarHBondContact O-N 3.42Å; S664-A666 PolarHBondContact O-N 2.86Å; S664-A667 PolarHBondContact O-N 3.48Å; S664-E668 PolarHBondContact O-N 2.88Å
665	R	36	Very low	38.5	Very low	217 Å²	217	118.3 Å²	118.3	82%	0.819	56%	0.564	S	S	*	*	H	α-helix	trans	-45.6	-26.4	174	-154.7	172.1	172.8	173	-2.3	112.9	Q669	R665-Q669 WeakPolarHBondContact O-CB 3.24Å; R665-Q669 PolarHBondContact O-N 3.46Å; R665-Q669 VanDerWaalsContact O-N 3.13Å
666	A	32.6	Very low	38.5	Very low	50 Å²	50	118.3 Å²	118.3	41%	0.413	56%	0.563	S	S	.	*	H	α-helix	trans	-72.7	-32.8	175.1	0	0	0	0	0	114.9	S664 R670	S664-A666 PolarHBondContact O-N 2.86Å; A666-R670 WeakPolarHBondContact O-CB 3.32Å; A666-R670 VanDerWaalsContact O-CG 3.27Å; A666-R670 WeakPolarHBondContact O-CG 3.4Å; A666-R670 PolarHBondContact O-N 2.86Å
667	A	39.4	Very low	38.5	Very low	37 Å²	37	115.8 Å²	115.8	31%	0.306	56%	0.558	S	S	.	*	H	α-helix	trans	-74.8	-35.9	177.1	0	0	0	0	0	112.1	S664 R670 R671	S664-A667 PolarHBondContact O-N 3.48Å; A667-R670 PolarHBondContact O-N 2.69Å; A667-R671 PolarHBondContact O-N 2.91Å
668	E	43	Very low	38.8	Very low	102 Å²	102	117.5 Å²	117.5	48%	0.477	58%	0.577	S	S	.	*	H	α-helix	trans	-67.2	-43.4	172.6	-164.3	-178.9	173.6	0	0	111.3	V663 S664 R670 R671 R672	V663-E668 HydrophobicContact CG1-CB 4.23Å; S664-E668 PolarHBondContact O-N 2.88Å; E668-R670 PolarHBondContact O-N 3.18Å; E668-R671 PolarHBondContact O-N 3.28Å; E668-R672 PolarHBondContact O-N 3.44Å
669	Q	36.8	Very low	39	Very low	115 Å²	115	118.4 Å²	118.4	54%	0.537	58%	0.578	S	S	.	*	H	α-helix	trans	-62	-41.2	172.9	-156.5	97.7	-20.8	0	0	111.5	R665 R671 R672 C673	R665-Q669 WeakPolarHBondContact O-CB 3.24Å; R665-Q669 PolarHBondContact O-N 3.46Å; R665-Q669 VanDerWaalsContact O-N 3.13Å; Q669-R671 PolarHBondContact O-N 2.64Å; Q669-R672 PolarHBondContact O-N 3.14Å; Q669-C673 WeakPolarHBondContact O-CB 3.33Å; Q669-C673 PolarHBondContact O-N 3.11Å; Q669-C673 PolarHBondContact O-SG 3.42Å
670	R	39.9	Very low	39.2	Very low	184 Å²	184	116 Å²	116	69%	0.694	58%	0.58	S	S	*	*	H	α-helix	trans	-63	-38.8	175.5	-81.9	175.9	-168.4	172	3.9	112.8	A666 A667 E668 C673 Q674	A666-R670 WeakPolarHBondContact O-CB 3.32Å; A666-R670 VanDerWaalsContact O-CG 3.27Å; A666-R670 WeakPolarHBondContact O-CG 3.4Å; A666-R670 PolarHBondContact O-N 2.86Å; A667-R670 PolarHBondContact O-N 2.69Å; E668-R670 PolarHBondContact O-N 3.18Å; R670-C673 PolarHBondContact O-N 3.05Å; R670-Q674 WeakPolarHBondContact O-CB 3.44Å; R670-Q674 WeakPolarHBondContact O-CG 3.35Å; R670-Q674 PolarHBondContact O-N 3.5Å
671	R	47.7	Very low	39.1	Very low	183 Å²	183	116.8 Å²	116.8	69%	0.691	59%	0.586	S	S	*	*	H	α-helix	trans	-70.2	-36.7	174.6	-74.4	-172.2	-169.1	-178.7	5.3	112.1	A667 E668 Q669 Q674 S675	A667-R671 PolarHBondContact O-N 2.91Å; E668-R671 PolarHBondContact O-N 3.28Å; Q669-R671 PolarHBondContact O-N 2.64Å; R671-Q674 PolarHBondContact O-N 2.96Å; R671-S675 WeakPolarHBondContact O-CB 3.41Å; R671-S675 PolarHBondContact O-N 2.81Å
672	R	42	Very low	39.5	Very low	165 Å²	165	119.9 Å²	119.9	62%	0.623	61%	0.612	S	S	*	*	H	α-helix	trans	-63.2	-42.7	170.5	-76.8	-173.7	-179.9	-176.9	2.3	112.1	E668 Q669 S675 M676	E668-R672 PolarHBondContact O-N 3.44Å; Q669-R672 PolarHBondContact O-N 3.14Å; R672-S675 WeakPolarHBondContact O-CB 3.42Å; R672-S675 PolarHBondContact O-N 3.39Å; R672-M676 PolarHBondContact O-N 3.32Å
673	C	40.2	Very low	39.7	Very low	58 Å²	58	121.7 Å²	121.7	39%	0.392	62%	0.617	S	S	.	*	H	α-helix	trans	-69.4	-34.7	176	-68.7	0	0	0	0	113	Q669 R670 M676 K677	Q669-C673 WeakPolarHBondContact O-CB 3.33Å; Q669-C673 PolarHBondContact O-N 3.11Å; Q669-C673 PolarHBondContact O-SG 3.42Å; R670-C673 PolarHBondContact O-N 3.05Å; C673-M676 WeakPolarHBondContact O-CB 3.47Å; C673-M676 PolarHBondContact O-N 3.43Å; C673-K677 PolarHBondContact O-N 3.33Å
674	Q	41.8	Very low	39.4	Very low	132 Å²	132	123 Å²	123	62%	0.617	62%	0.62	S	S	*	*	H	α-helix	trans	-69.2	-34.4	172.8	-80.7	177.6	-18.7	0	0	112.2	R670 R671 M676 K677	R670-Q674 WeakPolarHBondContact O-CB 3.44Å; R670-Q674 WeakPolarHBondContact O-CG 3.35Å; R670-Q674 PolarHBondContact O-N 3.5Å; R671-Q674 PolarHBondContact O-N 2.96Å; Q674-M676 PolarHBondContact O-N 3.39Å; Q674-K677 PolarHBondContact O-N 3.32Å
675	S	42	Very low	39.2	Very low	88 Å²	88	129.5 Å²	129.5	62%	0.615	64%	0.635	S	S	*	*	H	α-helix	trans	-65	-23.2	171.1	-170.9	0	0	0	0	113	R671 R672 S678	R671-S675 WeakPolarHBondContact O-CB 3.41Å; R671-S675 PolarHBondContact O-N 2.81Å; R672-S675 WeakPolarHBondContact O-CB 3.42Å; R672-S675 PolarHBondContact O-N 3.39Å; S675-S678 PolarHBondContact O-OG 3.28Å
676	M	37.8	Very low	39.2	Very low	115 Å²	115	125.2 Å²	125.2	57%	0.567	63%	0.629	S	S	*	*	H	α-helix	trans	-85.6	-12.4	175.2	-82.2	170.4	45.9	0	0	114.1	R672 C673 Q674 S678	R672-M676 PolarHBondContact O-N 3.32Å; C673-M676 WeakPolarHBondContact O-CB 3.47Å; C673-M676 PolarHBondContact O-N 3.43Å; Q674-M676 PolarHBondContact O-N 3.39Å; M676-S678 PolarHBondContact O-N 3.37Å; M676-S678 VanDerWaalsContact O-N 3.14Å
677	K	35.5	Very low	39.5	Very low	167 Å²	167	129 Å²	129	73%	0.726	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.7	6.2	178.7	-77.1	-176	175.9	-174.5	0	114.2	C673 Q674	C673-K677 PolarHBondContact O-N 3.33Å; Q674-K677 PolarHBondContact O-N 3.32Å
678	S	40.3	Very low	39.4	Very low	94 Å²	94	132 Å²	132	66%	0.657	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.2	2.2	177.1	55	0	0	0	0	114.4	S675 M676	S675-S678 PolarHBondContact O-OG 3.28Å; M676-S678 PolarHBondContact O-N 3.37Å; M676-S678 VanDerWaalsContact O-N 3.14Å
679	Y	35.8	Very low	38.8	Very low	173 Å²	173	132.3 Å²	132.3	68%	0.678	67%	0.669	S	S	*	*	S	Bend	trans	-101.8	133.8	176.7	-73.1	-83.3	0	0	0	112.8	S681	Y679-S681 PolarHBondContact O-N 3.22Å
680	P	38.9	Very low	38.6	Very low	130 Å²	130	134 Å²	134	84%	0.844	68%	0.682	S	S	*	*			trans	-86.7	88.8	171.5	33.9	-27.4	0	0	0	108.8
681	S	37.1	Very low	38.2	Very low	91 Å²	91	134.3 Å²	134.3	64%	0.636	69%	0.691	S	S	*	*			trans	-145	128.8	158.8	58.7	0	0	0	0	109.1	Y679 E683	Y679-S681 PolarHBondContact O-N 3.22Å; S681-E683 VanDerWaalsContact C-N 3.31Å; S681-E683 PolarHBondContact O-N 3.34Å
682	S	44.1	Very low	37.3	Very low	114 Å²	114	133.1 Å²	133.1	80%	0.797	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.6	5.6	-159.2	38.8	0	0	0	0	115.3
683	E	41.2	Very low	36.6	Very low	179 Å²	179	130.2 Å²	130.2	84%	0.836	71%	0.71	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.7	-9.4	-169.8	-66.1	-165.7	157.6	0	0	115.7	S681	S681-E683 VanDerWaalsContact C-N 3.31Å; S681-E683 PolarHBondContact O-N 3.34Å
684	L	36	Very low	35.9	Very low	130 Å²	130	132.4 Å²	132.4	68%	0.681	73%	0.732	S	S	*	*	S	Bend	trans	-96.8	9.4	177.9	-125.2	88.9	0	0	0	114.7
685	R	35.3	Very low	35.1	Very low	195 Å²	195	131.2 Å²	131.2	74%	0.736	75%	0.745	S	S	*	*	S	Bend	trans	-81.7	-24.5	-173.4	-161.4	165.5	170.6	161.2	-5.9	113.4	V687	R685-V687 PolarHBondContact O-N 3.46Å
686	N	36.2	Very low	34.2	Very low	128 Å²	128	135.9 Å²	135.9	68%	0.684	76%	0.757	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.3	-4.8	-169.5	-66.7	-5.3	0	0	0	115
687	V	39.3	Very low	33.6	Very low	129 Å²	129	136.5 Å²	136.5	78%	0.782	77%	0.769	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.8	-11.6	180	-173	0	0	0	0	112	R685	R685-V687 PolarHBondContact O-N 3.46Å
688	C	35.5	Very low	33.2	Very low	100 Å²	100	133.3 Å²	133.3	68%	0.676	77%	0.774	S	S	*	*	S	Bend	trans	-102.7	-8.7	-177.6	-67.1	0	0	0	0	115.2
689	D	32.1	Very low	32.6	Very low	109 Å²	109	138.1 Å²	138.1	58%	0.583	79%	0.786	S	S	*	*	S	Bend	trans	-98.6	-6.9	-169.9	-78	-23.4	0	0	0	114.6	Q691	D689-Q691 PolarHBondContact O-N 3.06Å
690	D	30.8	Very low	32.5	Very low	151 Å²	151	139.5 Å²	139.5	81%	0.807	80%	0.799	S	S	*	*	S	Bend	trans	-97	21.5	-169.4	-94.7	-13.3	0	0	0	117.1
691	Q	31.7	Very low	32	Very low	189 Å²	189	136.4 Å²	136.4	88%	0.883	79%	0.791	S	S	*	*			trans	-134.3	48.1	173.7	-69.9	-165.4	-10.7	0	0	114.5	D689	D689-Q691 PolarHBondContact O-N 3.06Å
692	N	30.5	Very low	31.7	Very low	159 Å²	159	141.6 Å²	141.6	85%	0.85	81%	0.805	S	S	*	*			trans	-115.2	93.7	164.7	-80	-24.4	0	0	0	110.5
693	A	26.6	Very low	31.4	Very low	103 Å²	103	141.9 Å²	141.9	85%	0.851	80%	0.798	S	S	*	*			trans	-158.5	96.8	159.7	0	0	0	0	0	110.8
694	A	25.3	Very low	31.3	Very low	105 Å²	105	139.3 Å²	139.3	87%	0.868	79%	0.789	S	S	*	*			trans	171.6	91	141.9	0	0	0	0	0	108.5
695	A	25	Very low	31.4	Very low	106 Å²	106	139.3 Å²	139.3	88%	0.876	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-97.1	124.3	162.6	0	0	0	0	0	107.4
696	E	23.4	Very low	31.4	Very low	187 Å²	187	136.3 Å²	136.3	87%	0.874	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-91.3	150.2	164	-75.1	-162.1	159.1	0	0	110.2
697	P	26.1	Very low	31.5	Very low	127 Å²	127	135.9 Å²	135.9	83%	0.825	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-81.9	149.4	-166.2	19.3	-7.5	0	0	0	113.1
698	A	26.2	Very low	31.3	Very low	100 Å²	100	135.7 Å²	135.7	83%	0.826	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-84.2	132.5	176.3	0	0	0	0	0	111.2
699	E	27.3	Very low	31.3	Very low	196 Å²	196	135.8 Å²	135.8	92%	0.916	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-81.6	138.8	163.5	-74.1	-173	155	0	0	110.6
700	E	33.4	Very low	31.3	Very low	201 Å²	201	137.7 Å²	137.7	94%	0.939	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-68.6	152.4	177.6	-66.3	174.4	146.6	0	0	112.4
701	G	28.5	Very low	31.5	Very low	66 Å²	66	140.9 Å²	140.9	68%	0.68	77%	0.769	S	S	*	*			trans	179.4	105.4	168.9	0	0	0	0	0	113.4	D703	G701-D703 PolarHBondContact O-N 2.84Å
702	E	32	Very low	31.6	Very low	199 Å²	199	141.7 Å²	141.7	93%	0.93	76%	0.763	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.2	23.4	-176.2	-69	-179.2	127.5	0	0	116.5
703	D	36.2	Very low	31.4	Very low	121 Å²	121	142 Å²	142	65%	0.647	76%	0.759	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95	-6	-170.8	-78.5	-31.9	0	0	0	115.8	G701 Q707	G701-D703 PolarHBondContact O-N 2.84Å; D703-Q707 PolarHBondContact O-N 3.44Å
704	L	39.1	Very low	31.4	Very low	124 Å²	124	140.7 Å²	140.7	65%	0.649	75%	0.749	S	S	*	*	H	α-helix	trans	-75.4	-32.4	-170.3	-153.9	78.1	0	0	0	113.5	M708	L704-M708 WeakPolarHBondContact O-CB 3.32Å; L704-M708 VanDerWaalsContact O-CG 3.27Å; L704-M708 WeakPolarHBondContact O-CG 3.37Å; L704-M708 PolarHBondContact O-N 3.3Å; L704-M708 VanDerWaalsContact O-N 3.07Å
705	L	38.2	Very low	31.3	Very low	130 Å²	130	141.4 Å²	141.4	68%	0.681	75%	0.745	S	S	*	*	H	α-helix	trans	-74.8	-35.5	-179.2	-155.3	82.8	0	0	0	111.5	M708 L709	L705-M708 PolarHBondContact O-N 2.97Å; L705-L709 PolarHBondContact O-N 3.42Å; L705-L709 VanDerWaalsContact O-N 3.14Å
706	Q	35.3	Very low	31.4	Very low	132 Å²	132	146 Å²	146	62%	0.617	74%	0.741	S	S	*	*	H	α-helix	trans	-68	-43.1	176	-154.1	87.3	-2.2	0	0	110.6	M708 L709 E710	Q706-M708 VanDerWaalsContact C-N 3.31Å; Q706-M708 PolarHBondContact O-N 3.38Å; Q706-L709 PolarHBondContact O-N 3.45Å; Q706-E710 PolarHBondContact O-N 3.45Å
707	Q	40.1	Very low	31.6	Very low	119 Å²	119	141.9 Å²	141.9	56%	0.556	73%	0.73	S	S	*	*	H	α-helix	trans	-64.8	-30.2	173.1	-84.5	-173.2	-6.7	0	0	113.6	D703	D703-Q707 PolarHBondContact O-N 3.44Å
708	M	34.5	Very low	31.8	Very low	125 Å²	125	143.5 Å²	143.5	62%	0.616	73%	0.732	S	S	*	*	H	α-helix	trans	-74.4	-26.9	175.1	-78.9	-173.6	65.6	0	0	113.3	L704 L705 Q706	L704-M708 WeakPolarHBondContact O-CB 3.32Å; L704-M708 VanDerWaalsContact O-CG 3.27Å; L704-M708 WeakPolarHBondContact O-CG 3.37Å; L704-M708 PolarHBondContact O-N 3.3Å; L704-M708 VanDerWaalsContact O-N 3.07Å; L705-M708 PolarHBondContact O-N 2.97Å; Q706-M708 VanDerWaalsContact C-N 3.31Å; Q706-M708 PolarHBondContact O-N 3.38Å
709	L	35.1	Very low	32.1	Very low	102 Å²	102	144.3 Å²	144.3	53%	0.534	72%	0.722	S	S	.	*	H	α-helix	trans	-81.5	-34.4	178.3	-79.6	159.7	0	0	0	112.5	L705 Q706 R711 R712	L705-L709 PolarHBondContact O-N 3.42Å; L705-L709 VanDerWaalsContact O-N 3.14Å; Q706-L709 PolarHBondContact O-N 3.45Å; L709-R711 PolarHBondContact O-N 2.91Å; L709-R712 PolarHBondContact O-N 3.49Å
710	E	31.2	Very low	32.1	Very low	149 Å²	149	138.9 Å²	138.9	70%	0.696	69%	0.694	S	S	*	*	H	α-helix	trans	-72.6	-24.6	177.2	-74.5	-176.1	161.9	0	0	113.8	Q706 R712	Q706-E710 PolarHBondContact O-N 3.45Å; E710-R712 VanDerWaalsContact C-N 3.26Å; E710-R712 PolarHBondContact O-N 3.27Å
711	R	36.7	Very low	32.1	Very low	219 Å²	219	134.7 Å²	134.7	83%	0.826	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.9	-8	176.2	-81.2	-173.1	177.5	171.4	2.3	115.3	L709	L709-R711 PolarHBondContact O-N 2.91Å
712	R	32.5	Very low	32.2	Very low	205 Å²	205	138.2 Å²	138.2	77%	0.774	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.8	-8.5	176.8	-83.9	-161.1	-135.5	-162.8	5.3	114.8	L709 E710	L709-R712 PolarHBondContact O-N 3.49Å; E710-R712 VanDerWaalsContact C-N 3.26Å; E710-R712 PolarHBondContact O-N 3.27Å
713	H	27.3	Very low	32.1	Very low	165 Å²	165	136.8 Å²	136.8	76%	0.764	68%	0.68	S	S	*	*			trans	-131	41.6	-171.1	-71.5	94.1	0	0	0	114.7
714	A	25.2	Very low	31.8	Very low	76 Å²	76	136 Å²	136	63%	0.628	68%	0.684	S	S	*	*	P	Polyproline II helix	trans	-95.8	118.2	164.9	0	0	0	0	0	109.9	Y716	A714-Y716 PolarHBondContact O-N 3.32Å
715	P	24.7	Very low	31.3	Very low	121 Å²	121	135.8 Å²	135.8	79%	0.786	69%	0.69	S	S	*	*	P	Polyproline II helix	trans	-67.7	122.5	168.3	26.8	-29.2	0	0	0	108.5
716	Y	27.2	Very low	30.9	Very low	202 Å²	202	133.2 Å²	133.2	79%	0.792	68%	0.683	S	S	*	*	P	Polyproline II helix	trans	-64.1	127.5	173.9	-76.2	-86.6	0	0	0	109.4	A714	A714-Y716 PolarHBondContact O-N 3.32Å
717	P	27.4	Very low	30.8	Very low	100 Å²	100	136.8 Å²	136.8	65%	0.649	70%	0.7	S	S	*	*	P	Polyproline II helix	trans	-67.7	142	170.1	27.8	-30.7	0	0	0	109.2	L719	P717-L719 PolarHBondContact O-N 2.89Å
718	N	29	Very low	30.3	Very low	162 Å²	162	139.7 Å²	139.7	87%	0.866	71%	0.713	S	S	*	*			trans	-47.7	106.6	-178.8	-71.9	-36.2	0	0	0	112.3
719	L	32.8	Very low	30.2	Very low	116 Å²	116	140.2 Å²	140.2	61%	0.607	71%	0.709	S	S	*	*			trans	-107.8	83	176.6	-101.4	124.1	0	0	0	108.9	P717	P717-L719 PolarHBondContact O-N 2.89Å
720	Y	28.1	Very low	30.1	Very low	83 Å²	83	139.6 Å²	139.6	33%	0.325	71%	0.709	S	S	.	*			trans	-138.3	122.6	165.7	-69.8	-71.2	0	0	0	109.8	R615 E761 I799	R615-Y720 HydrophobicContact CG-CE1 3.56Å; R615-Y720 WeakPolarHBondContact CG-OH 3.17Å; R615-Y720 PolarHBondContact NE-OH 3.06Å; Y720-E761 PolarHBondContact OH-OE1 2.97Å; Y720-E761 VanDerWaalsContact OH-OE1 3.09Å; Y720-I799 WeakPolarHBondContact OH-CD1 3.49Å
721	P	33.2	Very low	30	Very low	112 Å²	112	140.6 Å²	140.6	73%	0.727	72%	0.716	S	S	*	*			trans	-82.9	111.4	159.4	24.7	-14.4	0	0	0	108.4	Q723	P721-Q723 PolarHBondContact O-N 3.24Å
722	D	31.1	Very low	30	Very low	141 Å²	141	137.6 Å²	137.6	75%	0.754	71%	0.711	S	S	*	*			trans	-79.7	22.7	-178.3	-82.8	-26.9	0	0	0	114.2
723	Q	29.9	Very low	30.2	Very low	169 Å²	169	131.7 Å²	131.7	79%	0.79	69%	0.692	S	S	*	*			trans	-128.9	122.4	-173.1	-67	-175.9	-1.9	0	0	113.4	P721	P721-Q723 PolarHBondContact O-N 3.24Å
724	S	28.9	Very low	30.8	Very low	105 Å²	105	133.9 Å²	133.9	73%	0.734	69%	0.694	S	S	*	*	P	Polyproline II helix	trans	-56.7	150.5	158.6	47.4	0	0	0	0	110.7	S726	S724-S726 PolarHBondContact O-N 2.99Å
725	P	29.3	Very low	31.8	Very low	118 Å²	118	138.6 Å²	138.6	77%	0.766	70%	0.701	S	S	*	*	P	Polyproline II helix	trans	-65.7	118.4	-171.3	27.5	-33.5	0	0	0	111.2
726	S	29.6	Very low	33.4	Very low	77 Å²	77	136.7 Å²	136.7	54%	0.538	68%	0.678	S	S	.	*	P	Polyproline II helix	trans	-88.8	146	163.3	49.1	0	0	0	0	110.3	S724 E728	S724-S726 PolarHBondContact O-N 2.99Å; S726-E728 PolarHBondContact O-N 2.82Å
727	E	32.4	Very low	35.2	Very low	206 Å²	206	128 Å²	128	96%	0.963	65%	0.646	S	S	*	*	S	Bend	trans	-65.5	9	-166.8	-73.8	-177.2	140.4	0	0	117.6
728	E	30.7	Very low	37.7	Very low	181 Å²	181	124.1 Å²	124.1	85%	0.846	62%	0.619	S	S	*	*			trans	-122.7	83.4	-178.1	-73.2	-177.8	158.6	0	0	110.8	S726	S726-E728 PolarHBondContact O-N 2.82Å
729	W	32	Very low	40.4	Very low	136 Å²	136	117.2 Å²	117.2	52%	0.515	58%	0.583	S	S	.	*			trans	-105.9	130.7	166.8	-77.1	25.4	0	0	0	109.7	E733	W729-E733 VanDerWaalsContact CA-OE2 3.28Å; W729-E733 WeakPolarHBondContact CA-OE2 3.31Å; W729-E733 HydrophobicContact CB-CB 4.32Å; W729-E733 WeakPolarHBondContact CB-OE2 3.25Å; W729-E733 HydrophobicContact CD2-CB 4.17Å; W729-E733 HydrophobicContact CE3-CB 3.75Å; W729-E733 HydrophobicContact CG-CB 4.44Å; W729-E733 HydrophobicContact CZ3-CB 4.48Å
730	T	32.8	Very low	43	Very low	88 Å²	88	111.9 Å²	111.9	54%	0.54	56%	0.555	S	S	.	*			trans	-73.8	158.4	176.7	55.6	0	0	0	0	110.6	E732 E733	T730-E732 PolarHBondContact O-N 2.81Å; T730-E733 PolarHBondContact N-OE2 3.41Å; T730-E733 PolarHBondContact O-N 2.9Å
731	M	29.9	Very low	45.7	Very low	170 Å²	170	111.4 Å²	111.4	84%	0.837	56%	0.556	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.7	-18.8	-176.4	-157.7	170.7	-179	0	0	113.7
732	E	36	Very low	48.4	Very low	156 Å²	156	106 Å²	106	73%	0.729	52%	0.521	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.9	-26.4	179	-65.8	171	171.3	0	0	113.3	T730 R734	T730-E732 PolarHBondContact O-N 2.81Å; E732-R734 VanDerWaalsContact C-N 3.28Å; E732-R734 PolarHBondContact O-N 3.36Å
733	E	37.7	Very low	51.2	Low	81 Å²	81	100.1 Å²	100.1	38%	0.379	49%	0.489	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-6.7	179.8	-70.1	176.5	133.8	0	0	113.6	W729 T730 F735	W729-E733 VanDerWaalsContact CA-OE2 3.28Å; W729-E733 WeakPolarHBondContact CA-OE2 3.31Å; W729-E733 HydrophobicContact CB-CB 4.32Å; W729-E733 WeakPolarHBondContact CB-OE2 3.25Å; W729-E733 HydrophobicContact CD2-CB 4.17Å; W729-E733 HydrophobicContact CE3-CB 3.75Å; W729-E733 HydrophobicContact CG-CB 4.44Å; W729-E733 HydrophobicContact CZ3-CB 4.48Å; T730-E733 PolarHBondContact N-OE2 3.41Å; T730-E733 PolarHBondContact O-N 2.9Å; E733-F735 VanDerWaalsContact C-N 3.32Å
734	R	39.3	Very low	54.2	Low	211 Å²	211	92 Å²	92	80%	0.796	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.1	-14.9	176.9	-113.8	-179.9	-169.7	153	5.2	114	E732	E732-R734 VanDerWaalsContact C-N 3.28Å; E732-R734 PolarHBondContact O-N 3.36Å
735	F	45.6	Very low	57.1	Low	176 Å²	176	88.6 Å²	88.6	77%	0.772	43%	0.425	S	S	*	.			trans	-125.3	63.6	-176.8	-69.7	-80.9	0	0	0	111.7	E733	E733-F735 VanDerWaalsContact C-N 3.32Å
736	R	57.9	Low	60	Low	81 Å²	81	84.4 Å²	84.4	31%	0.306	39%	0.393	S	S	.	.			trans	-72.6	125.2	164.7	-84.1	-172.6	-112.7	-170.2	-9.9	109.8	E636 L738	E636-R736 WeakPolarHBondContact OE1-CD 3.24Å; E636-R736 IonicContact OE1-CZ 2.7Å; E636-R736 IonicContact OE1-NE 3.99Å; E636-R736 IonicContact OE1-NH1 3.91Å; E636-R736 PolarHBondContact OE1-NH1 2.95Å; R736-L738 PolarHBondContact O-N 3.42Å
737	P	66.2	Low	62.8	Low	18 Å²	18	81.9 Å²	81.9	12%	0.117	38%	0.376	C	S	.	.			trans	-70.1	103.7	175.7	26.8	-31.1	0	0	0	110.2	N637 E641 E842	N637-P737 PolarHBondContact N-O 3.38Å; E641-P737 HydrophobicContact CB-CG 4.41Å; E641-P737 HydrophobicContact CG-CG 3.86Å; E641-P737 WeakPolarHBondContact OE1-CD 3.37Å; P737-E842 HydrophobicContact CB-CG 4.25Å; P737-E842 WeakPolarHBondContact CB-OE1 3.25Å
738	L	80.3	Confident	65.5	Low	19 Å²	19	73 Å²	73	10%	0.099	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	103.9	179	-64.8	173.2	0	0	0	109.8	Y609 V634 E636 R736 F740 E842 I843	Y609-L738 HydrophobicContact CD1-CD1 3.67Å; Y609-L738 HydrophobicContact CE1-CD1 3.45Å; Y609-L738 VanDerWaalsContact CE1-CD1 3.45Å; Y609-L738 HydrophobicContact CE1-CD2 4.38Å; Y609-L738 HydrophobicContact CE2-CD2 4.14Å; Y609-L738 HydrophobicContact CG-CD1 4.32Å; V634-L738 HydrophobicContact CB-CB 4.13Å; V634-L738 HydrophobicContact CB-CD2 4.49Å; V634-L738 HydrophobicContact CG1-CB 4.24Å; V634-L738 HydrophobicContact CG2-CB 4.37Å; V634-L738 HydrophobicContact CG2-CD2 3.93Å; V634-L738 HydrophobicContact CG2-CG 4.5Å; E636-L738 HydrophobicContact CG-CD2 4.18Å; R736-L738 PolarHBondContact O-N 3.42Å; L738-F740 PolarHBondContact O-N 2.94Å; L738-E842 WeakPolarHBondContact O-CA 3.44Å; L738-I843 HydrophobicContact CB-CG2 4.13Å; L738-I843 PolarHBondContact O-N 3.46Å; L738-I843 VanDerWaalsContact O-N 3.07Å
739	T	84.7	Confident	68.4	Low	17 Å²	17	64.5 Å²	64.5	10%	0.104	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	128.8	176.3	54.7	0	0	0	0	110.2	V634 T635 N637	V634-T739 CarbonylContact C-O 3.54Å; V634-T739 WeakPolarHBondContact CA-O 3.38Å; T635-T739 PolarHBondContact N-O 3.45Å; T635-T739 PolarHBondContact O-N 3.38Å; T635-T739 PolarHBondContact O-OG1 3.31Å; T635-T739 PolarHBondContact OG1-OG1 3.07Å; N637-T739 HydrophobicContact CB-CG2 3.62Å
740	F	87.7	Confident	71.1	Confident	4 Å²	4	58.2 Å²	58.2	2%	0.018	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	129.8	-173.9	-178.1	-111.9	0	0	0	112.4	P632 F657 L738 G742 L743 P810 T812 P835 V837 G841 I843	P632-F740 HydrophobicContact CB-CD2 4.11Å; P632-F740 HydrophobicContact CB-CE2 3.81Å; F657-F740 VanDerWaalsContact CZ-O 3.28Å; F657-F740 WeakPolarHBondContact CZ-O 3.32Å; L738-F740 PolarHBondContact O-N 2.94Å; F740-G742 WeakPolarHBondContact CE2-O 3.4Å; F740-L743 HydrophobicContact CE2-CD2 4.44Å; F740-L743 HydrophobicContact CE2-CG 4.44Å; F740-L743 HydrophobicContact CZ-CG 4.16Å; F740-P810 HydrophobicContact CE1-CG 3.65Å; F740-P810 HydrophobicContact CZ-CG 3.53Å; F740-T812 HydrophobicContact CD1-CG2 4.41Å; F740-T812 HydrophobicContact CE1-CG2 3.82Å; F740-P835 HydrophobicContact CE1-CB 4.41Å; F740-P835 HydrophobicContact CE2-CB 4.26Å; F740-P835 HydrophobicContact CE2-CG 4.25Å; F740-P835 HydrophobicContact CZ-CB 3.95Å; F740-P835 HydrophobicContact CZ-CG 3.76Å; F740-V837 HydrophobicContact CD1-CG2 3.94Å; F740-V837 HydrophobicContact CE1-CG2 4.43Å; F740-V837 HydrophobicContact CG-CG2 4.28Å; F740-G841 PolarHBondContact N-O 3.46Å; F740-I843 HydrophobicContact CB-CB 4.14Å; F740-I843 HydrophobicContact CD2-CB 4.1Å; F740-I843 HydrophobicContact CD2-CD1 3.79Å; F740-I843 HydrophobicContact CD2-CG1 4.37Å; F740-I843 HydrophobicContact CE2-CD1 3.91Å; F740-I843 HydrophobicContact CG-CB 4.38Å
741	H	85.3	Confident	73.8	Confident	73 Å²	73	54.2 Å²	54.2	34%	0.338	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	-27.7	177.7	-69.5	-72.2	0	0	0	114.2	V633 T635 M806	V633-H741 PolarHBondContact O-N 3.2Å; T635-H741 WeakPolarHBondContact CG2-NE2 3.34Å; T635-H741 PolarHBondContact OG1-NE2 2.86Å; H741-M806 HydrophobicContact CB-CE 4.06Å; H741-M806 HydrophobicContact CB-SD 4.43Å
742	G	88.8	Confident	76.6	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	169.2	-174.4	-176	0	0	0	0	0	113.8	P632 V633 F740 N807	P632-G742 WeakPolarHBondContact CA-O 3.48Å; V633-G742 PolarHBondContact N-O 3.42Å; F740-G742 WeakPolarHBondContact CE2-O 3.4Å; G742-N807 CarbonylContact C-O 3.6Å; G742-N807 WeakPolarHBondContact CA-O 3.43Å
743	L	90.1	Very high	79.1	Confident	16 Å²	16	39 Å²	39	8%	0.084	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	136.4	174.8	-77.6	174.8	0	0	0	110.1	P632 F740 N807 P810 H833 P835 I846	P632-L743 HydrophobicContact CB-CD2 4.19Å; F740-L743 HydrophobicContact CE2-CD2 4.44Å; F740-L743 HydrophobicContact CE2-CG 4.44Å; F740-L743 HydrophobicContact CZ-CG 4.16Å; L743-N807 PolarHBondContact N-O 3.44Å; L743-N807 WeakPolarHBondContact O-CB 3.37Å; L743-N807 PolarHBondContact O-N 3.03Å; L743-P810 HydrophobicContact CB-CB 4.44Å; L743-P810 HydrophobicContact CB-CG 4.45Å; L743-P810 HydrophobicContact CD1-CB 3.71Å; L743-P810 HydrophobicContact CD1-CG 4.22Å; L743-P810 HydrophobicContact CG-CB 4.11Å; L743-P810 HydrophobicContact CG-CG 4.1Å; L743-H833 HydrophobicContact CD1-CB 4.24Å; L743-P835 HydrophobicContact CD1-CG 3.6Å; L743-P835 HydrophobicContact CD2-CG 4.01Å; L743-P835 HydrophobicContact CG-CG 3.9Å; L743-I846 HydrophobicContact CD2-CD1 4.4Å
744	I	92.1	Very high	81.4	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	140.6	167.8	-171.7	163.3	0	0	0	111.3	A630 F631 V633 Q748 L749 L752 V802 M806	A630-I744 CarbonylContact C-O 3.55Å; A630-I744 VanDerWaalsContact CA-O 3.26Å; A630-I744 WeakPolarHBondContact CA-O 3.28Å; F631-I744 HydrophobicContact CB-CG2 4.25Å; F631-I744 PolarHBondContact N-O 3.25Å; F631-I744 PolarHBondContact O-N 3Å; V633-I744 HydrophobicContact CG2-CB 4.28Å; V633-I744 HydrophobicContact CG2-CG2 3.91Å; I744-Q748 HydrophobicContact CD1-CB 4.21Å; I744-Q748 HydrophobicContact CG1-CB 4.06Å; I744-L749 HydrophobicContact CD1-CD2 3.64Å; I744-L749 HydrophobicContact CD1-CG 3.83Å; I744-L749 HydrophobicContact CG1-CD2 4.38Å; I744-L749 HydrophobicContact CG1-CG 4.1Å; I744-L749 HydrophobicContact CG2-CD1 4.09Å; I744-L749 HydrophobicContact CG2-CD2 4.39Å; I744-L749 HydrophobicContact CG2-CG 4.23Å; I744-L752 HydrophobicContact CD1-CD1 4.41Å; I744-V802 HydrophobicContact CB-CG1 4.1Å; I744-V802 HydrophobicContact CD1-CG1 3.17Å; I744-V802 HydrophobicContact CG1-CG1 4.18Å; I744-V802 HydrophobicContact CG2-CG1 4.04Å; I744-M806 HydrophobicContact CB-CB 4.19Å
745	L	91.2	Very high	83.7	Confident	33 Å²	33	32 Å²	32	17%	0.173	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	147.6	176.7	-58.6	176.3	0	0	0	111.7	H629 A630 S747 Q748 L749	H629-L745 CarbonylContact O-C 3.58Å; H629-L745 WeakPolarHBondContact O-CA 3.33Å; A630-L745 HydrophobicContact CB-CD2 3.99Å; L745-S747 VanDerWaalsContact C-N 3.3Å; L745-S747 PolarHBondContact O-N 3.31Å; L745-Q748 HydrophobicContact CB-CB 4.43Å; L745-Q748 HydrophobicContact CB-CG 4.04Å; L745-Q748 WeakPolarHBondContact O-CB 3.41Å; L745-Q748 PolarHBondContact O-N 3.49Å; L745-Q748 VanDerWaalsContact O-N 3.12Å; L745-L749 PolarHBondContact O-N 3.32Å; L745-L749 VanDerWaalsContact O-N 3.12Å
746	R	90.5	Very high	85.5	Confident	29 Å²	29	25.3 Å²	25.3	11%	0.109	13%	0.129	C	C	.	.	H	α-helix	trans	-55.9	-43.7	174	-175.2	-169	175.1	84.2	-0.9	111.9	L623 T626 Y628 H629 F631 Q748 L749 V750 D785	L623-R746 HydrophobicContact CD2-CG 3.6Å; L623-R746 VanDerWaalsContact O-CZ 3.24Å; L623-R746 PolarHBondContact O-NH1 3.32Å; L623-R746 PolarHBondContact O-NH2 2.96Å; T626-R746 PolarHBondContact O-NH1 3.47Å; Y628-R746 WeakPolarHBondContact O-CD 3.48Å; H629-R746 WeakPolarHBondContact O-CB 3.42Å; H629-R746 PolarHBondContact O-N 3.49Å; F631-R746 HydrophobicContact CE2-CB 4.05Å; F631-R746 HydrophobicContact CE2-CG 4.32Å; R746-Q748 VanDerWaalsContact C-N 3.27Å; R746-Q748 PolarHBondContact O-N 2.93Å; R746-L749 PolarHBondContact O-N 3.04Å; R746-V750 WeakPolarHBondContact O-CG2 3.39Å; R746-V750 PolarHBondContact O-N 3.14Å; R746-D785 IonicContact NH2-OD1 3.65Å
747	S	88	Confident	86.9	Confident	24 Å²	24	21.6 Å²	21.6	17%	0.168	12%	0.115	C	C	.	.	H	α-helix	trans	-61.9	-34.9	178.3	50.7	0	0	0	0	112.7	L745 N751	L745-S747 VanDerWaalsContact C-N 3.3Å; L745-S747 PolarHBondContact O-N 3.31Å; S747-N751 WeakPolarHBondContact O-CB 3.47Å; S747-N751 PolarHBondContact O-N 3.33Å
748	Q	89.4	Confident	88	Confident	20 Å²	20	21.6 Å²	21.6	9%	0.093	12%	0.115	C	C	.	.	H	α-helix	trans	-68.8	-46.2	176	-66.5	170.4	-32.8	0	0	110.6	C52 I744 L745 R746 V750 N751 L752 M776	C52-Q748 PolarHBondContact SG-NE2 3.38Å; I744-Q748 HydrophobicContact CD1-CB 4.21Å; I744-Q748 HydrophobicContact CG1-CB 4.06Å; L745-Q748 HydrophobicContact CB-CB 4.43Å; L745-Q748 HydrophobicContact CB-CG 4.04Å; L745-Q748 WeakPolarHBondContact O-CB 3.41Å; L745-Q748 PolarHBondContact O-N 3.49Å; L745-Q748 VanDerWaalsContact O-N 3.12Å; R746-Q748 VanDerWaalsContact C-N 3.27Å; R746-Q748 PolarHBondContact O-N 2.93Å; Q748-V750 PolarHBondContact O-N 2.97Å; Q748-N751 PolarHBondContact O-N 3.46Å; Q748-L752 VanDerWaalsContact O-CG 3.29Å; Q748-L752 WeakPolarHBondContact O-CG 3.45Å; Q748-L752 PolarHBondContact O-N 3.49Å; Q748-M776 HydrophobicContact CB-CE 4.27Å; Q748-M776 HydrophobicContact CG-CE 3.82Å
749	L	90.8	Very high	88.4	Confident	2 Å²	2	21.6 Å²	21.6	1%	0.01	11%	0.114	C	C	.	.	H	α-helix	trans	-58.7	-45.6	175.8	-72.4	172.1	0	0	0	112.2	L619 L623 F631 I744 L745 R746 N751 L752 L753 V802	L619-L749 HydrophobicContact CD1-CD2 4.45Å; L619-L749 HydrophobicContact CD2-CD2 4.15Å; L623-L749 HydrophobicContact CD1-CB 4.24Å; L623-L749 HydrophobicContact CD2-CB 4.42Å; L623-L749 HydrophobicContact CD2-CD1 4.32Å; F631-L749 HydrophobicContact CD2-CD1 3.65Å; F631-L749 HydrophobicContact CE2-CD1 4.05Å; I744-L749 HydrophobicContact CD1-CD2 3.64Å; I744-L749 HydrophobicContact CD1-CG 3.83Å; I744-L749 HydrophobicContact CG1-CD2 4.38Å; I744-L749 HydrophobicContact CG1-CG 4.1Å; I744-L749 HydrophobicContact CG2-CD1 4.09Å; I744-L749 HydrophobicContact CG2-CD2 4.39Å; I744-L749 HydrophobicContact CG2-CG 4.23Å; L745-L749 PolarHBondContact O-N 3.32Å; L745-L749 VanDerWaalsContact O-N 3.12Å; R746-L749 PolarHBondContact O-N 3.04Å; L749-N751 VanDerWaalsContact C-N 3.35Å; L749-N751 PolarHBondContact O-N 3.31Å; L749-L752 PolarHBondContact O-N 3.34Å; L749-L753 WeakPolarHBondContact O-CG 3.39Å; L749-L753 PolarHBondContact O-N 3.37Å; L749-L753 VanDerWaalsContact O-N 3.08Å; L749-V802 HydrophobicContact CD2-CG1 4.32Å; L749-V802 HydrophobicContact CD2-CG2 4.3Å
750	V	89.4	Confident	88.4	Confident	4 Å²	4	23.1 Å²	23.1	2%	0.024	13%	0.125	C	C	.	.	H	α-helix	trans	-62.8	-42.3	178.2	175.2	0	0	0	0	111.1	L623 R746 Q748 L752 L753 I754 P784 I786 V789	L623-V750 HydrophobicContact CD1-CG2 4.1Å; L623-V750 HydrophobicContact CD2-CG2 4.47Å; R746-V750 WeakPolarHBondContact O-CG2 3.39Å; R746-V750 PolarHBondContact O-N 3.14Å; Q748-V750 PolarHBondContact O-N 2.97Å; V750-L752 PolarHBondContact O-N 2.87Å; V750-L753 PolarHBondContact O-N 3.15Å; V750-I754 HydrophobicContact CG1-CD1 3.7Å; V750-I754 HydrophobicContact CG1-CG1 4.35Å; V750-I754 WeakPolarHBondContact O-CG1 3.26Å; V750-I754 PolarHBondContact O-N 3.02Å; V750-P784 HydrophobicContact CG1-CG 4.44Å; V750-P784 WeakPolarHBondContact CG1-O 3.1Å; V750-I786 HydrophobicContact CG2-CB 4.47Å; V750-V789 HydrophobicContact CG1-CG2 4.39Å
751	N	88.1	Confident	88.1	Confident	4 Å²	4	26.6 Å²	26.6	2%	0.021	14%	0.142	C	C	.	.	H	α-helix	trans	-64.5	-40	177.9	-162.8	-10.6	0	0	0	112	S747 Q748 L749 L753 I754 R755 E775 M776	S747-N751 WeakPolarHBondContact O-CB 3.47Å; S747-N751 PolarHBondContact O-N 3.33Å; Q748-N751 PolarHBondContact O-N 3.46Å; L749-N751 VanDerWaalsContact C-N 3.35Å; L749-N751 PolarHBondContact O-N 3.31Å; N751-L753 VanDerWaalsContact C-N 3.32Å; N751-L753 PolarHBondContact O-N 2.94Å; N751-I754 PolarHBondContact O-N 3.27Å; N751-R755 WeakPolarHBondContact O-CG 3.34Å; N751-R755 PolarHBondContact O-N 2.99Å; N751-R755 WeakPolarHBondContact OD1-CD 3.33Å; N751-R755 PolarHBondContact OD1-NE 3.36Å; N751-E775 PolarHBondContact ND2-O 3.28Å; N751-M776 WeakPolarHBondContact ND2-CA 3.44Å; N751-M776 PolarHBondContact ND2-O 3.03Å
752	L	88.8	Confident	87.8	Confident	1 Å²	1	30.4 Å²	30.4	1%	0.005	17%	0.165	C	C	.	.	H	α-helix	trans	-59.8	-41.9	174.1	-68.2	173.1	0	0	0	112	I744 Q748 L749 V750 G756 V757 L771 V800 Y805	I744-L752 HydrophobicContact CD1-CD1 4.41Å; Q748-L752 VanDerWaalsContact O-CG 3.29Å; Q748-L752 WeakPolarHBondContact O-CG 3.45Å; Q748-L752 PolarHBondContact O-N 3.49Å; L749-L752 PolarHBondContact O-N 3.34Å; V750-L752 PolarHBondContact O-N 2.87Å; L752-G756 PolarHBondContact O-N 2.98Å; L752-V757 HydrophobicContact CB-CB 4.34Å; L752-V757 HydrophobicContact CD2-CB 3.96Å; L752-V757 HydrophobicContact CD2-CG1 3.96Å; L752-V757 HydrophobicContact CD2-CG2 4.08Å; L752-V757 PolarHBondContact O-N 3.08Å; L752-L771 HydrophobicContact CD2-CD2 4.31Å; L752-V800 HydrophobicContact CD1-CG1 4.41Å; L752-Y805 HydrophobicContact CD1-CD2 3.63Å; L752-Y805 HydrophobicContact CD1-CE2 4.28Å; L752-Y805 HydrophobicContact CD1-CG 4.01Å; L752-Y805 HydrophobicContact CD2-CD1 4.13Å; L752-Y805 HydrophobicContact CD2-CD2 3.53Å; L752-Y805 HydrophobicContact CD2-CE1 4.07Å; L752-Y805 HydrophobicContact CD2-CE2 3.42Å; L752-Y805 VanDerWaalsContact CD2-CE2 3.42Å; L752-Y805 HydrophobicContact CD2-CG 3.88Å; L752-Y805 HydrophobicContact CG-CD2 4.22Å
753	L	88.8	Confident	87.4	Confident	5 Å²	5	35.5 Å²	35.5	3%	0.026	19%	0.188	C	C	.	.	H	α-helix	trans	-67.7	-44	177.9	-67.5	175.4	0	0	0	112.2	V616 V620 L623 L749 V750 N751 R755 G756 I786 L794 V800	V616-L753 HydrophobicContact CG1-CD2 4.03Å; V616-L753 HydrophobicContact CG2-CD2 4.24Å; V620-L753 HydrophobicContact CG2-CD1 4.1Å; L623-L753 HydrophobicContact CD1-CD1 3.67Å; L749-L753 WeakPolarHBondContact O-CG 3.39Å; L749-L753 PolarHBondContact O-N 3.37Å; L749-L753 VanDerWaalsContact O-N 3.08Å; V750-L753 PolarHBondContact O-N 3.15Å; N751-L753 VanDerWaalsContact C-N 3.32Å; N751-L753 PolarHBondContact O-N 2.94Å; L753-R755 VanDerWaalsContact C-N 3.3Å; L753-R755 PolarHBondContact O-N 2.88Å; L753-G756 PolarHBondContact O-N 3.4Å; L753-G756 VanDerWaalsContact O-N 3.11Å; L753-I786 HydrophobicContact CD1-CD1 4.02Å; L753-L794 HydrophobicContact CD2-CD2 4.33Å; L753-V800 HydrophobicContact CD2-CG2 4.32Å
754	I	86.8	Confident	86.9	Confident	73 Å²	73	38.3 Å²	38.3	37%	0.374	21%	0.21	S	C	.	.	H	α-helix	trans	-63.4	-38.4	-179.8	-72.4	171.4	0	0	0	111.7	V750 N751 G756 P784 V789	V750-I754 HydrophobicContact CG1-CD1 3.7Å; V750-I754 HydrophobicContact CG1-CG1 4.35Å; V750-I754 WeakPolarHBondContact O-CG1 3.26Å; V750-I754 PolarHBondContact O-N 3.02Å; N751-I754 PolarHBondContact O-N 3.27Å; I754-G756 PolarHBondContact O-N 2.99Å; I754-P784 HydrophobicContact CD1-CB 3.74Å; I754-P784 HydrophobicContact CD1-CG 3.1Å; I754-V789 HydrophobicContact CD1-CG2 3.81Å; I754-V789 HydrophobicContact CG1-CB 4.42Å; I754-V789 HydrophobicContact CG1-CG1 4.14Å; I754-V789 HydrophobicContact CG1-CG2 3.51Å
755	R	86.4	Confident	86.3	Confident	74 Å²	74	40.6 Å²	40.6	28%	0.279	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.2	3.5	178.6	-62.1	-171.2	-173.9	-117.2	-7.1	113.4	N751 L753 V757 L771 E775 E778	N751-R755 WeakPolarHBondContact O-CG 3.34Å; N751-R755 PolarHBondContact O-N 2.99Å; N751-R755 WeakPolarHBondContact OD1-CD 3.33Å; N751-R755 PolarHBondContact OD1-NE 3.36Å; L753-R755 VanDerWaalsContact C-N 3.3Å; L753-R755 PolarHBondContact O-N 2.88Å; R755-V757 VanDerWaalsContact C-N 3.3Å; R755-V757 HydrophobicContact CB-CG2 4.16Å; R755-V757 PolarHBondContact O-N 3.16Å; R755-L771 HydrophobicContact CB-CD1 4.37Å; R755-L771 HydrophobicContact CG-CD1 4.45Å; R755-E775 VanDerWaalsContact NH1-CG 3.28Å; R755-E775 PolarHBondContact NH2-O 3.34Å; R755-E778 IonicContact CZ-OE2 3.84Å; R755-E778 IonicContact NH1-OE2 3.8Å; R755-E778 PolarHBondContact NH1-OE2 3.07Å; R755-E778 IonicContact NH2-OE2 2.69Å; R755-E778 PolarHBondContact NH2-OE2 3.33Å
756	G	85.3	Confident	85.5	Confident	34 Å²	34	43.3 Å²	43.3	35%	0.351	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.9	29.7	176.3	0	0	0	0	0	113.8	L752 L753 I754 C758	L752-G756 PolarHBondContact O-N 2.98Å; L753-G756 PolarHBondContact O-N 3.4Å; L753-G756 VanDerWaalsContact O-N 3.11Å; I754-G756 PolarHBondContact O-N 2.99Å; G756-C758 PolarHBondContact O-N 2.67Å; G756-C758 PolarHBondContact O-SG 3.44Å; G756-C758 VanDerWaalsContact O-SG 3.35Å
757	V	86.8	Confident	85	Confident	4 Å²	4	45.3 Å²	45.3	2%	0.024	27%	0.268	C	S	.	.			trans	-74.7	87.6	-178.9	-179	0	0	0	0	109.6	L752 R755 Q768 P769 L771 Y805	L752-V757 HydrophobicContact CB-CB 4.34Å; L752-V757 HydrophobicContact CD2-CB 3.96Å; L752-V757 HydrophobicContact CD2-CG1 3.96Å; L752-V757 HydrophobicContact CD2-CG2 4.08Å; L752-V757 PolarHBondContact O-N 3.08Å; R755-V757 VanDerWaalsContact C-N 3.3Å; R755-V757 HydrophobicContact CB-CG2 4.16Å; R755-V757 PolarHBondContact O-N 3.16Å; V757-Q768 HydrophobicContact CG1-CG 3.52Å; V757-P769 HydrophobicContact CG1-CG 4.44Å; V757-P769 WeakPolarHBondContact CG1-O 3.24Å; V757-P769 HydrophobicContact CG2-CG 4.48Å; V757-L771 HydrophobicContact CG2-CB 4.49Å; V757-Y805 HydrophobicContact CG1-CE2 4.03Å
758	C	88.1	Confident	84.8	Confident	17 Å²	17	44.9 Å²	44.9	12%	0.115	26%	0.263	C	S	.	.			trans	-154.7	164.5	-178	58.6	0	0	0	0	111.2	V616 G756 M798 I799 V800	V616-C758 HydrophobicContact CG2-CB 4.35Å; G756-C758 PolarHBondContact O-N 2.67Å; G756-C758 PolarHBondContact O-SG 3.44Å; G756-C758 VanDerWaalsContact O-SG 3.35Å; C758-M798 HydrophobicContact CB-CB 3.95Å; C758-M798 WeakPolarHBondContact SG-CE 3.27Å; C758-I799 CarbonylContact C-O 3.59Å; C758-I799 VanDerWaalsContact CA-O 3.26Å; C758-I799 WeakPolarHBondContact CA-O 3.37Å; C758-I799 WeakPolarHBondContact CB-O 3.47Å; C758-V800 HydrophobicContact CB-CG2 4.02Å
759	Y	88.7	Confident	84.5	Confident	19 Å²	19	47.1 Å²	47.1	8%	0.075	28%	0.28	C	S	.	.	B	Isolated β-bridge	trans	-134.4	160.5	176.9	67	-80.7	0	0	0	110.8	H613 Q763 Q768 M798 I799 D801	H613-Y759 PolarHBondContact ND1-OH 3.35Å; Y759-Q763 WeakPolarHBondContact CD2-O 3.5Å; Y759-Q763 WeakPolarHBondContact CE2-O 3.4Å; Y759-Q768 HydrophobicContact CD1-CB 4.22Å; Y759-M798 WeakPolarHBondContact O-CA 3.4Å; Y759-I799 HydrophobicContact CD1-CB 4.42Å; Y759-I799 VanDerWaalsContact CD1-O 3.22Å; Y759-I799 WeakPolarHBondContact CD1-O 3.3Å; Y759-I799 HydrophobicContact CE1-CB 3.89Å; Y759-I799 HydrophobicContact CE1-CG2 3.8Å; Y759-I799 HydrophobicContact CE2-CB 4.12Å; Y759-I799 HydrophobicContact CE2-CD1 4.37Å; Y759-I799 HydrophobicContact CE2-CG2 4.41Å; Y759-I799 PolarHBondContact N-O 3.39Å; Y759-I799 PolarHBondContact O-N 3.39Å; Y759-I799 WeakPolarHBondContact OH-CG2 3.17Å; Y759-D801 HydrophobicContact CE1-CB 3.98Å
760	S	85.6	Confident	84.2	Confident	49 Å²	49	55 Å²	55	34%	0.343	31%	0.31	S	S	.	.			trans	-79	149.5	178.5	-177.6	0	0	0	0	111.2	N762 Q763	S760-N762 PolarHBondContact O-N 3.02Å; S760-Q763 PolarHBondContact O-N 3.42Å
761	E	81.3	Confident	84.1	Confident	77 Å²	77	55.5 Å²	55.5	36%	0.36	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56	-26.5	179.4	-53	-163.8	127.8	0	0	113.3	R615 Y720 Q763 R797 I799	R615-E761 IonicContact CZ-OE1 3.71Å; R615-E761 VanDerWaalsContact CZ-OE1 3.22Å; R615-E761 IonicContact NE-OE1 3.96Å; R615-E761 PolarHBondContact NE-OE1 3.08Å; R615-E761 IonicContact NH2-OE1 2.77Å; R615-E761 PolarHBondContact NH2-OE1 2.88Å; R615-E761 IonicContact NH2-OE2 2.81Å; Y720-E761 PolarHBondContact OH-OE1 2.97Å; Y720-E761 VanDerWaalsContact OH-OE1 3.09Å; E761-Q763 VanDerWaalsContact C-N 3.29Å; E761-Q763 PolarHBondContact O-N 2.99Å; E761-R797 WeakPolarHBondContact CG-O 3.18Å; E761-I799 HydrophobicContact CB-CD1 4.22Å; E761-I799 HydrophobicContact CG-CD1 3.84Å; E761-I799 HydrophobicContact CG-CG1 4.07Å
762	N	79.3	Confident	84	Confident	154 Å²	154	57.2 Å²	57.2	82%	0.824	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.9	-3.9	-179.8	-61.5	-10.4	0	0	0	113.6	S760	S760-N762 PolarHBondContact O-N 3.02Å
763	Q	79.9	Confident	83.7	Confident	106 Å²	106	60.2 Å²	60.2	50%	0.495	34%	0.337	S	S	.	.	S	Bend	trans	-115.9	156.8	-177.2	-64.3	-178.2	-2.1	0	0	110.8	Y759 S760 E761 T767	Y759-Q763 WeakPolarHBondContact CD2-O 3.5Å; Y759-Q763 WeakPolarHBondContact CE2-O 3.4Å; S760-Q763 PolarHBondContact O-N 3.42Å; E761-Q763 VanDerWaalsContact C-N 3.29Å; E761-Q763 PolarHBondContact O-N 2.99Å; Q763-T767 HydrophobicContact CB-CG2 4.14Å; Q763-T767 WeakPolarHBondContact CB-OG1 3.38Å; Q763-T767 PolarHBondContact OE1-OG1 3.3Å
764	S	80.2	Confident	83.3	Confident	76 Å²	76	64 Å²	64	53%	0.531	36%	0.36	S	S	.	.			trans	-77.8	158.2	174.8	64.1	0	0	0	0	111.2	A766 T767	S764-A766 PolarHBondContact O-N 3.12Å; S764-T767 PolarHBondContact O-N 3.48Å; S764-T767 PolarHBondContact O-OG1 3.16Å
765	S	78.2	Confident	83.2	Confident	48 Å²	48	64 Å²	64	34%	0.336	36%	0.359	S	S	.	.	G	3₁₀ helix	trans	-59.2	-17	177.2	59.7	0	0	0	0	113.8	T767 Q768 D801	S765-T767 PolarHBondContact O-N 3.38Å; S765-Q768 WeakPolarHBondContact O-CB 3.23Å; S765-Q768 PolarHBondContact O-N 3.11Å; S765-D801 VanDerWaalsContact CB-OD2 3.24Å; S765-D801 WeakPolarHBondContact CB-OD2 3.18Å; S765-D801 PolarHBondContact OG-OD2 3.47Å
766	A	76	Confident	83	Confident	89 Å²	89	61 Å²	61	74%	0.736	35%	0.348	S	S	*	.	G	3₁₀ helix	trans	-66.3	-19.5	174.7	0	0	0	0	0	113.8	S764 Q768	S764-A766 PolarHBondContact O-N 3.12Å; A766-Q768 VanDerWaalsContact C-N 3.27Å
767	T	78.6	Confident	82.7	Confident	71 Å²	71	60.3 Å²	60.3	44%	0.436	34%	0.337	S	S	.	.	G	3₁₀ helix	trans	-82.2	-6.9	175.6	66.8	0	0	0	0	113.1	Q763 S764 S765	Q763-T767 HydrophobicContact CB-CG2 4.14Å; Q763-T767 WeakPolarHBondContact CB-OG1 3.38Å; Q763-T767 PolarHBondContact OE1-OG1 3.3Å; S764-T767 PolarHBondContact O-N 3.48Å; S764-T767 PolarHBondContact O-OG1 3.16Å; S765-T767 PolarHBondContact O-N 3.38Å
768	Q	83.8	Confident	82.4	Confident	15 Å²	15	65.2 Å²	65.2	7%	0.07	36%	0.36	C	S	.	.	S	Bend	trans	-65.6	132.5	176.8	-175.6	171.7	-75.5	0	0	110.8	V757 Y759 S765 A766 R770 D801	V757-Q768 HydrophobicContact CG1-CG 3.52Å; Y759-Q768 HydrophobicContact CD1-CB 4.22Å; S765-Q768 WeakPolarHBondContact O-CB 3.23Å; S765-Q768 PolarHBondContact O-N 3.11Å; A766-Q768 VanDerWaalsContact C-N 3.27Å; Q768-R770 PolarHBondContact O-N 3.03Å; Q768-D801 PolarHBondContact NE2-O 2.92Å
769	P	84.2	Confident	81.9	Confident	68 Å²	68	67 Å²	67	44%	0.442	37%	0.368	S	S	.	.	P	Polyproline II helix	trans	-62.9	131.2	174.7	26.3	-33.9	0	0	0	110.3	V757 Y805	V757-P769 HydrophobicContact CG1-CG 4.44Å; V757-P769 WeakPolarHBondContact CG1-O 3.24Å; V757-P769 HydrophobicContact CG2-CG 4.48Å; P769-Y805 PolarHBondContact O-OH 3.33Å
770	R	84.6	Confident	81.4	Confident	168 Å²	168	66.8 Å²	66.8	63%	0.634	37%	0.368	S	S	*	.	P	Polyproline II helix	trans	-83.2	131.4	176.8	-74.5	-168.8	170.9	-149.9	-11.1	110.4	E55 E59 Q768	E55-R770 IonicContact OE1-CZ 2.74Å; E55-R770 VanDerWaalsContact OE1-CZ 3.27Å; E55-R770 IonicContact OE1-NH1 3.48Å; E55-R770 PolarHBondContact OE1-NH1 3.21Å; E55-R770 IonicContact OE1-NH2 2.75Å; E55-R770 PolarHBondContact OE1-NH2 3.27Å; E55-R770 IonicContact OE2-NH2 3.72Å; E59-R770 IonicContact OE1-NH1 3.99Å; E59-R770 PolarHBondContact OE1-NH1 2.96Å; Q768-R770 PolarHBondContact O-N 3.03Å
771	L	86.1	Confident	80.7	Confident	14 Å²	14	66.7 Å²	66.7	7%	0.073	37%	0.365	C	S	.	.	P	Polyproline II helix	trans	-98	130.7	178.5	-163.6	71.6	0	0	0	110.7	P56 L752 R755 V757 E775 M776 Y805	P56-L771 WeakPolarHBondContact CG-O 3.18Å; L752-L771 HydrophobicContact CD2-CD2 4.31Å; R755-L771 HydrophobicContact CB-CD1 4.37Å; R755-L771 HydrophobicContact CG-CD1 4.45Å; V757-L771 HydrophobicContact CG2-CB 4.49Å; L771-E775 HydrophobicContact CD1-CB 3.71Å; L771-E775 HydrophobicContact CD1-CG 4.38Å; L771-E775 WeakPolarHBondContact CD1-OE2 3.27Å; L771-E775 HydrophobicContact CG-CB 3.9Å; L771-M776 HydrophobicContact CD2-CG 3.49Å; L771-M776 VanDerWaalsContact CD2-CG 3.49Å; L771-M776 HydrophobicContact CG-CG 4.08Å; L771-Y805 HydrophobicContact CB-CE1 3.84Å; L771-Y805 PolarHBondContact N-OH 3.11Å
772	S	85.9	Confident	80.6	Confident	40 Å²	40	70.7 Å²	70.7	28%	0.28	38%	0.377	S	S	.	.	P	Polyproline II helix	trans	-76	157.1	176.9	67	0	0	0	0	112	T774 E775 M776	S772-T774 VanDerWaalsContact C-N 3.26Å; S772-T774 PolarHBondContact O-N 3.11Å; S772-T774 PolarHBondContact OG-OG1 2.89Å; S772-T774 VanDerWaalsContact OG-OG1 3.06Å; S772-E775 WeakPolarHBondContact CB-OE2 3.37Å; S772-E775 PolarHBondContact N-OE2 2.76Å; S772-E775 WeakPolarHBondContact O-CB 3.42Å; S772-E775 PolarHBondContact O-N 3.4Å; S772-E775 WeakPolarHBondContact OG-CB 3.46Å; S772-E775 WeakPolarHBondContact OG-CG 3.37Å; S772-E775 PolarHBondContact OG-N 3.45Å; S772-E775 PolarHBondContact OG-OE2 3.28Å; S772-M776 PolarHBondContact O-N 3.34Å
773	F	83.7	Confident	80.6	Confident	64 Å²	64	67.3 Å²	67.3	28%	0.281	35%	0.354	S	S	.	.	H	α-helix	trans	-62	-32.8	177.3	-176.7	-97.9	0	0	0	113.1	P56 Y57 V60 E775 M776 T777	P56-F773 HydrophobicContact CB-CB 4.34Å; Y57-F773 HydrophobicContact CD2-CD1 4.35Å; Y57-F773 AromaticContact CD2-CD2 3.75Å; Y57-F773 HydrophobicContact CD2-CD2 3.75Å; Y57-F773 HydrophobicContact CD2-CE1 4.14Å; Y57-F773 AromaticContact CD2-CE2 3.51Å; Y57-F773 HydrophobicContact CD2-CE2 3.51Å; Y57-F773 HydrophobicContact CD2-CG 4.17Å; Y57-F773 AromaticContact CD2-CZ 3.72Å; Y57-F773 HydrophobicContact CD2-CZ 3.72Å; Y57-F773 HydrophobicContact CE2-CE1 4.4Å; Y57-F773 HydrophobicContact CE2-CE2 4.29Å; Y57-F773 HydrophobicContact CE2-CZ 4.08Å; Y57-F773 HydrophobicContact CG-CD2 4.29Å; Y57-F773 HydrophobicContact CG-CE2 4.17Å; V60-F773 HydrophobicContact CG2-CB 3.73Å; V60-F773 HydrophobicContact CG2-CD1 4.46Å; V60-F773 HydrophobicContact CG2-CG 4.31Å; F773-E775 VanDerWaalsContact C-N 3.32Å; F773-E775 PolarHBondContact O-N 2.93Å; F773-M776 PolarHBondContact O-N 3.43Å; F773-T777 HydrophobicContact CD1-CG2 4.41Å; F773-T777 HydrophobicContact CE1-CG2 3.88Å; F773-T777 HydrophobicContact CE2-CG2 4.14Å; F773-T777 HydrophobicContact CZ-CG2 3.72Å; F773-T777 PolarHBondContact O-N 3.43Å; F773-T777 PolarHBondContact O-OG1 3.33Å
774	T	81.1	Confident	80.6	Confident	83 Å²	83	63.8 Å²	63.8	51%	0.509	34%	0.34	S	S	.	.	H	α-helix	trans	-64.8	-37.7	176.8	37.5	0	0	0	0	112.3	S772 T777 E778	S772-T774 VanDerWaalsContact C-N 3.26Å; S772-T774 PolarHBondContact O-N 3.11Å; S772-T774 PolarHBondContact OG-OG1 2.89Å; S772-T774 VanDerWaalsContact OG-OG1 3.06Å; T774-T777 PolarHBondContact O-N 2.77Å; T774-T777 PolarHBondContact O-OG1 3.28Å; T774-E778 PolarHBondContact O-N 2.82Å; T774-E778 VanDerWaalsContact O-N 3.16Å
775	E	83.6	Confident	80.6	Confident	73 Å²	73	63.6 Å²	63.6	34%	0.341	33%	0.333	S	S	.	.	H	α-helix	trans	-71.8	-39.4	175.7	-74.5	170.3	147.3	0	0	111.4	N751 R755 L771 S772 F773 T777 E778	N751-E775 PolarHBondContact ND2-O 3.28Å; R755-E775 VanDerWaalsContact NH1-CG 3.28Å; R755-E775 PolarHBondContact NH2-O 3.34Å; L771-E775 HydrophobicContact CD1-CB 3.71Å; L771-E775 HydrophobicContact CD1-CG 4.38Å; L771-E775 WeakPolarHBondContact CD1-OE2 3.27Å; L771-E775 HydrophobicContact CG-CB 3.9Å; S772-E775 WeakPolarHBondContact CB-OE2 3.37Å; S772-E775 PolarHBondContact N-OE2 2.76Å; S772-E775 WeakPolarHBondContact O-CB 3.42Å; S772-E775 PolarHBondContact O-N 3.4Å; S772-E775 WeakPolarHBondContact OG-CB 3.46Å; S772-E775 WeakPolarHBondContact OG-CG 3.37Å; S772-E775 PolarHBondContact OG-N 3.45Å; S772-E775 PolarHBondContact OG-OE2 3.28Å; F773-E775 VanDerWaalsContact C-N 3.32Å; F773-E775 PolarHBondContact O-N 2.93Å; E775-T777 PolarHBondContact O-N 2.91Å; E775-E778 PolarHBondContact O-N 2.77Å
776	M	81.9	Confident	80.7	Confident	12 Å²	12	61.3 Å²	61.3	6%	0.059	32%	0.317	C	S	.	.	H	α-helix	trans	-59.8	-29	174	-73	-172.2	75.1	0	0	113.6	N54 P56 Q748 N751 L771 S772 F773 Y805	N54-M776 WeakPolarHBondContact ND2-CE 3.4Å; P56-M776 HydrophobicContact CB-SD 4.33Å; P56-M776 HydrophobicContact CG-SD 4.13Å; Q748-M776 HydrophobicContact CB-CE 4.27Å; Q748-M776 HydrophobicContact CG-CE 3.82Å; N751-M776 WeakPolarHBondContact ND2-CA 3.44Å; N751-M776 PolarHBondContact ND2-O 3.03Å; L771-M776 HydrophobicContact CD2-CG 3.49Å; L771-M776 VanDerWaalsContact CD2-CG 3.49Å; L771-M776 HydrophobicContact CG-CG 4.08Å; S772-M776 PolarHBondContact O-N 3.34Å; F773-M776 PolarHBondContact O-N 3.43Å; M776-Y805 HydrophobicContact CE-CD1 4.31Å; M776-Y805 HydrophobicContact SD-CD1 3.92Å; M776-Y805 HydrophobicContact SD-CE1 4.42Å
777	T	78.9	Confident	80.9	Confident	19 Å²	19	62.9 Å²	62.9	12%	0.117	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.1	3.2	-174.5	52.8	0	0	0	0	113.9	F773 T774 E775 D779 Y780	F773-T777 HydrophobicContact CD1-CG2 4.41Å; F773-T777 HydrophobicContact CE1-CG2 3.88Å; F773-T777 HydrophobicContact CE2-CG2 4.14Å; F773-T777 HydrophobicContact CZ-CG2 3.72Å; F773-T777 PolarHBondContact O-N 3.43Å; F773-T777 PolarHBondContact O-OG1 3.33Å; T774-T777 PolarHBondContact O-N 2.77Å; T774-T777 PolarHBondContact O-OG1 3.28Å; E775-T777 PolarHBondContact O-N 2.91Å; T777-D779 PolarHBondContact O-N 3.16Å; T777-Y780 WeakPolarHBondContact O-CB 2.98Å; T777-Y780 PolarHBondContact O-N 3.1Å
778	E	80.3	Confident	80.8	Confident	108 Å²	108	66.5 Å²	66.5	51%	0.505	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-41.2	-176.9	-169.2	174.5	-175.5	0	0	112.7	R755 T774 E775 Y780	R755-E778 IonicContact CZ-OE2 3.84Å; R755-E778 IonicContact NH1-OE2 3.8Å; R755-E778 PolarHBondContact NH1-OE2 3.07Å; R755-E778 IonicContact NH2-OE2 2.69Å; R755-E778 PolarHBondContact NH2-OE2 3.33Å; T774-E778 PolarHBondContact O-N 2.82Å; T774-E778 VanDerWaalsContact O-N 3.16Å; E775-E778 PolarHBondContact O-N 2.77Å; E778-Y780 VanDerWaalsContact C-N 3.26Å; E778-Y780 PolarHBondContact O-N 2.99Å
779	D	78.1	Confident	80.5	Confident	55 Å²	55	66.5 Å²	66.5	29%	0.294	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81	-3.4	-177.9	-57.1	-52.4	0	0	0	113.4	T777 R782 Y783	T777-D779 PolarHBondContact O-N 3.16Å; D779-R782 CarbonylContact O-C 3.09Å; D779-R782 PolarHBondContact O-N 3.03Å; D779-Y783 HydrophobicContact CB-CD1 4.11Å
780	Y	77.4	Confident	80.1	Confident	14 Å²	14	68.8 Å²	68.8	6%	0.055	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.2	132	175.2	-177.3	-90.8	0	0	0	109.9	Q212 R229 D231 K234 T777 E778 Y783	Q212-Y780 VanDerWaalsContact NE2-CE1 3.35Å; R229-Y780 HydrophobicContact CB-CD1 3.83Å; R229-Y780 HydrophobicContact CB-CE1 4.44Å; R229-Y780 HydrophobicContact CG-CD1 4.46Å; D231-Y780 WeakPolarHBondContact OD1-CE2 3.32Å; D231-Y780 PolarHBondContact OD1-OH 3.29Å; K234-Y780 WeakPolarHBondContact CD-OH 3.34Å; T777-Y780 WeakPolarHBondContact O-CB 2.98Å; T777-Y780 PolarHBondContact O-N 3.1Å; E778-Y780 VanDerWaalsContact C-N 3.26Å; E778-Y780 PolarHBondContact O-N 2.99Å; Y780-Y783 HydrophobicContact CD2-CE2 4.25Å
781	P	72.8	Confident	79.5	Confident	46 Å²	46	63.8 Å²	63.8	30%	0.299	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	cis	-102	4.3	17.9	37.6	-35.9	0	0	0	116.4
782	R	77.8	Confident	78.6	Confident	161 Å²	161	67.9 Å²	67.9	61%	0.608	35%	0.352	S	S	*	.	S	Bend	trans	-122.9	97.1	178.1	-75.3	-168.1	-165.1	174.7	7.4	109.3	D779	D779-R782 CarbonylContact O-C 3.09Å; D779-R782 PolarHBondContact O-N 3.03Å
783	Y	79.8	Confident	77.9	Confident	84 Å²	84	73.1 Å²	73.1	33%	0.329	38%	0.376	S	S	.	.	P	Polyproline II helix	trans	-64.6	138.4	170.2	-61.3	-76.5	0	0	0	109.8	D779 Y780	D779-Y783 HydrophobicContact CB-CD1 4.11Å; Y780-Y783 HydrophobicContact CD2-CE2 4.25Å
784	P	80	Confident	77.6	Confident	31 Å²	31	71 Å²	71	20%	0.201	37%	0.367	C	S	.	.	P	Polyproline II helix	trans	-59.5	150	171.4	25.4	-34.4	0	0	0	110.3	V750 I754 E788	V750-P784 HydrophobicContact CG1-CG 4.44Å; V750-P784 WeakPolarHBondContact CG1-O 3.1Å; I754-P784 HydrophobicContact CD1-CB 3.74Å; I754-P784 HydrophobicContact CD1-CG 3.1Å; P784-E788 WeakPolarHBondContact CA-OE2 3.42Å; P784-E788 WeakPolarHBondContact CB-OE2 3.32Å
785	D	80.3	Confident	77.6	Confident	72 Å²	72	71.2 Å²	71.2	39%	0.385	37%	0.365	S	S	.	.	P	Polyproline II helix	trans	-85.8	156.8	176.8	-160.2	2.8	0	0	0	110.9	R746 H787 E788	R746-D785 IonicContact NH2-OD1 3.65Å; D785-H787 PolarHBondContact O-N 3.44Å; D785-H787 VanDerWaalsContact O-N 3.11Å; D785-H787 IonicContact OD2-CD2 3.47Å; D785-H787 PolarHBondContact OD2-CD2 2.69Å; D785-E788 HydrophobicContact CB-CG 4.44Å; D785-E788 PolarHBondContact N-OE2 2.99Å; D785-E788 WeakPolarHBondContact O-CB 3.38Å; D785-E788 PolarHBondContact O-N 3.06Å
786	I	80.6	Confident	77.6	Confident	0 Å²	0	70.7 Å²	70.7	0%	0	37%	0.368	C	S	.	.	G	3₁₀ helix	trans	-60.6	-24.4	179	-169.8	58.3	0	0	0	112.4	L623 R624 V750 L753 E788 V789	L623-I786 HydrophobicContact CB-CB 4.35Å; L623-I786 HydrophobicContact CB-CD1 4.3Å; L623-I786 HydrophobicContact CB-CG1 3.88Å; L623-I786 HydrophobicContact CD1-CD1 3.93Å; L623-I786 HydrophobicContact CD1-CG1 4.42Å; R624-I786 HydrophobicContact CG-CG1 4.13Å; R624-I786 HydrophobicContact CG-CG2 4.07Å; V750-I786 HydrophobicContact CG2-CB 4.47Å; L753-I786 HydrophobicContact CD1-CD1 4.02Å; I786-E788 VanDerWaalsContact C-N 3.3Å; I786-V789 HydrophobicContact CD1-CG2 4.25Å; I786-V789 PolarHBondContact O-N 3.42Å
787	H	80.8	Confident	77.7	Confident	123 Å²	123	78.8 Å²	78.8	57%	0.569	40%	0.398	S	S	*	.	G	3₁₀ helix	trans	-74.8	-18.9	177.1	-61.1	-65.7	0	0	0	113.2	D785 V789	D785-H787 PolarHBondContact O-N 3.44Å; D785-H787 VanDerWaalsContact O-N 3.11Å; D785-H787 IonicContact OD2-CD2 3.47Å; D785-H787 PolarHBondContact OD2-CD2 2.69Å; H787-V789 VanDerWaalsContact C-N 3.32Å
788	E	76.1	Confident	78.1	Confident	146 Å²	146	80.1 Å²	80.1	68%	0.682	40%	0.404	S	S	*	.	G	3₁₀ helix	trans	-85.9	-7.9	176.9	-59.5	179.1	163.1	0	0	112.2	P784 D785 I786	P784-E788 WeakPolarHBondContact CA-OE2 3.42Å; P784-E788 WeakPolarHBondContact CB-OE2 3.32Å; D785-E788 HydrophobicContact CB-CG 4.44Å; D785-E788 PolarHBondContact N-OE2 2.99Å; D785-E788 WeakPolarHBondContact O-CB 3.38Å; D785-E788 PolarHBondContact O-N 3.06Å; I786-E788 VanDerWaalsContact C-N 3.3Å
789	V	77.3	Confident	78.5	Confident	15 Å²	15	75.7 Å²	75.7	9%	0.091	38%	0.383	C	S	.	.	S	Bend	trans	-83.6	122.6	-178.2	-172.3	0	0	0	0	110.8	V750 I754 I786 H787 L791 L794	V750-V789 HydrophobicContact CG1-CG2 4.39Å; I754-V789 HydrophobicContact CD1-CG2 3.81Å; I754-V789 HydrophobicContact CG1-CB 4.42Å; I754-V789 HydrophobicContact CG1-CG1 4.14Å; I754-V789 HydrophobicContact CG1-CG2 3.51Å; I786-V789 HydrophobicContact CD1-CG2 4.25Å; I786-V789 PolarHBondContact O-N 3.42Å; H787-V789 VanDerWaalsContact C-N 3.32Å; V789-L791 PolarHBondContact O-N 3.34Å; V789-L794 HydrophobicContact CG1-CD1 3.61Å
790	D	75.1	Confident	79.1	Confident	117 Å²	117	73.1 Å²	73.1	63%	0.626	37%	0.369	S	S	*	.			trans	-71.3	96.3	174	-100.4	-29.1	0	0	0	111.1	A792 L793	D790-A792 PolarHBondContact O-N 3.17Å; D790-A792 VanDerWaalsContact O-N 3.16Å; D790-L793 HydrophobicContact CB-CD1 4.06Å; D790-L793 HydrophobicContact CB-CG 4.38Å; D790-L793 PolarHBondContact O-N 2.71Å
791	L	72.8	Confident	79.7	Confident	62 Å²	62	73.2 Å²	73.2	33%	0.325	37%	0.371	S	S	.	.	G	3₁₀ helix	trans	-62.4	-19.9	177.7	-69	178.9	0	0	0	113.7	V620 R624 V789 L793 L794	V620-L791 HydrophobicContact CB-CD2 4.38Å; V620-L791 HydrophobicContact CG1-CD1 4.16Å; V620-L791 HydrophobicContact CG1-CD2 3.69Å; V620-L791 HydrophobicContact CG2-CD2 3.77Å; R624-L791 VanDerWaalsContact NH1-CD1 3.31Å; V789-L791 PolarHBondContact O-N 3.34Å; L791-L793 PolarHBondContact O-N 2.96Å; L791-L794 PolarHBondContact O-N 3.46Å; L791-L794 VanDerWaalsContact O-N 3.13Å; L791-L794 VanDerWaalsContact O-O 3.11Å
792	A	67.3	Low	80.5	Confident	101 Å²	101	71 Å²	71	84%	0.835	36%	0.357	S	S	*	.	G	3₁₀ helix	trans	-64	-24.7	177.2	0	0	0	0	0	112.6	D790	D790-A792 PolarHBondContact O-N 3.17Å; D790-A792 VanDerWaalsContact O-N 3.16Å
793	L	69.6	Low	80.9	Confident	149 Å²	149	66.2 Å²	66.2	78%	0.78	35%	0.345	S	S	*	.	G	3₁₀ helix	trans	-86	-12.6	177.8	-63.4	171.1	0	0	0	112.7	D790 L791	D790-L793 HydrophobicContact CB-CD1 4.06Å; D790-L793 HydrophobicContact CB-CG 4.38Å; D790-L793 PolarHBondContact O-N 2.71Å; L791-L793 PolarHBondContact O-N 2.96Å
794	L	78.1	Confident	81.3	Confident	20 Å²	20	63.2 Å²	63.2	11%	0.105	34%	0.336	C	S	.	.	S	Bend	trans	-105.4	116.3	-176.2	-81.4	143.3	0	0	0	110.3	V616 L753 V789 L791 P796	V616-L794 HydrophobicContact CG1-CB 4.31Å; V616-L794 HydrophobicContact CG1-CD2 4.07Å; L753-L794 HydrophobicContact CD2-CD2 4.33Å; V789-L794 HydrophobicContact CG1-CD1 3.61Å; L791-L794 PolarHBondContact O-N 3.46Å; L791-L794 VanDerWaalsContact O-N 3.13Å; L791-L794 VanDerWaalsContact O-O 3.11Å; L794-P796 WeakPolarHBondContact O-CD 3.2Å
795	N	82.1	Confident	81.8	Confident	88 Å²	88	61.9 Å²	61.9	47%	0.471	33%	0.327	S	S	.	.			trans	-73.9	119.9	174.4	-172.9	-14.5	0	0	0	109.7	R797 M798	N795-R797 PolarHBondContact O-N 3.45Å; N795-R797 VanDerWaalsContact O-N 3.13Å; N795-R797 PolarHBondContact OD1-N 3.21Å; N795-M798 HydrophobicContact CB-CE 3.53Å; N795-M798 HydrophobicContact CB-CG 3.96Å; N795-M798 HydrophobicContact CB-SD 4.21Å; N795-M798 PolarHBondContact O-N 3.41Å; N795-M798 VanDerWaalsContact O-N 3.12Å
796	P	82.1	Confident	82.2	Confident	62 Å²	62	59.2 Å²	59.2	40%	0.403	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-22.6	-171.6	23.6	-35	0	0	0	114.3	Q617 L794	Q617-P796 HydrophobicContact CB-CB 3.99Å; Q617-P796 PolarHBondContact N-O 2.94Å; L794-P796 WeakPolarHBondContact O-CD 3.2Å
797	R	85.6	Confident	82.5	Confident	182 Å²	182	59.8 Å²	59.8	69%	0.687	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.1	-9.2	-179.9	-65.3	-172.9	-179.5	173.5	0.1	114.1	E761 N795	E761-R797 WeakPolarHBondContact CG-O 3.18Å; N795-R797 PolarHBondContact O-N 3.45Å; N795-R797 VanDerWaalsContact O-N 3.13Å; N795-R797 PolarHBondContact OD1-N 3.21Å
798	M	87.3	Confident	82.7	Confident	47 Å²	47	57.4 Å²	57.4	23%	0.232	31%	0.313	C	S	.	.			trans	-68.8	151.8	175.5	-68.6	-167.3	-70	0	0	110.6	R615 V616 C758 Y759 N795	R615-M798 WeakPolarHBondContact CA-O 2.99Å; V616-M798 HydrophobicContact CG2-CB 4.25Å; V616-M798 WeakPolarHBondContact CG2-O 3.49Å; V616-M798 PolarHBondContact N-O 3.17Å; C758-M798 HydrophobicContact CB-CB 3.95Å; C758-M798 WeakPolarHBondContact SG-CE 3.27Å; Y759-M798 WeakPolarHBondContact O-CA 3.4Å; N795-M798 HydrophobicContact CB-CE 3.53Å; N795-M798 HydrophobicContact CB-CG 3.96Å; N795-M798 HydrophobicContact CB-SD 4.21Å; N795-M798 PolarHBondContact O-N 3.41Å; N795-M798 VanDerWaalsContact O-N 3.12Å
799	I	88.4	Confident	83	Confident	14 Å²	14	53 Å²	53	7%	0.072	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	143.2	-179.1	-54.7	175	0	0	0	108.6	H613 R615 Y720 C758 Y759 E761	H613-I799 HydrophobicContact CB-CG2 3.98Å; R615-I799 HydrophobicContact CG-CG1 4.43Å; Y720-I799 WeakPolarHBondContact OH-CD1 3.49Å; C758-I799 CarbonylContact C-O 3.59Å; C758-I799 VanDerWaalsContact CA-O 3.26Å; C758-I799 WeakPolarHBondContact CA-O 3.37Å; C758-I799 WeakPolarHBondContact CB-O 3.47Å; Y759-I799 HydrophobicContact CD1-CB 4.42Å; Y759-I799 VanDerWaalsContact CD1-O 3.22Å; Y759-I799 WeakPolarHBondContact CD1-O 3.3Å; Y759-I799 HydrophobicContact CE1-CB 3.89Å; Y759-I799 HydrophobicContact CE1-CG2 3.8Å; Y759-I799 HydrophobicContact CE2-CB 4.12Å; Y759-I799 HydrophobicContact CE2-CD1 4.37Å; Y759-I799 HydrophobicContact CE2-CG2 4.41Å; Y759-I799 PolarHBondContact N-O 3.39Å; Y759-I799 PolarHBondContact O-N 3.39Å; Y759-I799 WeakPolarHBondContact OH-CG2 3.17Å; E761-I799 HydrophobicContact CB-CD1 4.22Å; E761-I799 HydrophobicContact CG-CD1 3.84Å; E761-I799 HydrophobicContact CG-CG1 4.07Å
800	V	90.4	Very high	83.5	Confident	1 Å²	1	52.5 Å²	52.5	1%	0.006	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	123.8	172.5	179.4	0	0	0	0	107.7	T614 V616 L619 L752 L753 C758 V802	T614-V800 PolarHBondContact N-O 2.98Å; T614-V800 VanDerWaalsContact N-O 3.11Å; T614-V800 PolarHBondContact O-N 2.84Å; V616-V800 HydrophobicContact CG2-CG2 3.71Å; L619-V800 HydrophobicContact CD1-CB 3.88Å; L619-V800 HydrophobicContact CD1-CG1 4.33Å; L619-V800 HydrophobicContact CD1-CG2 4Å; L752-V800 HydrophobicContact CD1-CG1 4.41Å; L753-V800 HydrophobicContact CD2-CG2 4.32Å; C758-V800 HydrophobicContact CB-CG2 4.02Å; V800-V802 HydrophobicContact CG1-CG2 4.19Å
801	D	89.5	Confident	84.3	Confident	17 Å²	17	50.5 Å²	50.5	9%	0.091	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	113.5	167.5	-173.6	-2.9	0	0	0	109.2	P612 H613 Y759 S765 Q768 T803	P612-D801 WeakPolarHBondContact O-CA 3.06Å; H613-D801 VanDerWaalsContact CE1-CG 3.45Å; H613-D801 IonicContact CE1-OD1 3.98Å; H613-D801 IonicContact CE1-OD2 2.78Å; H613-D801 PolarHBondContact CE1-OD2 3.45Å; H613-D801 IonicContact ND1-OD1 3.7Å; H613-D801 IonicContact ND1-OD2 3.38Å; Y759-D801 HydrophobicContact CE1-CB 3.98Å; S765-D801 VanDerWaalsContact CB-OD2 3.24Å; S765-D801 WeakPolarHBondContact CB-OD2 3.18Å; S765-D801 PolarHBondContact OG-OD2 3.47Å; Q768-D801 PolarHBondContact NE2-O 2.92Å; D801-T803 WeakPolarHBondContact OD1-CB 3.29Å; D801-T803 PolarHBondContact OD1-N 2.94Å; D801-T803 PolarHBondContact OD1-OG1 2.9Å
802	V	89.7	Confident	85.1	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	27%	0.274	C	S	.	.			trans	-91.6	-20.1	-174	-173.4	0	0	0	0	111.8	V610 P612 V633 I744 L749 V800 P804 Y805 M806	V610-V802 HydrophobicContact CG1-CG2 4.28Å; P612-V802 PolarHBondContact O-N 3.42Å; V633-V802 HydrophobicContact CG2-CG1 4.32Å; I744-V802 HydrophobicContact CB-CG1 4.1Å; I744-V802 HydrophobicContact CD1-CG1 3.17Å; I744-V802 HydrophobicContact CG1-CG1 4.18Å; I744-V802 HydrophobicContact CG2-CG1 4.04Å; L749-V802 HydrophobicContact CD2-CG1 4.32Å; L749-V802 HydrophobicContact CD2-CG2 4.3Å; V800-V802 HydrophobicContact CG1-CG2 4.19Å; V802-P804 VanDerWaalsContact C-CD 3.45Å; V802-Y805 PolarHBondContact O-N 3Å; V802-M806 PolarHBondContact O-N 3.14Å; V802-M806 VanDerWaalsContact O-N 3.11Å
803	T	87.3	Confident	86.2	Confident	59 Å²	59	45.1 Å²	45.1	36%	0.362	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-50.4	-44.7	-176.3	-41.1	0	0	0	0	114.8	D801 Y805 M806	D801-T803 WeakPolarHBondContact OD1-CB 3.29Å; D801-T803 PolarHBondContact OD1-N 2.94Å; D801-T803 PolarHBondContact OD1-OG1 2.9Å; T803-Y805 VanDerWaalsContact C-N 3.27Å; T803-Y805 PolarHBondContact O-N 3.32Å; T803-M806 HydrophobicContact CG2-CE 3.82Å; T803-M806 WeakPolarHBondContact O-CG 3.4Å
804	P	87.6	Confident	87.2	Confident	22 Å²	22	40.9 Å²	40.9	14%	0.143	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72	-21	-179.1	27.1	-34.5	0	0	0	113.4	E55 P56 V802	E55-P804 HydrophobicContact CB-CB 4.25Å; E55-P804 WeakPolarHBondContact CB-O 3.36Å; E55-P804 PolarHBondContact N-O 3.4Å; E55-P804 VanDerWaalsContact OE2-CB 3.25Å; E55-P804 WeakPolarHBondContact OE2-CB 3.34Å; P56-P804 WeakPolarHBondContact CD-O 3.21Å; V802-P804 VanDerWaalsContact C-CD 3.45Å
805	Y	89.8	Confident	87.6	Confident	3 Å²	3	41.1 Å²	41.1	1%	0.012	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.1	-17	-171.9	-58.3	-66.6	0	0	0	114.1	N54 P56 L752 V757 P769 L771 M776 V802 T803	N54-Y805 WeakPolarHBondContact CB-O 3.25Å; N54-Y805 PolarHBondContact ND2-O 3.01Å; P56-Y805 HydrophobicContact CG-CD1 3.8Å; P56-Y805 HydrophobicContact CG-CE1 3.73Å; L752-Y805 HydrophobicContact CD1-CD2 3.63Å; L752-Y805 HydrophobicContact CD1-CE2 4.28Å; L752-Y805 HydrophobicContact CD1-CG 4.01Å; L752-Y805 HydrophobicContact CD2-CD1 4.13Å; L752-Y805 HydrophobicContact CD2-CD2 3.53Å; L752-Y805 HydrophobicContact CD2-CE1 4.07Å; L752-Y805 HydrophobicContact CD2-CE2 3.42Å; L752-Y805 VanDerWaalsContact CD2-CE2 3.42Å; L752-Y805 HydrophobicContact CD2-CG 3.88Å; L752-Y805 HydrophobicContact CG-CD2 4.22Å; V757-Y805 HydrophobicContact CG1-CE2 4.03Å; P769-Y805 PolarHBondContact O-OH 3.33Å; L771-Y805 HydrophobicContact CB-CE1 3.84Å; L771-Y805 PolarHBondContact N-OH 3.11Å; M776-Y805 HydrophobicContact CE-CD1 4.31Å; M776-Y805 HydrophobicContact SD-CD1 3.92Å; M776-Y805 HydrophobicContact SD-CE1 4.42Å; V802-Y805 PolarHBondContact O-N 3Å; T803-Y805 VanDerWaalsContact C-N 3.27Å; T803-Y805 PolarHBondContact O-N 3.32Å
806	M	88.7	Confident	87.9	Confident	15 Å²	15	43 Å²	43	7%	0.074	23%	0.234	C	C	.	.	S	Bend	trans	-71	155.8	177.2	72.7	-178.2	179.4	0	0	112.3	V633 H741 I744 V802 T803 S808	V633-M806 HydrophobicContact CB-SD 3.7Å; V633-M806 HydrophobicContact CG1-SD 3.79Å; V633-M806 HydrophobicContact CG2-CB 4.13Å; V633-M806 HydrophobicContact CG2-SD 3.8Å; H741-M806 HydrophobicContact CB-CE 4.06Å; H741-M806 HydrophobicContact CB-SD 4.43Å; I744-M806 HydrophobicContact CB-CB 4.19Å; V802-M806 PolarHBondContact O-N 3.14Å; V802-M806 VanDerWaalsContact O-N 3.11Å; T803-M806 HydrophobicContact CG2-CE 3.82Å; T803-M806 WeakPolarHBondContact O-CG 3.4Å; M806-S808 PolarHBondContact O-N 3.26Å
807	N	87.8	Confident	88.3	Confident	13 Å²	13	41 Å²	41	7%	0.07	22%	0.22	C	C	.	.	B	Isolated β-bridge	trans	-72.6	110.4	163.1	-171.9	0.9	0	0	0	108.7	G742 L743 C809 P810	G742-N807 CarbonylContact C-O 3.6Å; G742-N807 WeakPolarHBondContact CA-O 3.43Å; L743-N807 PolarHBondContact N-O 3.44Å; L743-N807 WeakPolarHBondContact O-CB 3.37Å; L743-N807 PolarHBondContact O-N 3.03Å; N807-C809 VanDerWaalsContact C-N 3.32Å; N807-C809 PolarHBondContact OD1-N 3.06Å; N807-P810 WeakPolarHBondContact O-CD 3.33Å
808	S	83.4	Confident	88.6	Confident	72 Å²	72	38 Å²	38	50%	0.503	21%	0.209	S	C	.	.	S	Bend	trans	-76.4	-17.2	-178.1	60.1	0	0	0	0	114	M806	M806-S808 PolarHBondContact O-N 3.26Å
809	C	84.3	Confident	88.8	Confident	53 Å²	53	35.8 Å²	35.8	36%	0.358	20%	0.198	S	C	.	.	S	Bend	trans	-136.8	57.9	-175.5	56.5	0	0	0	0	112.8	N807	N807-C809 VanDerWaalsContact C-N 3.32Å; N807-C809 PolarHBondContact OD1-N 3.06Å
810	P	87.8	Confident	88.9	Confident	6 Å²	6	36.2 Å²	36.2	4%	0.039	20%	0.203	C	C	.	.			trans	-66.5	152.9	173.6	31.1	-33.2	0	0	0	110.4	F740 L743 N807 T812	F740-P810 HydrophobicContact CE1-CG 3.65Å; F740-P810 HydrophobicContact CZ-CG 3.53Å; L743-P810 HydrophobicContact CB-CB 4.44Å; L743-P810 HydrophobicContact CB-CG 4.45Å; L743-P810 HydrophobicContact CD1-CB 3.71Å; L743-P810 HydrophobicContact CD1-CG 4.22Å; L743-P810 HydrophobicContact CG-CB 4.11Å; L743-P810 HydrophobicContact CG-CG 4.1Å; N807-P810 WeakPolarHBondContact O-CD 3.33Å; P810-T812 PolarHBondContact O-N 2.87Å
811	Y	90.4	Very high	89	Confident	75 Å²	75	41.9 Å²	41.9	29%	0.294	23%	0.229	S	C	.	.			trans	-62	131.9	170.8	-66.5	-84.8	0	0	0	109.6	L825 M829 L831 L834 P835	Y811-L825 HydrophobicContact CD1-CD1 4.38Å; Y811-M829 HydrophobicContact CE1-CE 3.66Å; Y811-M829 HydrophobicContact CE1-CG 4.45Å; Y811-M829 HydrophobicContact CE2-CE 3.97Å; Y811-M829 WeakPolarHBondContact OH-CE 3.3Å; Y811-L831 HydrophobicContact CD2-CD1 4.41Å; Y811-L831 HydrophobicContact CD2-CD2 3.51Å; Y811-L831 HydrophobicContact CE2-CD2 4.14Å; Y811-L831 HydrophobicContact CG-CD1 4.24Å; Y811-L831 HydrophobicContact CG-CD2 4.15Å; Y811-L834 VanDerWaalsContact O-CD1 3.28Å; Y811-L834 WeakPolarHBondContact O-CD1 3.36Å; Y811-P835 WeakPolarHBondContact O-CD 3.47Å
812	T	90.1	Very high	89.1	Confident	35 Å²	35	41.1 Å²	41.1	22%	0.215	23%	0.225	C	C	.	.			trans	-128.5	155.5	178	61.8	0	0	0	0	110.9	F740 P810 P835 V837	F740-T812 HydrophobicContact CD1-CG2 4.41Å; F740-T812 HydrophobicContact CE1-CG2 3.82Å; P810-T812 PolarHBondContact O-N 2.87Å; T812-P835 WeakPolarHBondContact CA-O 3.46Å; T812-P835 HydrophobicContact CG2-CB 4.2Å; T812-V837 HydrophobicContact CG2-CG2 3.8Å
813	V	91.4	Very high	89.2	Confident	15 Å²	15	41.4 Å²	41.4	9%	0.091	23%	0.226	C	C	.	.	B	Isolated β-bridge	trans	-128.3	154.4	174.8	-68.6	0	0	0	0	110.9	A599 V822 L825 L834 P835 V836 V837 I847	A599-V813 HydrophobicContact CB-CG2 4.38Å; V813-V822 HydrophobicContact CG2-CG2 4.45Å; V813-L825 HydrophobicContact CG1-CD2 3.64Å; V813-L834 HydrophobicContact CG1-CD1 4.12Å; V813-L834 HydrophobicContact CG1-CD2 4.04Å; V813-L834 HydrophobicContact CG1-CG 4.35Å; V813-L834 HydrophobicContact CG2-CD1 4.43Å; V813-L834 HydrophobicContact CG2-CD2 4.12Å; V813-L834 HydrophobicContact CG2-CG 4.03Å; V813-P835 PolarHBondContact N-O 2.93Å; V813-P835 VanDerWaalsContact N-O 3.12Å; V813-V836 HydrophobicContact CG2-CG2 4Å; V813-V836 WeakPolarHBondContact O-CA 3.14Å; V813-V837 PolarHBondContact O-N 2.92Å; V813-I847 HydrophobicContact CG2-CD1 4.44Å
814	S	88.9	Confident	89.3	Confident	59 Å²	59	42.1 Å²	42.1	41%	0.413	23%	0.228	S	C	.	.			trans	-76.6	151.2	172.6	81.7	0	0	0	0	110.7	N816 T817	S814-N816 PolarHBondContact O-N 3.09Å; S814-T817 PolarHBondContact N-OG1 3.1Å; S814-T817 VanDerWaalsContact O-CB 3.29Å; S814-T817 WeakPolarHBondContact O-CB 3.38Å; S814-T817 PolarHBondContact O-N 3.35Å; S814-T817 VanDerWaalsContact O-N 3.12Å; S814-T817 PolarHBondContact O-OG1 2.89Å; S814-T817 PolarHBondContact OG-N 3.44Å; S814-T817 PolarHBondContact OG-OG1 3.02Å
815	P	88.1	Confident	89.4	Confident	25 Å²	25	43.4 Å²	43.4	16%	0.162	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-28.1	178.3	22.8	-33.6	0	0	0	113.3	A599 S600 T817 V836 V837	A599-P815 PolarHBondContact N-O 2.76Å; S600-P815 PolarHBondContact N-O 2.95Å; P815-T817 VanDerWaalsContact C-N 3.29Å; P815-T817 PolarHBondContact O-N 3.44Å; P815-V836 HydrophobicContact CB-CG1 3.91Å; P815-V837 WeakPolarHBondContact CD-O 3.22Å
816	N	88.1	Confident	89.5	Confident	127 Å²	127	43.4 Å²	43.4	68%	0.679	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.1	3.4	-178.4	-60.5	-15.4	0	0	0	113.3	S814	S814-N816 PolarHBondContact O-N 3.09Å
817	T	89.6	Confident	89.4	Confident	20 Å²	20	43.7 Å²	43.7	12%	0.123	23%	0.233	C	C	.	.			trans	-68.1	136	-179.3	-46.3	0	0	0	0	110	T598 A599 S814 P815 Q821 V822	T598-T817 CarbonylContact C-O 3.51Å; T598-T817 WeakPolarHBondContact CA-O 3.41Å; A599-T817 PolarHBondContact N-O 3.36Å; S814-T817 PolarHBondContact N-OG1 3.1Å; S814-T817 VanDerWaalsContact O-CB 3.29Å; S814-T817 WeakPolarHBondContact O-CB 3.38Å; S814-T817 PolarHBondContact O-N 3.35Å; S814-T817 VanDerWaalsContact O-N 3.12Å; S814-T817 PolarHBondContact O-OG1 2.89Å; S814-T817 PolarHBondContact OG-N 3.44Å; S814-T817 PolarHBondContact OG-OG1 3.02Å; P815-T817 VanDerWaalsContact C-N 3.29Å; P815-T817 PolarHBondContact O-N 3.44Å; T817-Q821 HydrophobicContact CG2-CB 3.89Å; T817-V822 HydrophobicContact CG2-CG2 3.85Å
818	R	92.3	Very high	89.3	Confident	120 Å²	120	46.3 Å²	46.3	45%	0.453	25%	0.25	S	C	.	.	B	Isolated β-bridge	trans	-68.8	149.9	177.8	-63.8	-63.6	-172.2	176.1	-5.8	111.9	D595 K596 S820 Q821 V822	D595-R818 WeakPolarHBondContact O-CD 3.36Å; D595-R818 PolarHBondContact O-NH1 2.88Å; K596-R818 PolarHBondContact O-NH1 2.9Å; R818-S820 PolarHBondContact O-N 3Å; R818-Q821 PolarHBondContact O-N 3.45Å; R818-V822 WeakPolarHBondContact O-CG2 3.15Å; R818-V822 PolarHBondContact O-N 3.49Å; R818-V822 VanDerWaalsContact O-N 3.16Å
819	I	91.9	Very high	89.3	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-61.1	-41.8	-177	-68.4	-163.2	0	0	0	113.3	T590 L597 I602 Q821 V822 F823 L857	T590-I819 HydrophobicContact CG2-CG2 4.49Å; L597-I819 HydrophobicContact CB-CD1 3.21Å; L597-I819 HydrophobicContact CB-CG1 3.72Å; L597-I819 HydrophobicContact CD1-CD1 3.64Å; L597-I819 HydrophobicContact CG-CD1 4.06Å; L597-I819 PolarHBondContact O-N 3.27Å; I602-I819 HydrophobicContact CD1-CD1 4.05Å; I602-I819 HydrophobicContact CD1-CG1 4.26Å; I602-I819 HydrophobicContact CG1-CD1 4.42Å; I602-I819 HydrophobicContact CG2-CD1 3.55Å; I819-Q821 PolarHBondContact O-N 2.88Å; I819-V822 PolarHBondContact O-N 2.93Å; I819-V822 VanDerWaalsContact O-N 3.12Å; I819-F823 VanDerWaalsContact O-CB 3.26Å; I819-F823 WeakPolarHBondContact O-CB 3.29Å; I819-F823 PolarHBondContact O-N 3.11Å; I819-L857 HydrophobicContact CD1-CD2 3.64Å; I819-L857 HydrophobicContact CG2-CD1 4.29Å; I819-L857 HydrophobicContact CG2-CD2 4.25Å
820	S	90.6	Very high	89.4	Confident	24 Å²	24	43.9 Å²	43.9	17%	0.168	23%	0.229	C	C	.	.	H	α-helix	trans	-54.1	-40.6	176.6	47.4	0	0	0	0	112.9	D595 R818 N824	D595-S820 VanDerWaalsContact CG-OG 3.3Å; D595-S820 WeakPolarHBondContact OD1-CA 3.47Å; D595-S820 WeakPolarHBondContact OD1-CB 3.37Å; D595-S820 PolarHBondContact OD1-N 3.28Å; D595-S820 PolarHBondContact OD1-OG 3.27Å; D595-S820 PolarHBondContact OD2-OG 3.02Å; R818-S820 PolarHBondContact O-N 3Å; S820-N824 WeakPolarHBondContact O-CB 3.32Å; S820-N824 PolarHBondContact O-N 3.46Å; S820-N824 PolarHBondContact O-ND2 2.87Å
821	Q	91.1	Very high	89.5	Confident	120 Å²	120	43.8 Å²	43.8	56%	0.561	23%	0.228	S	C	*	.	H	α-helix	trans	-69.1	-44.3	178.8	-64.5	-179.3	-3	0	0	111.3	T817 R818 I819 L825	T817-Q821 HydrophobicContact CG2-CB 3.89Å; R818-Q821 PolarHBondContact O-N 3.45Å; I819-Q821 PolarHBondContact O-N 2.88Å; Q821-L825 WeakPolarHBondContact O-CB 3.41Å; Q821-L825 PolarHBondContact O-N 3.4Å
822	V	92.4	Very high	89.5	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-60.7	-46.6	175.6	175.9	0	0	0	0	110.5	A599 V813 T817 R818 I819 L825 F826 L834 I847 L852	A599-V822 HydrophobicContact CB-CG2 4.06Å; V813-V822 HydrophobicContact CG2-CG2 4.45Å; T817-V822 HydrophobicContact CG2-CG2 3.85Å; R818-V822 WeakPolarHBondContact O-CG2 3.15Å; R818-V822 PolarHBondContact O-N 3.49Å; R818-V822 VanDerWaalsContact O-N 3.16Å; I819-V822 PolarHBondContact O-N 2.93Å; I819-V822 VanDerWaalsContact O-N 3.12Å; V822-L825 PolarHBondContact O-N 2.86Å; V822-F826 VanDerWaalsContact O-CB 3.28Å; V822-F826 WeakPolarHBondContact O-CB 3.39Å; V822-F826 PolarHBondContact O-N 3.14Å; V822-L834 HydrophobicContact CG1-CD2 3.78Å; V822-I847 HydrophobicContact CG1-CD1 3.88Å; V822-I847 HydrophobicContact CG1-CG2 4.45Å; V822-L852 HydrophobicContact CG1-CD2 4.25Å
823	F	91.7	Very high	89.6	Confident	7 Å²	7	41.6 Å²	41.6	3%	0.031	22%	0.217	C	C	.	.	H	α-helix	trans	-63.5	-48.2	-179.7	-174.3	-88.8	0	0	0	111.6	L586 E587 T590 I819 L825 F826 R827 L852	L586-F823 HydrophobicContact CB-CE2 4.44Å; L586-F823 HydrophobicContact CB-CZ 4.26Å; L586-F823 HydrophobicContact CD2-CE2 4.06Å; E587-F823 VanDerWaalsContact O-CE1 3.29Å; E587-F823 WeakPolarHBondContact O-CE1 3.45Å; E587-F823 WeakPolarHBondContact O-CZ 3.02Å; T590-F823 HydrophobicContact CG2-CB 3.79Å; T590-F823 HydrophobicContact CG2-CD1 3.73Å; T590-F823 HydrophobicContact CG2-CD2 3.46Å; T590-F823 VanDerWaalsContact CG2-CD2 3.46Å; T590-F823 HydrophobicContact CG2-CE1 4.1Å; T590-F823 HydrophobicContact CG2-CE2 3.86Å; T590-F823 HydrophobicContact CG2-CG 3.38Å; T590-F823 HydrophobicContact CG2-CZ 4.14Å; I819-F823 VanDerWaalsContact O-CB 3.26Å; I819-F823 WeakPolarHBondContact O-CB 3.29Å; I819-F823 PolarHBondContact O-N 3.11Å; F823-L825 PolarHBondContact O-N 2.77Å; F823-F826 PolarHBondContact O-N 3.27Å; F823-R827 VanDerWaalsContact O-CB 3.24Å; F823-R827 WeakPolarHBondContact O-CB 3.03Å; F823-R827 PolarHBondContact O-N 3.42Å; F823-L852 HydrophobicContact CD2-CB 4.26Å; F823-L852 HydrophobicContact CD2-CD2 4.49Å
824	N	89.4	Confident	89.7	Confident	74 Å²	74	40.9 Å²	40.9	40%	0.396	21%	0.213	S	C	.	.	H	α-helix	trans	-61.3	-44.6	177.5	-75.6	-21.6	0	0	0	111	S820 T828	S820-N824 WeakPolarHBondContact O-CB 3.32Å; S820-N824 PolarHBondContact O-N 3.46Å; S820-N824 PolarHBondContact O-ND2 2.87Å; N824-T828 WeakPolarHBondContact O-CB 3.21Å; N824-T828 WeakPolarHBondContact O-CG2 3.29Å; N824-T828 PolarHBondContact O-N 2.9Å; N824-T828 PolarHBondContact O-OG1 3.4Å
825	L	90.1	Very high	89.9	Confident	49 Å²	49	38 Å²	38	26%	0.257	19%	0.193	S	C	.	.	H	α-helix	trans	-60.8	-49.5	175.3	-179.8	66.1	0	0	0	111.6	Y811 V813 Q821 V822 F823 R827 T828 M829 L831 L834	Y811-L825 HydrophobicContact CD1-CD1 4.38Å; V813-L825 HydrophobicContact CG1-CD2 3.64Å; Q821-L825 WeakPolarHBondContact O-CB 3.41Å; Q821-L825 PolarHBondContact O-N 3.4Å; V822-L825 PolarHBondContact O-N 2.86Å; F823-L825 PolarHBondContact O-N 2.77Å; L825-R827 PolarHBondContact O-N 3.3Å; L825-T828 PolarHBondContact O-OG1 2.95Å; L825-M829 HydrophobicContact CD1-CG 3.79Å; L825-M829 WeakPolarHBondContact O-CB 3.35Å; L825-M829 WeakPolarHBondContact O-CG 3.2Å; L825-M829 PolarHBondContact O-N 3.44Å; L825-L831 HydrophobicContact CG-CD1 4.35Å; L825-L834 HydrophobicContact CD2-CD1 4.28Å
826	F	90.8	Very high	90.1	Very high	2 Å²	2	36.9 Å²	36.9	1%	0.009	19%	0.185	C	C	.	.	H	α-helix	trans	-60.3	-45.7	-178.3	-167.3	-82.3	0	0	0	111.6	L586 V822 F823 G830 L831 L834 R849 L852	L586-F826 HydrophobicContact CD1-CD1 3.75Å; L586-F826 HydrophobicContact CD1-CE1 3.88Å; V822-F826 VanDerWaalsContact O-CB 3.28Å; V822-F826 WeakPolarHBondContact O-CB 3.39Å; V822-F826 PolarHBondContact O-N 3.14Å; F823-F826 PolarHBondContact O-N 3.27Å; F826-G830 PolarHBondContact O-N 2.99Å; F826-G830 VanDerWaalsContact O-N 3.14Å; F826-L831 HydrophobicContact CD2-CB 3.91Å; F826-L831 WeakPolarHBondContact CE1-O 3.37Å; F826-L831 HydrophobicContact CE2-CB 4.07Å; F826-L831 HydrophobicContact CG-CB 4.24Å; F826-L831 WeakPolarHBondContact CZ-O 3.44Å; F826-L831 PolarHBondContact O-N 3.2Å; F826-L834 HydrophobicContact CD2-CB 4.03Å; F826-L834 HydrophobicContact CD2-CD2 4.25Å; F826-L834 HydrophobicContact CE2-CB 4.34Å; F826-R849 HydrophobicContact CE1-CB 4.02Å; F826-R849 HydrophobicContact CZ-CB 4Å; F826-R849 VanDerWaalsContact CZ-N 3.35Å; F826-L852 HydrophobicContact CB-CD1 3.59Å; F826-L852 HydrophobicContact CD1-CD1 3.67Å; F826-L852 HydrophobicContact CD2-CD1 3.64Å; F826-L852 HydrophobicContact CE1-CD1 4.25Å; F826-L852 HydrophobicContact CE2-CD1 4.23Å; F826-L852 HydrophobicContact CG-CD1 3.34Å
827	R	87.3	Confident	90	Very high	21 Å²	21	31.5 Å²	31.5	8%	0.079	16%	0.157	C	C	.	.	H	α-helix	trans	-69.8	-50.2	-179.7	-179.2	178.3	179.9	92.3	-1.5	112	N163 S266 L586 E587 F823 L825 G830	N163-R827 PolarHBondContact ND2-NH1 2.78Å; S266-R827 WeakPolarHBondContact CB-O 3.42Å; L586-R827 PolarHBondContact O-NH1 3.08Å; E587-R827 WeakPolarHBondContact O-CD 3.12Å; E587-R827 PolarHBondContact O-NE 3.1Å; E587-R827 PolarHBondContact O-NH1 3.47Å; F823-R827 VanDerWaalsContact O-CB 3.24Å; F823-R827 WeakPolarHBondContact O-CB 3.03Å; F823-R827 PolarHBondContact O-N 3.42Å; L825-R827 PolarHBondContact O-N 3.3Å; R827-G830 PolarHBondContact O-N 3.01Å
828	T	84.8	Confident	89.7	Confident	68 Å²	68	32.6 Å²	32.6	42%	0.417	16%	0.162	S	C	.	.	H	α-helix	trans	-69.8	-31.4	-176	57	0	0	0	0	113.1	F267 N824 L825	F267-T828 WeakPolarHBondContact CB-O 3.32Å; N824-T828 WeakPolarHBondContact O-CB 3.21Å; N824-T828 WeakPolarHBondContact O-CG2 3.29Å; N824-T828 PolarHBondContact O-N 2.9Å; N824-T828 PolarHBondContact O-OG1 3.4Å; L825-T828 PolarHBondContact O-OG1 2.95Å
829	M	84.7	Confident	89	Confident	63 Å²	63	31.6 Å²	31.6	31%	0.31	18%	0.18	S	C	.	.	H	α-helix	trans	-90.8	-6.7	176.6	-59.3	-54.4	-74.7	0	0	112.7	Y811 L825 L831	Y811-M829 HydrophobicContact CE1-CE 3.66Å; Y811-M829 HydrophobicContact CE1-CG 4.45Å; Y811-M829 HydrophobicContact CE2-CE 3.97Å; Y811-M829 WeakPolarHBondContact OH-CE 3.3Å; L825-M829 HydrophobicContact CD1-CG 3.79Å; L825-M829 WeakPolarHBondContact O-CB 3.35Å; L825-M829 WeakPolarHBondContact O-CG 3.2Å; L825-M829 PolarHBondContact O-N 3.44Å; M829-L831 VanDerWaalsContact C-N 3.34Å; M829-L831 HydrophobicContact CB-CD1 4.35Å; M829-L831 HydrophobicContact CB-CD2 3.64Å; M829-L831 HydrophobicContact CB-CG 3.78Å
830	G	86.1	Confident	88.2	Confident	12 Å²	12	33.2 Å²	33.2	12%	0.124	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	64.7	38.6	-179.5	0	0	0	0	0	112.5	Y49 F826 R827	Y49-G830 WeakPolarHBondContact CB-O 3.27Å; F826-G830 PolarHBondContact O-N 2.99Å; F826-G830 VanDerWaalsContact O-N 3.14Å; R827-G830 PolarHBondContact O-N 3.01Å
831	L	89.6	Confident	87.5	Confident	3 Å²	3	32.5 Å²	32.5	2%	0.016	19%	0.186	C	C	.	.			trans	-72.2	154.6	-173.3	-54.8	-177.5	0	0	0	111.2	D50 Y811 L825 F826 M829 L834	D50-L831 HydrophobicContact CB-CD2 4.19Å; Y811-L831 HydrophobicContact CD2-CD1 4.41Å; Y811-L831 HydrophobicContact CD2-CD2 3.51Å; Y811-L831 HydrophobicContact CE2-CD2 4.14Å; Y811-L831 HydrophobicContact CG-CD1 4.24Å; Y811-L831 HydrophobicContact CG-CD2 4.15Å; L825-L831 HydrophobicContact CG-CD1 4.35Å; F826-L831 HydrophobicContact CD2-CB 3.91Å; F826-L831 WeakPolarHBondContact CE1-O 3.37Å; F826-L831 HydrophobicContact CE2-CB 4.07Å; F826-L831 HydrophobicContact CG-CB 4.24Å; F826-L831 WeakPolarHBondContact CZ-O 3.44Å; F826-L831 PolarHBondContact O-N 3.2Å; M829-L831 VanDerWaalsContact C-N 3.34Å; M829-L831 HydrophobicContact CB-CD1 4.35Å; M829-L831 HydrophobicContact CB-CD2 3.64Å; M829-L831 HydrophobicContact CB-CG 3.78Å; L831-L834 HydrophobicContact CD1-CB 4.47Å; L831-L834 HydrophobicContact CD1-CD1 3.89Å
832	R	90.6	Very high	87.1	Confident	29 Å²	29	28.4 Å²	28.4	11%	0.109	17%	0.167	C	C	.	.	S	Bend	trans	-106.4	-42	170.5	-175.7	176.8	177.7	174.8	9.1	111.9	D48 H629	D48-R832 WeakPolarHBondContact OD1-CD 3.43Å; D48-R832 IonicContact OD1-CZ 3.88Å; D48-R832 IonicContact OD1-NE 2.77Å; D48-R832 IonicContact OD1-NH1 2.74Å; D48-R832 PolarHBondContact OD1-NH1 3.39Å; D48-R832 IonicContact OD2-NH1 2.8Å; D48-R832 PolarHBondContact OD2-NH1 2.03Å; H629-R832 PolarHBondContact CD2-NH2 3.41Å; H629-R832 PolarHBondContact ND1-NH2 2.88Å
833	H	92.4	Very high	86.7	Confident	35 Å²	35	29 Å²	29	16%	0.162	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	132.3	179.9	-46.4	97.9	0	0	0	108.1	A630 L743 I846	A630-H833 WeakPolarHBondContact CB-CE1 3.4Å; A630-H833 WeakPolarHBondContact CB-ND1 3.36Å; L743-H833 HydrophobicContact CD1-CB 4.24Å; H833-I846 HydrophobicContact CB-CG2 4.24Å
834	L	93.7	Very high	86.5	Confident	0 Å²	0	31.3 Å²	31.3	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	97.9	179.7	178.5	58.1	0	0	0	109.1	Y811 V813 V822 L825 F826 L831 I847	Y811-L834 VanDerWaalsContact O-CD1 3.28Å; Y811-L834 WeakPolarHBondContact O-CD1 3.36Å; V813-L834 HydrophobicContact CG1-CD1 4.12Å; V813-L834 HydrophobicContact CG1-CD2 4.04Å; V813-L834 HydrophobicContact CG1-CG 4.35Å; V813-L834 HydrophobicContact CG2-CD1 4.43Å; V813-L834 HydrophobicContact CG2-CD2 4.12Å; V813-L834 HydrophobicContact CG2-CG 4.03Å; V822-L834 HydrophobicContact CG1-CD2 3.78Å; L825-L834 HydrophobicContact CD2-CD1 4.28Å; F826-L834 HydrophobicContact CD2-CB 4.03Å; F826-L834 HydrophobicContact CD2-CD2 4.25Å; F826-L834 HydrophobicContact CE2-CB 4.34Å; L831-L834 HydrophobicContact CD1-CB 4.47Å; L831-L834 HydrophobicContact CD1-CD1 3.89Å; L834-I847 HydrophobicContact CB-CB 4.23Å; L834-I847 PolarHBondContact N-O 3.18Å; L834-I847 PolarHBondContact O-N 3.08Å
835	P	92.7	Very high	86.5	Confident	0 Å²	0	27.8 Å²	27.8	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.6	137.2	176.5	-22.1	33.8	0	0	0	112.3	F740 L743 Y811 T812 V813 V837 I843	F740-P835 HydrophobicContact CE1-CB 4.41Å; F740-P835 HydrophobicContact CE2-CB 4.26Å; F740-P835 HydrophobicContact CE2-CG 4.25Å; F740-P835 HydrophobicContact CZ-CB 3.95Å; F740-P835 HydrophobicContact CZ-CG 3.76Å; L743-P835 HydrophobicContact CD1-CG 3.6Å; L743-P835 HydrophobicContact CD2-CG 4.01Å; L743-P835 HydrophobicContact CG-CG 3.9Å; Y811-P835 WeakPolarHBondContact O-CD 3.47Å; T812-P835 WeakPolarHBondContact CA-O 3.46Å; T812-P835 HydrophobicContact CG2-CB 4.2Å; V813-P835 PolarHBondContact N-O 2.93Å; V813-P835 VanDerWaalsContact N-O 3.12Å; P835-V837 HydrophobicContact CB-CG2 4.37Å; P835-I843 HydrophobicContact CB-CD1 4.07Å
836	V	91.3	Very high	86.6	Confident	0 Å²	0	26.3 Å²	26.3	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	118.1	172.7	-173.4	0	0	0	0	108	A599 M603 V813 P815 V844 G845 I847	A599-V836 HydrophobicContact CB-CG2 4.48Å; M603-V836 HydrophobicContact CB-CG2 3.9Å; M603-V836 HydrophobicContact SD-CB 3.76Å; M603-V836 HydrophobicContact SD-CG1 3.74Å; M603-V836 HydrophobicContact SD-CG2 3.96Å; V813-V836 HydrophobicContact CG2-CG2 4Å; V813-V836 WeakPolarHBondContact O-CA 3.14Å; P815-V836 HydrophobicContact CB-CG1 3.91Å; V836-V844 PolarHBondContact O-N 3.49Å; V836-G845 PolarHBondContact N-O 2.76Å; V836-G845 PolarHBondContact O-N 3.48Å; V836-I847 HydrophobicContact CG2-CD1 3.62Å; V836-I847 HydrophobicContact CG2-CG1 3.8Å
837	V	87.1	Confident	86.8	Confident	14 Å²	14	26.2 Å²	26.2	9%	0.085	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	135.5	-173.8	-173.8	0	0	0	0	109.5	F740 T812 V813 P815 P835 G841 E842	F740-V837 HydrophobicContact CD1-CG2 3.94Å; F740-V837 HydrophobicContact CE1-CG2 4.43Å; F740-V837 HydrophobicContact CG-CG2 4.28Å; T812-V837 HydrophobicContact CG2-CG2 3.8Å; V813-V837 PolarHBondContact O-N 2.92Å; P815-V837 WeakPolarHBondContact CD-O 3.22Å; P835-V837 HydrophobicContact CB-CG2 4.37Å; V837-G841 VanDerWaalsContact CG1-C 3.45Å; V837-E842 CarbonylContact C-O 3.55Å; V837-E842 VanDerWaalsContact CA-O 3.23Å; V837-E842 WeakPolarHBondContact CA-O 3.38Å; V837-E842 WeakPolarHBondContact CG1-O 3.15Å
838	N	83.5	Confident	87	Confident	43 Å²	43	27.4 Å²	27.4	23%	0.23	17%	0.167	C	C	.	.			trans	-75.1	176.8	175.6	85.2	2.3	0	0	0	112	V840 G841 E842 V844	N838-V840 PolarHBondContact O-N 3.22Å; N838-V840 WeakPolarHBondContact OD1-CA 3.29Å; N838-V840 WeakPolarHBondContact OD1-CB 3.44Å; N838-V840 PolarHBondContact OD1-N 3.47Å; N838-G841 PolarHBondContact O-N 3.37Å; N838-G841 VanDerWaalsContact O-N 3.15Å; N838-G841 PolarHBondContact OD1-N 3.44Å; N838-E842 PolarHBondContact N-O 2.89Å; N838-E842 PolarHBondContact ND2-OE2 3.47Å; N838-E842 PolarHBondContact OD1-N 3.09Å; N838-E842 VanDerWaalsContact OD1-N 3.11Å; N838-V844 HydrophobicContact CB-CG2 4.04Å
839	A	77.1	Confident	87.3	Confident	100 Å²	100	24.9 Å²	24.9	83%	0.826	15%	0.15	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.6	-19	178.6	0	0	0	0	0	114.8
840	V	75.3	Confident	87.4	Confident	34 Å²	34	26.2 Å²	26.2	21%	0.206	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.1	-15.8	178.2	-167.9	0	0	0	0	111.4	N640 N838	N640-V840 WeakPolarHBondContact ND2-CG1 3.04Å; N838-V840 PolarHBondContact O-N 3.22Å; N838-V840 WeakPolarHBondContact OD1-CA 3.29Å; N838-V840 WeakPolarHBondContact OD1-CB 3.44Å; N838-V840 PolarHBondContact OD1-N 3.47Å
841	G	75.9	Confident	87.6	Confident	9 Å²	9	26 Å²	26	9%	0.093	15%	0.151	C	C	.	.	S	Bend	trans	94.3	17.8	-176.5	0	0	0	0	0	113.8	F740 V837 N838	F740-G841 PolarHBondContact N-O 3.46Å; V837-G841 VanDerWaalsContact CG1-C 3.45Å; N838-G841 PolarHBondContact O-N 3.37Å; N838-G841 VanDerWaalsContact O-N 3.15Å; N838-G841 PolarHBondContact OD1-N 3.44Å
842	E	82.2	Confident	87.6	Confident	33 Å²	33	26 Å²	26	15%	0.154	15%	0.151	C	C	.	.	B	Isolated β-bridge	trans	-92	139.4	177.6	-67	157.6	179.2	0	0	111	P737 L738 V837 N838	P737-E842 HydrophobicContact CB-CG 4.25Å; P737-E842 WeakPolarHBondContact CB-OE1 3.25Å; L738-E842 WeakPolarHBondContact O-CA 3.44Å; V837-E842 CarbonylContact C-O 3.55Å; V837-E842 VanDerWaalsContact CA-O 3.23Å; V837-E842 WeakPolarHBondContact CA-O 3.38Å; V837-E842 WeakPolarHBondContact CG1-O 3.15Å; N838-E842 PolarHBondContact N-O 2.89Å; N838-E842 PolarHBondContact ND2-OE2 3.47Å; N838-E842 PolarHBondContact OD1-N 3.09Å; N838-E842 VanDerWaalsContact OD1-N 3.11Å
843	I	85.1	Confident	87.5	Confident	14 Å²	14	25.4 Å²	25.4	7%	0.072	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	126.9	175.8	-166.8	172.2	0	0	0	110.2	L607 P632 V634 L738 F740 P835 I846	L607-I843 HydrophobicContact CD1-CB 4.31Å; L607-I843 HydrophobicContact CD1-CD1 3.81Å; L607-I843 HydrophobicContact CD1-CG1 3.64Å; L607-I843 HydrophobicContact CD1-CG2 3.91Å; P632-I843 HydrophobicContact CB-CD1 3.47Å; P632-I843 VanDerWaalsContact CB-CD1 3.47Å; P632-I843 HydrophobicContact CG-CD1 3.87Å; V634-I843 HydrophobicContact CG1-CG2 3.77Å; L738-I843 HydrophobicContact CB-CG2 4.13Å; L738-I843 PolarHBondContact O-N 3.46Å; L738-I843 VanDerWaalsContact O-N 3.07Å; F740-I843 HydrophobicContact CB-CB 4.14Å; F740-I843 HydrophobicContact CD2-CB 4.1Å; F740-I843 HydrophobicContact CD2-CD1 3.79Å; F740-I843 HydrophobicContact CD2-CG1 4.37Å; F740-I843 HydrophobicContact CE2-CD1 3.91Å; F740-I843 HydrophobicContact CG-CB 4.38Å; P835-I843 HydrophobicContact CB-CD1 4.07Å; I843-I846 HydrophobicContact CD1-CD1 4.25Å; I843-I846 HydrophobicContact CD1-CG1 4.04Å
844	V	86.3	Confident	87.2	Confident	55 Å²	55	27.1 Å²	27.1	33%	0.333	16%	0.159	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	-24.3	-176.7	-161	0	0	0	0	111.6	M603 V836 N838	M603-V844 HydrophobicContact CE-CB 4.1Å; M603-V844 HydrophobicContact CE-CG1 3.55Å; M603-V844 HydrophobicContact SD-CB 4.33Å; M603-V844 HydrophobicContact SD-CG1 4.42Å; V836-V844 PolarHBondContact O-N 3.49Å; N838-V844 HydrophobicContact CB-CG2 4.04Å
845	G	90.4	Very high	86.7	Confident	0 Å²	0	32.9 Å²	32.9	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-174.3	176	177.1	0	0	0	0	0	112.6	E604 V836	E604-G845 WeakPolarHBondContact O-CA 3.34Å; V836-G845 PolarHBondContact N-O 2.76Å; V836-G845 PolarHBondContact O-N 3.48Å
846	I	92.3	Very high	86.4	Confident	17 Å²	17	35 Å²	35	9%	0.087	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	136.3	172.4	-69	176	0	0	0	108.6	E604 L607 P632 L743 H833 I843 T848	E604-I846 PolarHBondContact N-O 3.31Å; E604-I846 PolarHBondContact O-N 3.35Å; L607-I846 HydrophobicContact CD2-CB 3.99Å; L607-I846 HydrophobicContact CD2-CD1 3.88Å; L607-I846 HydrophobicContact CD2-CG1 3.67Å; P632-I846 HydrophobicContact CB-CD1 4.41Å; P632-I846 HydrophobicContact CG-CD1 3.98Å; L743-I846 HydrophobicContact CD2-CD1 4.4Å; H833-I846 HydrophobicContact CB-CG2 4.24Å; I843-I846 HydrophobicContact CD1-CD1 4.25Å; I843-I846 HydrophobicContact CD1-CG1 4.04Å; I846-T848 HydrophobicContact CG2-CG2 4.23Å
847	I	93.9	Very high	86.3	Confident	0 Å²	0	35.1 Å²	35.1	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	130.3	173	-62.7	170.1	0	0	0	108.2	A599 I602 M603 V813 V822 L834 V836 N851 L852	A599-I847 HydrophobicContact CB-CD1 3.97Å; I602-I847 HydrophobicContact CD1-CD1 3.94Å; I602-I847 HydrophobicContact CD1-CG1 4.43Å; I602-I847 HydrophobicContact CD1-CG2 4.28Å; I602-I847 HydrophobicContact CG1-CD1 4.06Å; I602-I847 HydrophobicContact CG1-CG1 4.39Å; M603-I847 HydrophobicContact CB-CD1 4.42Å; M603-I847 HydrophobicContact CB-CG1 3.79Å; V813-I847 HydrophobicContact CG2-CD1 4.44Å; V822-I847 HydrophobicContact CG1-CD1 3.88Å; V822-I847 HydrophobicContact CG1-CG2 4.45Å; L834-I847 HydrophobicContact CB-CB 4.23Å; L834-I847 PolarHBondContact N-O 3.18Å; L834-I847 PolarHBondContact O-N 3.08Å; V836-I847 HydrophobicContact CG2-CD1 3.62Å; V836-I847 HydrophobicContact CG2-CG1 3.8Å; I847-N851 HydrophobicContact CG2-CB 4.18Å; I847-L852 HydrophobicContact CG2-CD1 4.06Å; I847-L852 HydrophobicContact CG2-CD2 4.22Å; I847-L852 HydrophobicContact CG2-CG 3.96Å
848	T	92	Very high	86.3	Confident	47 Å²	47	36.1 Å²	36.1	29%	0.288	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	173.8	174.8	71.4	0	0	0	0	110.7	I846 H850 N851	I846-T848 HydrophobicContact CG2-CG2 4.23Å; T848-H850 PolarHBondContact O-N 3.44Å; T848-N851 PolarHBondContact N-OD1 3.45Å; T848-N851 WeakPolarHBondContact O-CB 3.27Å; T848-N851 PolarHBondContact O-N 3.01Å; T848-N851 PolarHBondContact OG1-OD1 3.45Å
849	R	90.3	Very high	86.5	Confident	15 Å²	15	36.4 Å²	36.4	6%	0.057	21%	0.21	C	C	.	.	G	3₁₀ helix	trans	-54.3	-38.2	176.1	177.5	-178	-71.2	-95.6	-6.6	112.9	S46 N163 L586 F826 N851 L852 T853	S46-R849 PolarHBondContact OG-NE 3.43Å; N163-R849 PolarHBondContact O-NH1 3.04Å; N163-R849 PolarHBondContact O-NH2 3.21Å; N163-R849 PolarHBondContact OD1-NH1 3.01Å; L586-R849 HydrophobicContact CD1-CG 4.35Å; L586-R849 HydrophobicContact CD2-CG 4.34Å; L586-R849 HydrophobicContact CG-CG 4.27Å; F826-R849 HydrophobicContact CE1-CB 4.02Å; F826-R849 HydrophobicContact CZ-CB 4Å; F826-R849 VanDerWaalsContact CZ-N 3.35Å; R849-N851 PolarHBondContact O-N 2.91Å; R849-L852 PolarHBondContact O-N 2.87Å; R849-L852 VanDerWaalsContact O-N 3.12Å; R849-T853 PolarHBondContact O-N 3.04Å
850	H	88	Confident	87	Confident	90 Å²	90	34.5 Å²	34.5	42%	0.417	18%	0.183	S	C	.	.	G	3₁₀ helix	trans	-63.6	-32.8	-179.5	-176.8	-75.7	0	0	0	111.8	T848 L852 T853 F856	T848-H850 PolarHBondContact O-N 3.44Å; H850-L852 PolarHBondContact O-N 3.31Å; H850-T853 PolarHBondContact O-OG1 3.41Å; H850-T853 VanDerWaalsContact O-OG1 3.08Å; H850-F856 WeakPolarHBondContact O-CB 3.23Å
851	N	89.6	Confident	87.7	Confident	8 Å²	8	33.4 Å²	33.4	4%	0.043	18%	0.176	C	C	.	.	G	3₁₀ helix	trans	-73.8	-8.7	178.6	-52.8	108.8	0	0	0	113.2	I602 I847 T848 R849 F856 L857	I602-N851 PolarHBondContact O-ND2 3.44Å; I847-N851 HydrophobicContact CG2-CB 4.18Å; T848-N851 PolarHBondContact N-OD1 3.45Å; T848-N851 WeakPolarHBondContact O-CB 3.27Å; T848-N851 PolarHBondContact O-N 3.01Å; T848-N851 PolarHBondContact OG1-OD1 3.45Å; R849-N851 PolarHBondContact O-N 2.91Å; N851-F856 HydrophobicContact CB-CD1 4.32Å; N851-F856 HydrophobicContact CB-CE1 3.97Å; N851-F856 HydrophobicContact CB-CZ 4.46Å; N851-F856 WeakPolarHBondContact O-CD1 3.47Å; N851-L857 WeakPolarHBondContact O-CD2 3.5Å
852	L	90.8	Very high	88.2	Confident	2 Å²	2	41.1 Å²	41.1	1%	0.01	20%	0.203	C	C	.	.	G	3₁₀ helix	trans	-115.3	7.6	-177.3	-63.8	174.4	0	0	0	112.6	L586 I602 V822 F823 F826 I847 R849 H850	L586-L852 HydrophobicContact CD2-CB 3.85Å; L586-L852 WeakPolarHBondContact CD2-O 3.37Å; I602-L852 HydrophobicContact CD1-CD2 3.71Å; V822-L852 HydrophobicContact CG1-CD2 4.25Å; F823-L852 HydrophobicContact CD2-CB 4.26Å; F823-L852 HydrophobicContact CD2-CD2 4.49Å; F826-L852 HydrophobicContact CB-CD1 3.59Å; F826-L852 HydrophobicContact CD1-CD1 3.67Å; F826-L852 HydrophobicContact CD2-CD1 3.64Å; F826-L852 HydrophobicContact CE1-CD1 4.25Å; F826-L852 HydrophobicContact CE2-CD1 4.23Å; F826-L852 HydrophobicContact CG-CD1 3.34Å; I847-L852 HydrophobicContact CG2-CD1 4.06Å; I847-L852 HydrophobicContact CG2-CD2 4.22Å; I847-L852 HydrophobicContact CG2-CG 3.96Å; R849-L852 PolarHBondContact O-N 2.87Å; R849-L852 VanDerWaalsContact O-N 3.12Å; H850-L852 PolarHBondContact O-N 3.31Å
853	T	87.7	Confident	88.4	Confident	18 Å²	18	44.5 Å²	44.5	11%	0.11	22%	0.218	C	C	.	.	S	Bend	trans	-71.5	147.8	172.6	59	0	0	0	0	110.1	P584 R849 H850 E855 F856 L857	P584-T853 HydrophobicContact CB-CG2 3.76Å; R849-T853 PolarHBondContact O-N 3.04Å; H850-T853 PolarHBondContact O-OG1 3.41Å; H850-T853 VanDerWaalsContact O-OG1 3.08Å; T853-E855 VanDerWaalsContact C-N 3.31Å; T853-E855 PolarHBondContact O-N 3.08Å; T853-F856 PolarHBondContact O-N 3.2Å; T853-F856 VanDerWaalsContact O-N 3.15Å; T853-F856 WeakPolarHBondContact OG1-CB 3.48Å; T853-L857 WeakPolarHBondContact O-CG 3.28Å; T853-L857 PolarHBondContact O-N 3.39Å
854	H	85.4	Confident	88.2	Confident	71 Å²	71	46 Å²	46	33%	0.329	23%	0.225	S	C	.	.	H	α-helix	trans	-53.8	-47.3	-179.2	-178.2	-88.6	0	0	0	112	E591 F856 L857 V858	E591-H854 IonicContact OE1-CD2 3.17Å; E591-H854 IonicContact OE1-CE1 2.96Å; E591-H854 IonicContact OE1-NE2 2.83Å; E591-H854 PolarHBondContact OE1-NE2 3.05Å; E591-H854 IonicContact OE2-NE2 3.27Å; H854-F856 PolarHBondContact O-N 3.4Å; H854-L857 PolarHBondContact O-N 3.17Å; H854-V858 VanDerWaalsContact O-CG2 3.25Å; H854-V858 WeakPolarHBondContact O-CG2 3.22Å; H854-V858 PolarHBondContact O-N 3.41Å
855	E	83.6	Confident	88	Confident	120 Å²	120	48.4 Å²	48.4	56%	0.561	23%	0.229	S	C	*	.	H	α-helix	trans	-57.7	-43.5	178.3	-66.5	169.1	-166.4	0	0	112.9	T853 A859	T853-E855 VanDerWaalsContact C-N 3.31Å; T853-E855 PolarHBondContact O-N 3.08Å; E855-A859 WeakPolarHBondContact O-CB 3.11Å; E855-A859 PolarHBondContact O-N 2.92Å
856	F	87	Confident	87.5	Confident	44 Å²	44	55.1 Å²	55.1	19%	0.193	26%	0.263	C	S	.	.	H	α-helix	trans	-68.5	-42.7	179.3	-176.8	-89.6	0	0	0	111.7	I602 H850 N851 T853 H854 A859 K860	I602-F856 HydrophobicContact CB-CE1 4.17Å; I602-F856 HydrophobicContact CG2-CE1 4.32Å; H850-F856 WeakPolarHBondContact O-CB 3.23Å; N851-F856 HydrophobicContact CB-CD1 4.32Å; N851-F856 HydrophobicContact CB-CE1 3.97Å; N851-F856 HydrophobicContact CB-CZ 4.46Å; N851-F856 WeakPolarHBondContact O-CD1 3.47Å; T853-F856 PolarHBondContact O-N 3.2Å; T853-F856 VanDerWaalsContact O-N 3.15Å; T853-F856 WeakPolarHBondContact OG1-CB 3.48Å; H854-F856 PolarHBondContact O-N 3.4Å; F856-A859 PolarHBondContact O-N 3.02Å; F856-K860 HydrophobicContact CD1-CG 4.11Å; F856-K860 HydrophobicContact CE1-CG 3.7Å; F856-K860 HydrophobicContact CZ-CG 4.06Å; F856-K860 PolarHBondContact O-N 2.71Å
857	L	88.6	Confident	86.5	Confident	4 Å²	4	59.9 Å²	59.9	2%	0.021	29%	0.293	C	S	.	.	H	α-helix	trans	-64.4	-43.4	178.5	-67.7	178.7	0	0	0	111.5	T590 M594 I602 I819 N851 T853 H854 A859 K860 L861	T590-L857 HydrophobicContact CG2-CD1 4.45Å; M594-L857 HydrophobicContact CE-CB 4.36Å; M594-L857 HydrophobicContact SD-CB 3.76Å; I602-L857 HydrophobicContact CG2-CD2 3.91Å; I819-L857 HydrophobicContact CD1-CD2 3.64Å; I819-L857 HydrophobicContact CG2-CD1 4.29Å; I819-L857 HydrophobicContact CG2-CD2 4.25Å; N851-L857 WeakPolarHBondContact O-CD2 3.5Å; T853-L857 WeakPolarHBondContact O-CG 3.28Å; T853-L857 PolarHBondContact O-N 3.39Å; H854-L857 PolarHBondContact O-N 3.17Å; L857-A859 VanDerWaalsContact C-N 3.33Å; L857-A859 PolarHBondContact O-N 3.43Å; L857-K860 PolarHBondContact O-N 3.13Å; L857-L861 WeakPolarHBondContact O-CB 3.33Å; L857-L861 PolarHBondContact O-N 3.03Å
858	V	88	Confident	84.7	Confident	34 Å²	34	67.8 Å²	67.8	21%	0.206	33%	0.334	C	S	.	.	H	α-helix	trans	-59.5	-44.5	174	173.8	0	0	0	0	110.8	M594 H854 K860 L861 R862	M594-V858 HydrophobicContact CE-CB 4.18Å; M594-V858 HydrophobicContact CE-CG2 3.35Å; H854-V858 VanDerWaalsContact O-CG2 3.25Å; H854-V858 WeakPolarHBondContact O-CG2 3.22Å; H854-V858 PolarHBondContact O-N 3.41Å; V858-K860 VanDerWaalsContact C-N 3.34Å; V858-K860 PolarHBondContact O-N 3.5Å; V858-L861 PolarHBondContact O-N 2.66Å; V858-R862 WeakPolarHBondContact O-CG 3.25Å; V858-R862 PolarHBondContact O-N 3.44Å
859	A	87.4	Confident	84.3	Confident	49 Å²	49	68.8 Å²	68.8	41%	0.405	34%	0.336	S	S	.	.	H	α-helix	trans	-61.6	-42.8	178.2	0	0	0	0	0	111.9	E855 F856 L857 R862 Q863	E855-A859 WeakPolarHBondContact O-CB 3.11Å; E855-A859 PolarHBondContact O-N 2.92Å; F856-A859 PolarHBondContact O-N 3.02Å; L857-A859 VanDerWaalsContact C-N 3.33Å; L857-A859 PolarHBondContact O-N 3.43Å; A859-R862 PolarHBondContact O-N 3.34Å; A859-Q863 WeakPolarHBondContact O-CG 3.45Å; A859-Q863 PolarHBondContact O-N 3.27Å; A859-Q863 VanDerWaalsContact O-N 3.08Å
860	K	87.9	Confident	84	Confident	61 Å²	61	71.6 Å²	71.6	27%	0.265	35%	0.35	S	S	.	.	H	α-helix	trans	-67.7	-37.9	175.7	-76.3	-68.2	-179.2	-175.5	0	113.1	L597 D601 I602 F856 L857 V858 R862 Q863 H864	L597-K860 HydrophobicContact CD1-CB 4.19Å; D601-K860 WeakPolarHBondContact O-CD 3.42Å; D601-K860 WeakPolarHBondContact O-CE 3.45Å; I602-K860 HydrophobicContact CG2-CG 4.4Å; F856-K860 HydrophobicContact CD1-CG 4.11Å; F856-K860 HydrophobicContact CE1-CG 3.7Å; F856-K860 HydrophobicContact CZ-CG 4.06Å; F856-K860 PolarHBondContact O-N 2.71Å; L857-K860 PolarHBondContact O-N 3.13Å; V858-K860 VanDerWaalsContact C-N 3.34Å; V858-K860 PolarHBondContact O-N 3.5Å; K860-R862 VanDerWaalsContact C-N 3.35Å; K860-Q863 WeakPolarHBondContact O-CB 2.96Å; K860-Q863 PolarHBondContact O-N 2.94Å; K860-H864 WeakPolarHBondContact O-CB 3.37Å; K860-H864 PolarHBondContact O-N 3.46Å
861	L	88.5	Confident	83.8	Confident	10 Å²	10	70.6 Å²	70.6	5%	0.052	35%	0.347	C	S	.	.	H	α-helix	trans	-62.1	-43.6	175	-168.5	75	0	0	0	111.1	E593 M594 K596 L597 L857 V858 Q863 H864 Y865	E593-L861 HydrophobicContact CB-CD2 4.07Å; E593-L861 WeakPolarHBondContact O-CD1 3.3Å; M594-L861 HydrophobicContact CE-CD2 4.27Å; M594-L861 HydrophobicContact SD-CB 4.2Å; M594-L861 HydrophobicContact SD-CD2 4Å; K596-L861 HydrophobicContact CB-CD1 4.32Å; L597-L861 HydrophobicContact CD1-CB 4.14Å; L597-L861 HydrophobicContact CD1-CD1 4.13Å; L597-L861 HydrophobicContact CD2-CD1 4.4Å; L597-L861 HydrophobicContact CG-CD1 3.93Å; L857-L861 WeakPolarHBondContact O-CB 3.33Å; L857-L861 PolarHBondContact O-N 3.03Å; V858-L861 PolarHBondContact O-N 2.66Å; L861-Q863 PolarHBondContact O-N 2.87Å; L861-H864 WeakPolarHBondContact O-CB 3.07Å; L861-H864 PolarHBondContact O-N 3.36Å; L861-Y865 HydrophobicContact CD1-CE2 4.22Å; L861-Y865 HydrophobicContact CD2-CE2 4Å; L861-Y865 HydrophobicContact CG-CD2 4.16Å; L861-Y865 HydrophobicContact CG-CE2 3.7Å; L861-Y865 WeakPolarHBondContact O-CD2 3.47Å; L861-Y865 PolarHBondContact O-N 2.6Å; L861-Y865 VanDerWaalsContact O-N 3.07Å
862	R	87.5	Confident	83.4	Confident	172 Å²	172	74.3 Å²	74.3	65%	0.649	37%	0.365	S	S	*	.	H	α-helix	trans	-60.1	-44.5	173.8	-71.9	-178.4	-171.2	-179.6	3.9	111.8	V858 A859 K860 H864 Y865 I866	V858-R862 WeakPolarHBondContact O-CG 3.25Å; V858-R862 PolarHBondContact O-N 3.44Å; A859-R862 PolarHBondContact O-N 3.34Å; K860-R862 VanDerWaalsContact C-N 3.35Å; R862-H864 VanDerWaalsContact C-N 3.33Å; R862-H864 PolarHBondContact O-N 2.91Å; R862-Y865 PolarHBondContact O-N 3.2Å; R862-I866 WeakPolarHBondContact O-CG1 3.42Å; R862-I866 PolarHBondContact O-N 2.69Å
863	Q	85.1	Confident	83	Confident	103 Å²	103	78.8 Å²	78.8	48%	0.481	39%	0.387	S	S	.	.	H	α-helix	trans	-59.7	-44.5	175.5	-72.8	178.3	-8.4	0	0	111.6	A859 K860 L861 Y865 I866 T867	A859-Q863 WeakPolarHBondContact O-CG 3.45Å; A859-Q863 PolarHBondContact O-N 3.27Å; A859-Q863 VanDerWaalsContact O-N 3.08Å; K860-Q863 WeakPolarHBondContact O-CB 2.96Å; K860-Q863 PolarHBondContact O-N 2.94Å; L861-Q863 PolarHBondContact O-N 2.87Å; Q863-Y865 VanDerWaalsContact C-N 3.3Å; Q863-Y865 PolarHBondContact O-N 3.49Å; Q863-I866 PolarHBondContact O-N 2.92Å; Q863-T867 PolarHBondContact O-N 3.22Å; Q863-T867 VanDerWaalsContact O-N 3.09Å; Q863-T867 PolarHBondContact O-OG1 3.46Å
864	H	81.8	Confident	82.7	Confident	47 Å²	47	82.9 Å²	82.9	22%	0.218	41%	0.405	C	S	.	.	H	α-helix	trans	-61.2	-36.7	179.2	-175.8	-84.1	0	0	0	112.5	L597 D601 K860 L861 R862 I866 T867 I868	L597-H864 HydrophobicContact CD2-CB 3.68Å; D601-H864 IonicContact OD2-CD2 3.77Å; K860-H864 WeakPolarHBondContact O-CB 3.37Å; K860-H864 PolarHBondContact O-N 3.46Å; L861-H864 WeakPolarHBondContact O-CB 3.07Å; L861-H864 PolarHBondContact O-N 3.36Å; R862-H864 VanDerWaalsContact C-N 3.33Å; R862-H864 PolarHBondContact O-N 2.91Å; H864-I866 VanDerWaalsContact C-N 3.33Å; H864-T867 WeakPolarHBondContact CA-OG1 3.19Å; H864-T867 PolarHBondContact O-N 3.06Å; H864-T867 PolarHBondContact O-OG1 2.06Å; H864-I868 WeakPolarHBondContact CE1-CD1 3.32Å; H864-I868 WeakPolarHBondContact ND1-CD1 3.04Å; H864-I868 WeakPolarHBondContact O-CG1 3.41Å; H864-I868 PolarHBondContact O-N 3.29Å
865	Y	82.3	Confident	82.5	Confident	105 Å²	105	83.7 Å²	83.7	41%	0.412	41%	0.411	S	S	.	.	H	α-helix	trans	-70.6	-24.6	173.5	-76.1	-64.1	0	0	0	114.3	K596 L861 R862 Q863	K596-Y865 PolarHBondContact NZ-OH 2.91Å; L861-Y865 HydrophobicContact CD1-CE2 4.22Å; L861-Y865 HydrophobicContact CD2-CE2 4Å; L861-Y865 HydrophobicContact CG-CD2 4.16Å; L861-Y865 HydrophobicContact CG-CE2 3.7Å; L861-Y865 WeakPolarHBondContact O-CD2 3.47Å; L861-Y865 PolarHBondContact O-N 2.6Å; L861-Y865 VanDerWaalsContact O-N 3.07Å; R862-Y865 PolarHBondContact O-N 3.2Å; Q863-Y865 VanDerWaalsContact C-N 3.3Å; Q863-Y865 PolarHBondContact O-N 3.49Å
866	I	80.3	Confident	82.4	Confident	141 Å²	141	80.9 Å²	80.9	72%	0.723	40%	0.399	S	S	*	.	H	α-helix	trans	-80	-30.6	176.7	-65.4	164.2	0	0	0	110.8	R862 Q863 H864	R862-I866 WeakPolarHBondContact O-CG1 3.42Å; R862-I866 PolarHBondContact O-N 2.69Å; Q863-I866 PolarHBondContact O-N 2.92Å; H864-I866 VanDerWaalsContact C-N 3.33Å
867	T	71.3	Confident	82	Confident	117 Å²	117	84 Å²	84	72%	0.718	42%	0.416	S	S	*	.	H	α-helix	trans	-82.6	-17.8	-179.2	48.6	0	0	0	0	114.6	Q863 H864	Q863-T867 PolarHBondContact O-N 3.22Å; Q863-T867 VanDerWaalsContact O-N 3.09Å; Q863-T867 PolarHBondContact O-OG1 3.46Å; H864-T867 WeakPolarHBondContact CA-OG1 3.19Å; H864-T867 PolarHBondContact O-N 3.06Å; H864-T867 PolarHBondContact O-OG1 2.06Å
868	I	55.1	Low	81.4	Confident	165 Å²	165	91.3 Å²	91.3	85%	0.846	45%	0.452	S	S	*	.			trans	-87.5	0	170.8	-65.5	169.7	0	0	0	108.3	H864	H864-I868 WeakPolarHBondContact CE1-CD1 3.32Å; H864-I868 WeakPolarHBondContact ND1-CD1 3.04Å; H864-I868 WeakPolarHBondContact O-CG1 3.41Å; H864-I868 PolarHBondContact O-N 3.29Å

Retrieved 868 of 868 residues in 314.8 ms (Link to these results)

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