A0A087XNI8_POEFO Loading...

Anion exchange protein

AlphaFold DB , UniProt , Accession A0A087XNI8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,076 aa.

						>A0A087XNI8_POEFO|A0A087XNI8
MDEQSKEEHVLTGLDEEALVDHGKTSFTTLSNYETEDLESHRAVYVGVHVPFGRGSKRRHRHRERRHHRKKKDRDCEEGKEDGRESPSYDTPSQRVQFILGTEDDDLEHIPHDLFTELDELSFRHGGATEWRETARWLKFEEDVEDGGERWSKPYVATLSLHSLFELRSCILNGTVMLDMRANSIEEIADMVIDSMVASGQLKEDLRAKVREAMLKKHHHQNERKLSNRIPLVRSIADIGKKHSDPLLLERNGPMVSPHSLPNNLDGNKAMERRPSKVGVDMNFMKKIPPGAEASNVLVGEVDFLEKPIIAFVRLSPAVLITGLTEVPVPTRFLFLLLGPHGKGPQYHEIGRSMATLMTDEIFHDVAYKAKDRTDLLSGIDEFLDQVTVLPPGEWDPTIRIEPPKNVPSQMKRKRPSHPNGNAPPAGELEKEDDHHAGPELQRTGRIFGGLILDVKRKAPFYWSDIKDSLNLQCLASILFLYCACMSPVITFGGLLGEATKGNISAIESLFGASLTGVAYSLFAGQPLTILGSTGPVLVFEKILFKFCKDYGLSYLSLRTSIGLWTVFLCILLVATDASSLVCYITRFTEEAFAALICIIFIYEALEKLFHLGEYYPVNMHNSLDNLTFYSCQCSPPANASDQLLQHWNLTGYNSSDFIPWSNLNVSMCKLLDGEFVGPACGHHGPYIPDVLFWSIILFFTTFFLSSFLKQFKTERYFPTKVRSTISDFAVFLTIMIMVLVDYLMGIPSPKLHVPDRFEPTSKHRGWLMDPLGENPWWTLLVAAVPALLCTILIFMDQQITAVIINRKEHKLKKGCGYHLDLLIVAIMLGVCSIMGLPWFVAATVLSISHVNSLKVESGCSAPGEQPKFLGIREQRVTGFMIFTLMGCSVFMTSVLKFIPMPVLYGVFLYMGVSSLKGIQFFDRIKLFGMPAKHQPDLIYLRYVPLWKVHVFTLVQLTCLVLLWVIKASAAAVVFPMMVLALVFIRKLLDLLFTKRELSWLDDLMPESKKKTEDDKKKKAQEKLEEESRLEEEEEEERKMKVRFEGSNRLNIPVNSFSGRSYRIGVVTESLQWKNR
					

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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	30.5	Very low	25.4	Very low	224 Å²	224	169.1 Å²	169.1	100%	1.103	85%	0.845	S	S	*	*				0	95.4	0	-70.9	179.1	78	0	0	105.2
2	D	29.8	Very low	25.3	Very low	154 Å²	154	166 Å²	166	82%	0.824	84%	0.842	S	S	*	*			cis	-146.8	139.2	20.5	-72.6	-41.1	0	0	0	109.9
3	E	27.3	Very low	25.2	Very low	194 Å²	194	159.2 Å²	159.2	91%	0.907	84%	0.839	S	S	*	*			trans	-87.5	138.7	166.1	-82.4	178.3	133	0	0	108.8
4	Q	25.6	Very low	25.3	Very low	201 Å²	201	160.4 Å²	160.4	94%	0.939	84%	0.844	S	S	*	*			trans	-143.4	131.4	155.1	-113.1	178.2	-1.8	0	0	111.1
5	S	24.4	Very low	25.3	Very low	102 Å²	102	160.1 Å²	160.1	71%	0.713	84%	0.844	S	S	*	*			trans	-117.6	151.2	-170.4	58.2	0	0	0	0	111.5
6	K	25.6	Very low	25.5	Very low	197 Å²	197	162.6 Å²	162.6	86%	0.857	85%	0.849	S	S	*	*			trans	79.3	120	150.6	-75.7	-179.5	170.6	-177.6	0	121.3
7	E	23.2	Very low	25.6	Very low	183 Å²	183	163.7 Å²	163.7	86%	0.855	85%	0.85	S	S	*	*				162.9	108.6	116.4	-88.2	178.7	171.8	0	0	108.5
8	E	23.7	Very low	25.7	Very low	173 Å²	173	160 Å²	160	81%	0.808	85%	0.847	S	S	*	*				44.8	134.2	97	-77.7	-172.6	-177.5	0	0	114.7
9	H	21.7	Very low	25.7	Very low	145 Å²	145	160.7 Å²	160.7	67%	0.671	85%	0.85	S	S	*	*			cis	-170.9	153.6	10.4	-121.5	-71.5	0	0	0	106.7
10	V	23.2	Very low	25.7	Very low	135 Å²	135	158.5 Å²	158.5	82%	0.818	84%	0.843	S	S	*	*			trans	-178.6	127.9	135.9	163.5	0	0	0	0	110
11	L	24.5	Very low	25.7	Very low	152 Å²	152	158.7 Å²	158.7	80%	0.796	84%	0.844	S	S	*	*			trans	-75.2	139.2	170.7	-92.4	87.3	0	0	0	112.1
12	T	24	Very low	25.4	Very low	132 Å²	132	155.2 Å²	155.2	81%	0.81	83%	0.825	S	S	*	*			trans	-133.5	118.7	151.4	44.9	0	0	0	0	108.9
13	G	24.8	Very low	25.4	Very low	78 Å²	78	151.9 Å²	151.9	80%	0.804	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-73.8	143.1	171.9	0	0	0	0	0	111.3
14	L	26.5	Very low	25.3	Very low	175 Å²	175	151.8 Å²	151.8	92%	0.916	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-91.3	138.5	-179.8	-80	152	0	0	0	110.7
15	D	24.8	Very low	25.6	Very low	157 Å²	157	149.2 Å²	149.2	84%	0.84	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-63.4	134.9	171.6	-66.4	-54.3	0	0	0	111.8
16	E	28.2	Very low	25.7	Very low	199 Å²	199	149 Å²	149	93%	0.93	82%	0.821	S	S	*	*			trans	-84.8	104.7	164.9	-78	-162.7	154.6	0	0	109.9
17	E	27.2	Very low	25.9	Very low	182 Å²	182	149.7 Å²	149.7	85%	0.85	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-78	131.6	161.6	-76.5	-174.6	150.4	0	0	110.3	L19	E17-L19 PolarHBondContact O-N 3.46Å
18	A	27.1	Very low	26.1	Very low	97 Å²	97	147.2 Å²	147.2	80%	0.802	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-67.4	125.2	177.8	0	0	0	0	0	112	V20	A18-V20 PolarHBondContact O-N 3.42Å
19	L	25.7	Very low	26.5	Very low	174 Å²	174	144.9 Å²	144.9	91%	0.911	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-66.8	119.8	170.8	-88.9	150.8	0	0	0	111.1	E17	E17-L19 PolarHBondContact O-N 3.46Å
20	V	27	Very low	27.1	Very low	116 Å²	116	146 Å²	146	70%	0.703	83%	0.829	S	S	*	*			trans	-76.8	113.5	166.6	175.3	0	0	0	0	108	A18	A18-V20 PolarHBondContact O-N 3.42Å
21	D	25.2	Very low	27.3	Very low	162 Å²	162	143.9 Å²	143.9	87%	0.866	82%	0.82	S	S	*	*			trans	-95.1	120	173.6	-153.9	1.3	0	0	0	111.2
22	H	24.8	Very low	27.6	Very low	151 Å²	151	144.1 Å²	144.1	70%	0.699	82%	0.823	S	S	*	*			trans	-87.1	121.8	176.6	-85.3	-76	0	0	0	108.7	K24	H22-K24 PolarHBondContact O-N 3.19Å; H22-K24 VanDerWaalsContact O-N 3.07Å
23	G	29.9	Very low	27.8	Very low	85 Å²	85	144.8 Å²	144.8	88%	0.876	81%	0.811	S	S	*	*			trans	-43.1	116	176.8	0	0	0	0	0	113
24	K	24.3	Very low	28.3	Very low	191 Å²	191	147.7 Å²	147.7	83%	0.83	80%	0.804	S	S	*	*			trans	-119.7	120.2	164.6	-86.9	-179	177.7	172.7	0	109	H22 S26	H22-K24 PolarHBondContact O-N 3.19Å; H22-K24 VanDerWaalsContact O-N 3.07Å; K24-S26 PolarHBondContact O-N 2.63Å
25	T	31.6	Very low	28.6	Very low	147 Å²	147	145.1 Å²	145.1	90%	0.902	80%	0.796	S	S	*	*			trans	-65.2	119.9	161	41.7	0	0	0	0	108.8
26	S	26.1	Very low	29.2	Very low	99 Å²	99	144.8 Å²	144.8	69%	0.692	79%	0.789	S	S	*	*			trans	-128.9	103.5	168.7	49.7	0	0	0	0	110.3	K24 T28	K24-S26 PolarHBondContact O-N 2.63Å; S26-T28 PolarHBondContact O-N 2.98Å
27	F	31.4	Very low	29.5	Very low	211 Å²	211	139.5 Å²	139.5	93%	0.925	77%	0.767	S	S	*	*			trans	-57.3	118.7	152.9	-85.7	-95.9	0	0	0	108.6
28	T	27	Very low	29.9	Very low	130 Å²	130	134.7 Å²	134.7	80%	0.798	75%	0.747	S	S	*	*			trans	-144	115.3	156.1	27.3	0	0	0	0	109.4	S26	S26-T28 PolarHBondContact O-N 2.98Å
29	T	31	Very low	30.5	Very low	125 Å²	125	137.1 Å²	137.1	77%	0.767	74%	0.741	S	S	*	*			trans	-65.7	147.1	169.7	42.6	0	0	0	0	111.6
30	L	34.8	Very low	31.2	Very low	168 Å²	168	131.4 Å²	131.4	88%	0.88	72%	0.716	S	S	*	*			trans	74	82.5	166.4	-71.7	133.4	0	0	0	117.2
31	S	27.8	Very low	31.7	Very low	90 Å²	90	131.7 Å²	131.7	63%	0.629	71%	0.71	S	S	*	*			trans	-125.4	131.4	144	53.6	0	0	0	0	108.2	Y33	S31-Y33 PolarHBondContact O-N 3.14Å
32	N	30.2	Very low	32.4	Very low	158 Å²	158	133.5 Å²	133.5	85%	0.845	70%	0.704	S	S	*	*			trans	-64.6	105.4	175.2	-69.8	-29.7	0	0	0	108.2	E34	N32-E34 PolarHBondContact O-N 3.4Å
33	Y	28.6	Very low	33.6	Very low	146 Å²	146	127.5 Å²	127.5	57%	0.573	68%	0.681	S	S	*	*			trans	-66.7	121.3	167	-81.3	-92.1	0	0	0	108.2	S31 D37 L38	S31-Y33 PolarHBondContact O-N 3.14Å; Y33-D37 HydrophobicContact CD1-CB 4.3Å; Y33-L38 HydrophobicContact CD1-CD1 4.39Å; Y33-L38 HydrophobicContact CG-CD1 4.18Å
34	E	34.4	Very low	34.8	Very low	139 Å²	139	125.9 Å²	125.9	65%	0.65	65%	0.654	S	S	*	*			trans	-61.7	142.7	163.9	-69.2	-176.3	159.4	0	0	108.2	N32 E36 D37 L38	N32-E34 PolarHBondContact O-N 3.4Å; E34-E36 PolarHBondContact O-N 3.32Å; E34-E36 VanDerWaalsContact O-N 3.12Å; E34-D37 PolarHBondContact O-N 3.18Å; E34-D37 VanDerWaalsContact O-N 3.16Å; E34-L38 PolarHBondContact O-N 3.48Å
35	T	33.7	Very low	36.4	Very low	121 Å²	121	118.4 Å²	118.4	74%	0.742	62%	0.62	S	S	*	*	H	α-helix	trans	-60.3	-22.7	-175.1	32.3	0	0	0	0	113.4	E39	T35-E39 PolarHBondContact O-N 2.78Å
36	E	37.3	Very low	37.8	Very low	150 Å²	150	111.6 Å²	111.6	70%	0.701	58%	0.579	S	S	*	*	H	α-helix	trans	-71.5	-39.5	176.3	-70.4	-177.7	159.4	0	0	112.7	E34 L38 E39 S40	E34-E36 PolarHBondContact O-N 3.32Å; E34-E36 VanDerWaalsContact O-N 3.12Å; E36-L38 VanDerWaalsContact C-N 3.3Å; E36-L38 PolarHBondContact O-N 3.11Å; E36-E39 PolarHBondContact O-N 3.22Å; E36-S40 PolarHBondContact O-N 3.14Å
37	D	35.3	Very low	39.2	Very low	87 Å²	87	107.3 Å²	107.3	47%	0.465	55%	0.55	S	S	.	*	H	α-helix	trans	-69.5	-30.9	177	-74.5	-24	0	0	0	111.9	Y33 E34 E39 S40 H41	Y33-D37 HydrophobicContact CD1-CB 4.3Å; E34-D37 PolarHBondContact O-N 3.18Å; E34-D37 VanDerWaalsContact O-N 3.16Å; D37-E39 VanDerWaalsContact C-N 3.34Å; D37-S40 PolarHBondContact O-N 3.42Å; D37-H41 PolarHBondContact O-CD2 3.44Å; D37-H41 PolarHBondContact O-N 2.99Å
38	L	35.1	Very low	40.2	Very low	81 Å²	81	98 Å²	98	42%	0.424	51%	0.511	S	S	.	.	H	α-helix	trans	-71.9	-28.2	178.2	-145.7	90.6	0	0	0	112.8	Y33 E34 E36	Y33-L38 HydrophobicContact CD1-CD1 4.39Å; Y33-L38 HydrophobicContact CG-CD1 4.18Å; E34-L38 PolarHBondContact O-N 3.48Å; E36-L38 VanDerWaalsContact C-N 3.3Å; E36-L38 PolarHBondContact O-N 3.11Å
39	E	39.3	Very low	41.2	Very low	148 Å²	148	95 Å²	95	69%	0.692	49%	0.488	S	S	*	.	H	α-helix	trans	-76.1	-38.7	174.3	-78.2	-175.6	164.1	0	0	111.6	T35 E36 D37 H41 R42 A43	T35-E39 PolarHBondContact O-N 2.78Å; E36-E39 PolarHBondContact O-N 3.22Å; D37-E39 VanDerWaalsContact C-N 3.34Å; E39-H41 VanDerWaalsContact C-N 3.33Å; E39-H41 PolarHBondContact O-N 3.13Å; E39-R42 PolarHBondContact O-N 2.78Å; E39-R42 VanDerWaalsContact O-N 3.13Å; E39-A43 PolarHBondContact O-N 3.22Å
40	S	39.8	Very low	41.8	Very low	55 Å²	55	89.7 Å²	89.7	39%	0.385	46%	0.455	S	S	.	.	H	α-helix	trans	-59.3	-40.5	175.8	-174.2	0	0	0	0	112.6	E36 D37 R42 A43	E36-S40 PolarHBondContact O-N 3.14Å; D37-S40 PolarHBondContact O-N 3.42Å; S40-R42 VanDerWaalsContact C-N 3.25Å; S40-R42 PolarHBondContact O-N 3.41Å; S40-A43 PolarHBondContact O-N 3.45Å
41	H	38.8	Very low	42.1	Very low	121 Å²	121	82.6 Å²	82.6	56%	0.56	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.4	-5.1	178.2	-73.9	-59.6	0	0	0	115.3	D37 E39	D37-H41 PolarHBondContact O-CD2 3.44Å; D37-H41 PolarHBondContact O-N 2.99Å; E39-H41 VanDerWaalsContact C-N 3.33Å; E39-H41 PolarHBondContact O-N 3.13Å
42	R	39.6	Very low	42.5	Very low	201 Å²	201	84.5 Å²	84.5	76%	0.758	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.1	-7.6	176.4	-75.5	-178	172.5	171.2	0.3	113.8	E39 S40 V44	E39-R42 PolarHBondContact O-N 2.78Å; E39-R42 VanDerWaalsContact O-N 3.13Å; S40-R42 VanDerWaalsContact C-N 3.25Å; S40-R42 PolarHBondContact O-N 3.41Å; R42-V44 PolarHBondContact O-N 3.16Å
43	A	49.3	Very low	42.9	Very low	24 Å²	24	78.4 Å²	78.4	20%	0.198	39%	0.391	C	S	.	.	P	Polyproline II helix	trans	-77.8	116.5	-178.3	0	0	0	0	0	110.9	E39 S40 Y45 P392	E39-A43 PolarHBondContact O-N 3.22Å; S40-A43 PolarHBondContact O-N 3.45Å; A43-Y45 HydrophobicContact CB-CE2 3.78Å; A43-Y45 VanDerWaalsContact O-CD2 3.24Å; A43-Y45 WeakPolarHBondContact O-CD2 3.25Å; A43-Y45 WeakPolarHBondContact O-CE2 3.42Å; A43-P392 WeakPolarHBondContact O-CB 3.49Å
44	V	54.4	Low	43.4	Very low	52 Å²	52	78.6 Å²	78.6	32%	0.315	39%	0.39	S	S	.	.	P	Polyproline II helix	trans	-79.1	123.8	170.7	178.9	0	0	0	0	108.2	R42 L161 V389	R42-V44 PolarHBondContact O-N 3.16Å; V44-L161 HydrophobicContact CB-CB 4.23Å; V44-L161 HydrophobicContact CB-CD1 4.41Å; V44-L161 HydrophobicContact CG1-CB 4.47Å; V44-L161 HydrophobicContact CG1-CD1 3.98Å; V44-L161 VanDerWaalsContact O-CB 3.26Å; V44-L161 WeakPolarHBondContact O-CB 3.3Å; V44-L161 PolarHBondContact O-N 2.85Å; V44-V389 HydrophobicContact CG1-CB 4.47Å; V44-V389 HydrophobicContact CG1-CG1 3.29Å
45	Y	58.8	Low	43.2	Very low	33 Å²	33	74.7 Å²	74.7	13%	0.129	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	153.9	179.6	-68.4	-87.2	0	0	0	111.7	A43 L159 L390 P397	A43-Y45 HydrophobicContact CB-CE2 3.78Å; A43-Y45 VanDerWaalsContact O-CD2 3.24Å; A43-Y45 WeakPolarHBondContact O-CD2 3.25Å; A43-Y45 WeakPolarHBondContact O-CE2 3.42Å; Y45-L159 CarbonylContact C-O 3.58Å; Y45-L159 WeakPolarHBondContact CA-O 3.35Å; Y45-L390 PolarHBondContact O-N 3.41Å; Y45-P397 HydrophobicContact CD2-CG 4.31Å; Y45-P397 HydrophobicContact CE1-CB 4.11Å; Y45-P397 HydrophobicContact CE1-CG 4.18Å; Y45-P397 HydrophobicContact CE2-CB 4.33Å; Y45-P397 HydrophobicContact CE2-CG 3.52Å; Y45-P397 VanDerWaalsContact CZ-CG 3.43Å; Y45-P397 WeakPolarHBondContact OH-CG 3.33Å
46	V	60.7	Low	42.9	Very low	4 Å²	4	74.6 Å²	74.6	2%	0.024	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	116.7	-164.8	172.4	0	0	0	0	108.4	L159 L161 L164 V387	V46-L159 PolarHBondContact N-O 2.97Å; V46-L159 PolarHBondContact O-N 3.42Å; V46-L161 HydrophobicContact CG2-CB 3.74Å; V46-L161 HydrophobicContact CG2-CD1 3.79Å; V46-L161 HydrophobicContact CG2-CG 3.98Å; V46-L164 HydrophobicContact CG1-CD1 4.19Å; V46-V387 HydrophobicContact CB-CG1 4.28Å; V46-V387 HydrophobicContact CG1-CB 3.2Å; V46-V387 HydrophobicContact CG1-CG1 3Å; V46-V387 HydrophobicContact CG1-CG2 3.7Å
47	G	55.6	Low	42.5	Very low	9 Å²	9	76.3 Å²	76.3	9%	0.093	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	123.1	-173.6	0	0	0	0	0	114	V387 T388	G47-V387 VanDerWaalsContact C-CG1 3.43Å; G47-V387 WeakPolarHBondContact O-CG1 3.35Å; G47-T388 PolarHBondContact N-O 3.47Å; G47-T388 PolarHBondContact O-OG1 3Å; G47-T388 VanDerWaalsContact O-OG1 3.09Å
48	V	52.9	Low	42.1	Very low	17 Å²	17	82.1 Å²	82.1	10%	0.103	41%	0.412	C	S	.	.	P	Polyproline II helix	trans	-85.1	138.4	-168.6	-174.9	0	0	0	0	113.7	L159 T356 F383	V48-L159 HydrophobicContact CG2-CD1 4.21Å; V48-L159 HydrophobicContact CG2-CG 4.48Å; V48-T356 HydrophobicContact CB-CG2 4.39Å; V48-T356 HydrophobicContact CG1-CG2 4.32Å; V48-T356 HydrophobicContact CG2-CG2 3.74Å; V48-F383 HydrophobicContact CG1-CE2 3.99Å; V48-F383 HydrophobicContact CG1-CZ 4.15Å; V48-F383 HydrophobicContact CG2-CZ 3.85Å
49	H	46.7	Very low	41.7	Very low	67 Å²	67	89.9 Å²	89.9	31%	0.31	44%	0.436	S	S	.	.	P	Polyproline II helix	trans	-85	121	171.5	-89.4	73.5	0	0	0	111.1	Q410	H49-Q410 PolarHBondContact O-NE2 3.35Å
50	V	45.4	Very low	41.1	Very low	12 Å²	12	89.9 Å²	89.9	7%	0.073	44%	0.436	C	S	.	.	P	Polyproline II helix	trans	-78.6	149.5	-174.9	-172.8	0	0	0	0	111.8	K139 F140 V407	V50-K139 HydrophobicContact CG1-CB 4.36Å; V50-F140 HydrophobicContact CG1-CE1 4.21Å; V50-F140 HydrophobicContact CG1-CZ 4.19Å; V50-F140 HydrophobicContact CG2-CD1 4.36Å; V50-F140 HydrophobicContact CG2-CE1 3.76Å; V50-F140 HydrophobicContact CG2-CZ 4.45Å; V50-V407 HydrophobicContact CB-CG1 3.78Å; V50-V407 HydrophobicContact CB-CG2 4.42Å; V50-V407 WeakPolarHBondContact O-CG1 3.34Å
51	P	40.5	Very low	40.4	Very low	19 Å²	19	99.1 Å²	99.1	12%	0.123	46%	0.462	C	S	.	.	P	Polyproline II helix	trans	-78.5	167.5	174.1	28.3	-37.5	0	0	0	115.7	T359 E361	P51-T359 WeakPolarHBondContact CG-O 3.47Å; P51-E361 WeakPolarHBondContact CA-OE1 3.13Å; P51-E361 HydrophobicContact CB-CB 3.9Å; P51-E361 HydrophobicContact CB-CG 3.39Å; P51-E361 WeakPolarHBondContact CB-OE1 3.35Å; P51-E361 HydrophobicContact CG-CG 4.43Å
52	F	36.4	Very low	39.8	Very low	131 Å²	131	101.2 Å²	101.2	58%	0.575	47%	0.472	S	S	*	.	P	Polyproline II helix	trans	-96	132.3	174.9	-168.2	-90.3	0	0	0	110.6	R54 E361	F52-R54 PolarHBondContact O-N 3.38Å; F52-E361 PolarHBondContact N-OE1 3.43Å
53	G	37.5	Very low	39.3	Very low	30 Å²	30	103.5 Å²	103.5	31%	0.309	48%	0.48	S	S	.	.	P	Polyproline II helix	trans	-61.2	133.2	177.6	0	0	0	0	0	112.2	G55	G53-G55 PolarHBondContact O-N 3.1Å
54	R	40.1	Very low	38.2	Very low	149 Å²	149	110.7 Å²	110.7	56%	0.562	51%	0.51	S	S	*	.			trans	-55.1	105.7	173.1	-84.5	-177.5	178.5	177.7	6.7	109.8	F52 S56 P111	F52-R54 PolarHBondContact O-N 3.38Å; R54-S56 PolarHBondContact O-N 3.23Å; R54-P111 PolarHBondContact NH1-O 3.1Å; R54-P111 PolarHBondContact NH2-O 3.18Å
55	G	30.1	Very low	37	Very low	58 Å²	58	119.3 Å²	119.3	60%	0.598	54%	0.537	S	S	*	.			trans	-62.1	121.1	158.4	0	0	0	0	0	106.9	G53 K57	G53-G55 PolarHBondContact O-N 3.1Å; G55-K57 PolarHBondContact O-N 3.02Å
56	S	27.4	Very low	35.5	Very low	118 Å²	118	129.1 Å²	129.1	83%	0.825	57%	0.573	S	S	*	*			trans	-58.9	74.8	171.7	168.9	0	0	0	0	110.3	R54 R58	R54-S56 PolarHBondContact O-N 3.23Å; S56-R58 PolarHBondContact O-N 3.15Å
57	K	27.8	Very low	34	Very low	187 Å²	187	137.5 Å²	137.5	81%	0.813	61%	0.612	S	S	*	*			trans	-79.9	102.7	159.3	-77.2	-177.2	174.9	179.3	0	104.5	G55 R59	G55-K57 PolarHBondContact O-N 3.02Å; K57-R59 VanDerWaalsContact C-N 3.31Å; K57-R59 PolarHBondContact O-N 3.05Å
58	R	27.2	Very low	32.7	Very low	209 Å²	209	146.1 Å²	146.1	79%	0.789	65%	0.649	S	S	*	*			trans	-47.7	105.9	155.8	-77.3	179.4	173.5	174.4	-3.1	106	S56 H60	S56-R58 PolarHBondContact O-N 3.15Å; R58-H60 PolarHBondContact O-N 3.15Å
59	R	27.2	Very low	31.5	Very low	243 Å²	243	157.1 Å²	157.1	92%	0.917	69%	0.689	S	S	*	*			trans	-64.4	93.8	167.3	-81.4	-175.9	175.1	-176.8	-1.1	105.2	K57 R61	K57-R59 VanDerWaalsContact C-N 3.31Å; K57-R59 PolarHBondContact O-N 3.05Å; R59-R61 PolarHBondContact O-N 2.71Å; R59-R61 VanDerWaalsContact O-N 3.08Å
60	H	26	Very low	30.7	Very low	149 Å²	149	163.8 Å²	163.8	69%	0.69	72%	0.717	S	S	*	*			trans	-60.3	112.6	164.9	-83.5	-77.8	0	0	0	106.2	R58 H62	R58-H60 PolarHBondContact O-N 3.15Å; H60-H62 VanDerWaalsContact C-N 3.31Å; H60-H62 PolarHBondContact O-N 2.83Å
61	R	25.7	Very low	29.9	Very low	249 Å²	249	172.7 Å²	172.7	94%	0.94	76%	0.755	S	S	*	*			trans	-54.6	99.3	164.6	-92.1	-179.3	167.6	174.3	-3.8	107.2	R59 R63	R59-R61 PolarHBondContact O-N 2.71Å; R59-R61 VanDerWaalsContact O-N 3.08Å; R61-R63 PolarHBondContact O-N 3.47Å
62	H	25.7	Very low	29.4	Very low	165 Å²	165	181.3 Å²	181.3	76%	0.764	79%	0.79	S	S	*	*			trans	-71	114.4	162.7	-96.8	-78.5	0	0	0	107	H60 E64	H60-H62 VanDerWaalsContact C-N 3.31Å; H60-H62 PolarHBondContact O-N 2.83Å; H62-E64 VanDerWaalsContact C-N 3.26Å; H62-E64 PolarHBondContact O-N 3.36Å
63	R	29	Very low	29.1	Very low	248 Å²	248	181.8 Å²	181.8	94%	0.936	80%	0.799	S	S	*	*			trans	-73.3	83.8	172.3	-160.2	178.2	-169.4	174.2	2.7	107.1	R61	R61-R63 PolarHBondContact O-N 3.47Å
64	E	27.9	Very low	28.7	Very low	175 Å²	175	192.1 Å²	192.1	82%	0.818	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-81.3	129	173.8	-84.9	-173.7	164.4	0	0	111	H62 R66	H62-E64 VanDerWaalsContact C-N 3.26Å; H62-E64 PolarHBondContact O-N 3.36Å; E64-R66 PolarHBondContact O-N 2.89Å
65	R	29.2	Very low	28.2	Very low	233 Å²	233	191.9 Å²	191.9	88%	0.879	84%	0.839	S	S	*	*	P	Polyproline II helix	trans	-71.7	117.7	178.5	-72.9	176.1	172.1	-178.7	-3.4	108.8	H67	R65-H67 PolarHBondContact O-N 2.95Å
66	R	27.4	Very low	28.2	Very low	239 Å²	239	195.4 Å²	195.4	90%	0.902	85%	0.853	S	S	*	*	P	Polyproline II helix	trans	-61.1	117	170.1	-73.6	179.3	174.4	-179.8	-2.9	110.1	E64	E64-R66 PolarHBondContact O-N 2.89Å
67	H	28.9	Very low	28.4	Very low	180 Å²	180	198 Å²	198	83%	0.833	85%	0.852	S	S	*	*			trans	-96.3	115.5	157.4	-85.7	-74.8	0	0	0	108.8	R65 R69	R65-H67 PolarHBondContact O-N 2.95Å; H67-R69 PolarHBondContact O-N 3.39Å
68	H	27.2	Very low	28.6	Very low	190 Å²	190	197.9 Å²	197.9	88%	0.88	85%	0.854	S	S	*	*			trans	-58.8	124.5	170.8	-81.5	-77.1	0	0	0	110.8
69	R	28.7	Very low	28.7	Very low	248 Å²	248	191.6 Å²	191.6	94%	0.936	85%	0.854	S	S	*	*			trans	-115.3	107.3	158.3	-148.2	173.4	-175.6	177.1	0.2	108.2	H67 K71	H67-R69 PolarHBondContact O-N 3.39Å; R69-K71 PolarHBondContact O-N 2.84Å
70	K	29.1	Very low	29.1	Very low	208 Å²	208	190.2 Å²	190.2	90%	0.904	86%	0.855	S	S	*	*	P	Polyproline II helix	trans	-51	122.5	174.6	-94.9	176.1	166.6	178.5	0	110.2
71	K	29.9	Very low	29.3	Very low	199 Å²	199	192.4 Å²	192.4	87%	0.865	87%	0.865	S	S	*	*	P	Polyproline II helix	trans	-87.6	131.3	162.3	-158.6	173.4	-178.4	-177.5	0	107	R69	R69-K71 PolarHBondContact O-N 2.84Å
72	K	28.1	Very low	29.9	Very low	199 Å²	199	189.2 Å²	189.2	87%	0.865	87%	0.867	S	S	*	*	P	Polyproline II helix	trans	-88.4	126	-176.3	-175.5	178.8	179.6	-179.3	0	108.4
73	D	30.3	Very low	30.2	Very low	141 Å²	141	184.4 Å²	184.4	75%	0.754	86%	0.863	S	S	*	*	P	Polyproline II helix	trans	-61.7	143.4	176.8	-61.6	-50.7	0	0	0	112
74	R	30.6	Very low	30.8	Very low	247 Å²	247	184.9 Å²	184.9	93%	0.932	86%	0.864	S	S	*	*			trans	-146.7	108.1	156.6	-143.9	178.7	-177.4	-171.7	-1.5	108.3
75	D	29.5	Very low	30.9	Very low	144 Å²	144	185.4 Å²	185.4	77%	0.77	87%	0.867	S	S	*	*			trans	-65.8	141.6	178.3	-56.3	-53.7	0	0	0	112.1
76	C	29.2	Very low	31.3	Very low	132 Å²	132	179.1 Å²	179.1	89%	0.892	86%	0.859	S	S	*	*			trans	-150	112.8	141.3	-89.5	0	0	0	0	107.4
77	E	32.2	Very low	32.1	Very low	173 Å²	173	171.7 Å²	171.7	81%	0.808	84%	0.841	S	S	*	*			trans	-61.5	161.4	157.9	-55.8	-159.4	147.9	0	0	109.2
78	E	31.3	Very low	32.7	Very low	184 Å²	184	168.7 Å²	168.7	86%	0.86	84%	0.84	S	S	*	*			cis	-168.8	148.9	21.1	-143	176.5	-173.3	0	0	105.5
79	G	29	Very low	33.9	Very low	77 Å²	77	163.1 Å²	163.1	79%	0.794	81%	0.812	S	S	*	*			trans	156.9	90.5	171.3	0	0	0	0	0	114.5
80	K	36.9	Very low	35.1	Very low	215 Å²	215	158.2 Å²	158.2	94%	0.935	81%	0.805	S	S	*	*			trans	-70.8	125	166	-86	175.1	170.3	175.4	0	110
81	E	29.8	Very low	37.4	Very low	194 Å²	194	151 Å²	151	91%	0.907	78%	0.778	S	S	*	*			trans	-150.9	129.1	140.7	-114	176	-173.3	0	0	109.3	G83	E81-G83 PolarHBondContact O-N 3.29Å
82	D	38	Very low	39.5	Very low	182 Å²	182	143.8 Å²	143.8	97%	0.973	75%	0.751	S	S	*	*			trans	-66.4	115.9	177.6	-83	-49.3	0	0	0	110.3
83	G	31.6	Very low	41.6	Very low	65 Å²	65	135.7 Å²	135.7	67%	0.67	72%	0.72	S	S	*	*			trans	-162.7	103	171.7	0	0	0	0	0	110.7	E81 E85	E81-G83 PolarHBondContact O-N 3.29Å; G83-E85 VanDerWaalsContact C-N 3.28Å; G83-E85 PolarHBondContact O-N 2.76Å
84	R	41.3	Very low	43.8	Very low	258 Å²	258	133 Å²	133	97%	0.974	70%	0.703	S	S	*	*			trans	-72.5	85.2	166.8	-74.7	-179.1	179.6	172.4	-0.2	108.5
85	E	30.3	Very low	46.1	Very low	185 Å²	185	124.2 Å²	124.2	86%	0.864	67%	0.67	S	S	*	*	P	Polyproline II helix	trans	-93.6	122.8	164.6	-73.3	-171.7	165.5	0	0	109.6	G83	G83-E85 VanDerWaalsContact C-N 3.28Å; G83-E85 PolarHBondContact O-N 2.76Å
86	S	38	Very low	48.5	Very low	102 Å²	102	117.4 Å²	117.4	71%	0.713	63%	0.633	S	S	*	*	P	Polyproline II helix	trans	-64.6	150.7	171.5	-54	0	0	0	0	109	S88	S86-S88 PolarHBondContact O-N 3.29Å
87	P	43.7	Very low	50.7	Low	83 Å²	83	113.3 Å²	113.3	54%	0.539	60%	0.601	S	S	.	*	P	Polyproline II helix	trans	-54.5	136.1	171.3	-17.9	29.4	0	0	0	109.9	Y89	P87-Y89 HydrophobicContact CB-CE1 4.21Å; P87-Y89 HydrophobicContact CB-CE2 4.21Å; P87-Y89 HydrophobicContact CG-CE2 4.36Å; P87-Y89 WeakPolarHBondContact O-CD2 3.26Å; P87-Y89 VanDerWaalsContact O-CE2 3.29Å; P87-Y89 WeakPolarHBondContact O-CE2 3.15Å; P87-Y89 PolarHBondContact O-N 2.92Å; P87-Y89 VanDerWaalsContact O-N 3.1Å
88	S	42.6	Very low	52.9	Low	116 Å²	116	110.4 Å²	110.4	81%	0.811	59%	0.586	S	S	*	*			trans	-68.1	106.5	169.5	57.3	0	0	0	0	108.4	S86	S86-S88 PolarHBondContact O-N 3.29Å
89	Y	52.4	Low	55.2	Low	73 Å²	73	102.2 Å²	102.2	29%	0.286	55%	0.548	S	S	.	.			trans	-88.9	130	174.5	-58.3	-79.1	0	0	0	109.3	P87 R95 F98	P87-Y89 HydrophobicContact CB-CE1 4.21Å; P87-Y89 HydrophobicContact CB-CE2 4.21Å; P87-Y89 HydrophobicContact CG-CE2 4.36Å; P87-Y89 WeakPolarHBondContact O-CD2 3.26Å; P87-Y89 VanDerWaalsContact O-CE2 3.29Å; P87-Y89 WeakPolarHBondContact O-CE2 3.15Å; P87-Y89 PolarHBondContact O-N 2.92Å; P87-Y89 VanDerWaalsContact O-N 3.1Å; Y89-R95 HydrophobicContact CD1-CB 4.49Å; Y89-R95 HydrophobicContact CD2-CG 4.32Å; Y89-R95 HydrophobicContact CG-CB 4.25Å; Y89-R95 HydrophobicContact CG-CG 4.5Å; Y89-F98 HydrophobicContact CE1-CB 4.37Å; Y89-F98 HydrophobicContact CE1-CD1 4.47Å; Y89-F98 HydrophobicContact CE1-CG 4.29Å; Y89-F98 WeakPolarHBondContact OH-CD1 3.39Å; Y89-F98 WeakPolarHBondContact OH-CE1 3.38Å
90	D	54.6	Low	57.4	Low	146 Å²	146	99.9 Å²	99.9	78%	0.781	52%	0.517	S	S	*	.	S	Bend	trans	-85.4	-20	-178.1	-79.7	-28.8	0	0	0	113.2
91	T	76.3	Confident	58.6	Low	57 Å²	57	92.3 Å²	92.3	35%	0.35	50%	0.501	S	S	.	.			trans	-141.3	148.7	176	70	0	0	0	0	114.5	S93 Q94 R95	T91-S93 VanDerWaalsContact C-N 3.26Å; T91-S93 PolarHBondContact O-N 2.99Å; T91-Q94 PolarHBondContact O-N 2.91Å; T91-Q94 VanDerWaalsContact OG1-CG 3.25Å; T91-Q94 WeakPolarHBondContact OG1-CG 3.01Å; T91-Q94 PolarHBondContact OG1-N 3.49Å; T91-R95 PolarHBondContact O-N 3.27Å
92	P	73.4	Confident	60.1	Low	46 Å²	46	84.9 Å²	84.9	30%	0.299	47%	0.468	S	S	.	.	H	α-helix	trans	-55.2	-38.6	175.2	-26.2	34.8	0	0	0	113.4	Q94 R95 V96 D381	P92-Q94 PolarHBondContact O-N 3.07Å; P92-R95 WeakPolarHBondContact O-CB 3.2Å; P92-R95 PolarHBondContact O-N 3.5Å; P92-V96 WeakPolarHBondContact O-CG2 3.49Å; P92-V96 PolarHBondContact O-N 3.41Å; P92-D381 HydrophobicContact CB-CB 4.06Å; P92-D381 HydrophobicContact CG-CB 4.21Å
93	S	73.6	Confident	60.6	Low	29 Å²	29	85.3 Å²	85.3	20%	0.203	46%	0.464	C	S	.	.	H	α-helix	trans	-61.5	-40.8	178.6	-37.2	0	0	0	0	113.1	T91 R95 V96 Q97 E382	T91-S93 VanDerWaalsContact C-N 3.26Å; T91-S93 PolarHBondContact O-N 2.99Å; S93-R95 VanDerWaalsContact C-N 3.32Å; S93-V96 PolarHBondContact O-N 2.9Å; S93-Q97 WeakPolarHBondContact O-CB 2.96Å; S93-Q97 VanDerWaalsContact O-CG 3.25Å; S93-Q97 WeakPolarHBondContact O-CG 3.01Å; S93-Q97 PolarHBondContact O-N 3.45Å; S93-E382 WeakPolarHBondContact CA-OE2 3.4Å; S93-E382 WeakPolarHBondContact CB-OE2 3.39Å; S93-E382 PolarHBondContact OG-OE2 3.26Å
94	Q	76.4	Confident	61.4	Low	86 Å²	86	86.1 Å²	86.1	40%	0.402	45%	0.454	S	S	.	.	H	α-helix	trans	-65.9	-38.9	177.1	-74.3	171.7	2	0	0	111.2	T91 P92 Q97 F98	T91-Q94 PolarHBondContact O-N 2.91Å; T91-Q94 VanDerWaalsContact OG1-CG 3.25Å; T91-Q94 WeakPolarHBondContact OG1-CG 3.01Å; T91-Q94 PolarHBondContact OG1-N 3.49Å; P92-Q94 PolarHBondContact O-N 3.07Å; Q94-Q97 PolarHBondContact O-N 3.41Å; Q94-F98 WeakPolarHBondContact O-CB 3.31Å; Q94-F98 PolarHBondContact O-N 2.89Å
95	R	77.4	Confident	61.7	Low	61 Å²	61	81.4 Å²	81.4	23%	0.23	45%	0.448	C	S	.	.	H	α-helix	trans	-65.8	-44.7	176	-173.9	172.2	176.6	163.5	5.2	111.7	Y89 T91 P92 S93 F98 I99 T374 D375 S378	Y89-R95 HydrophobicContact CD1-CB 4.49Å; Y89-R95 HydrophobicContact CD2-CG 4.32Å; Y89-R95 HydrophobicContact CG-CB 4.25Å; Y89-R95 HydrophobicContact CG-CG 4.5Å; T91-R95 PolarHBondContact O-N 3.27Å; P92-R95 WeakPolarHBondContact O-CB 3.2Å; P92-R95 PolarHBondContact O-N 3.5Å; S93-R95 VanDerWaalsContact C-N 3.32Å; R95-F98 WeakPolarHBondContact O-CB 3.44Å; R95-F98 PolarHBondContact O-N 2.67Å; R95-I99 HydrophobicContact CG-CD1 4.2Å; R95-I99 WeakPolarHBondContact O-CD1 3.32Å; R95-I99 VanDerWaalsContact O-CG1 3.28Å; R95-I99 WeakPolarHBondContact O-CG1 3.38Å; R95-I99 PolarHBondContact O-N 3.17Å; R95-T374 PolarHBondContact NH2-OG1 3.2Å; R95-D375 IonicContact CZ-OD1 2.8Å; R95-D375 IonicContact NE-OD1 2.69Å; R95-D375 PolarHBondContact NE-OD1 2.91Å; R95-D375 VanDerWaalsContact NE-OD1 3.11Å; R95-D375 IonicContact NH2-OD1 3.82Å; R95-D375 PolarHBondContact NH2-OD1 2.76Å; R95-S378 WeakPolarHBondContact CD-OG 3.37Å
96	V	79.9	Confident	62.9	Low	2 Å²	2	77.5 Å²	77.5	1%	0.012	43%	0.433	C	S	.	.	H	α-helix	trans	-61.1	-44.6	174.6	169.6	0	0	0	0	111.4	P92 S93 F98 I99 L100 I362 V366 S378 E382	P92-V96 WeakPolarHBondContact O-CG2 3.49Å; P92-V96 PolarHBondContact O-N 3.41Å; S93-V96 PolarHBondContact O-N 2.9Å; V96-F98 VanDerWaalsContact C-N 3.31Å; V96-F98 PolarHBondContact O-N 3.49Å; V96-I99 PolarHBondContact O-N 3.19Å; V96-L100 HydrophobicContact CG1-CD1 3.99Å; V96-L100 HydrophobicContact CG1-CG 4.41Å; V96-L100 VanDerWaalsContact O-CG 3.3Å; V96-L100 WeakPolarHBondContact O-CG 3.1Å; V96-L100 PolarHBondContact O-N 3.37Å; V96-I362 HydrophobicContact CG1-CG2 3.7Å; V96-V366 HydrophobicContact CG1-CG2 3.71Å; V96-V366 HydrophobicContact CG2-CG2 4.36Å; V96-S378 WeakPolarHBondContact CG2-O 3.49Å; V96-E382 HydrophobicContact CB-CG 4.49Å; V96-E382 HydrophobicContact CG1-CG 4.31Å; V96-E382 HydrophobicContact CG2-CB 4Å; V96-E382 HydrophobicContact CG2-CG 4.41Å
97	Q	77.1	Confident	63.8	Low	46 Å²	46	80 Å²	80	22%	0.215	44%	0.437	C	S	.	.	H	α-helix	trans	-62.3	-37.9	176.5	-74.1	174.5	26.3	0	0	112.6	S93 Q94 L100 G101 S417	S93-Q97 WeakPolarHBondContact O-CB 2.96Å; S93-Q97 VanDerWaalsContact O-CG 3.25Å; S93-Q97 WeakPolarHBondContact O-CG 3.01Å; S93-Q97 PolarHBondContact O-N 3.45Å; Q94-Q97 PolarHBondContact O-N 3.41Å; Q97-L100 PolarHBondContact O-N 3.42Å; Q97-G101 PolarHBondContact O-N 3.45Å; Q97-S417 PolarHBondContact OE1-OG 3.46Å
98	F	78.3	Confident	64.5	Low	112 Å²	112	81.6 Å²	81.6	49%	0.491	44%	0.437	S	S	.	.	H	α-helix	trans	-63.1	-48.1	174.2	177.1	-98.7	0	0	0	111.4	Y89 Q94 R95 V96 L100 G101 T102	Y89-F98 HydrophobicContact CE1-CB 4.37Å; Y89-F98 HydrophobicContact CE1-CD1 4.47Å; Y89-F98 HydrophobicContact CE1-CG 4.29Å; Y89-F98 WeakPolarHBondContact OH-CD1 3.39Å; Y89-F98 WeakPolarHBondContact OH-CE1 3.38Å; Q94-F98 WeakPolarHBondContact O-CB 3.31Å; Q94-F98 PolarHBondContact O-N 2.89Å; R95-F98 WeakPolarHBondContact O-CB 3.44Å; R95-F98 PolarHBondContact O-N 2.67Å; V96-F98 VanDerWaalsContact C-N 3.31Å; V96-F98 PolarHBondContact O-N 3.49Å; F98-L100 VanDerWaalsContact C-N 3.26Å; F98-L100 PolarHBondContact O-N 3.46Å; F98-G101 CarbonylContact O-C 3.59Å; F98-G101 PolarHBondContact O-N 2.93Å; F98-T102 HydrophobicContact CD1-CG2 4.49Å; F98-T102 HydrophobicContact CE1-CG2 4.04Å; F98-T102 HydrophobicContact CE2-CG2 4.24Å; F98-T102 HydrophobicContact CZ-CG2 3.9Å; F98-T102 PolarHBondContact O-N 3.45Å
99	I	78.3	Confident	65.7	Low	12 Å²	12	78 Å²	78	6%	0.062	41%	0.408	C	S	.	.	H	α-helix	trans	-56.7	-42.6	176	-65.7	160.4	0	0	0	110.6	R95 V96 T102 K369 D375	R95-I99 HydrophobicContact CG-CD1 4.2Å; R95-I99 WeakPolarHBondContact O-CD1 3.32Å; R95-I99 VanDerWaalsContact O-CG1 3.28Å; R95-I99 WeakPolarHBondContact O-CG1 3.38Å; R95-I99 PolarHBondContact O-N 3.17Å; V96-I99 PolarHBondContact O-N 3.19Å; I99-T102 PolarHBondContact O-OG1 3.5Å; I99-K369 HydrophobicContact CG2-CB 3.59Å; I99-K369 HydrophobicContact CG2-CD 4.25Å; I99-K369 WeakPolarHBondContact O-CD 3.47Å; I99-K369 PolarHBondContact O-NZ 3.05Å; I99-D375 HydrophobicContact CD1-CB 3.75Å
100	L	75.3	Confident	66.8	Low	27 Å²	27	78.2 Å²	78.2	14%	0.141	41%	0.413	C	S	.	.	H	α-helix	trans	-70.8	-32.7	177.6	-66.2	175.9	0	0	0	112.7	V96 Q97 F98 I362 D365 V366 K369	V96-L100 HydrophobicContact CG1-CD1 3.99Å; V96-L100 HydrophobicContact CG1-CG 4.41Å; V96-L100 VanDerWaalsContact O-CG 3.3Å; V96-L100 WeakPolarHBondContact O-CG 3.1Å; V96-L100 PolarHBondContact O-N 3.37Å; Q97-L100 PolarHBondContact O-N 3.42Å; F98-L100 VanDerWaalsContact C-N 3.26Å; F98-L100 PolarHBondContact O-N 3.46Å; L100-I362 HydrophobicContact CD1-CG2 4.27Å; L100-D365 HydrophobicContact CD2-CB 3.41Å; L100-D365 VanDerWaalsContact CD2-CB 3.41Å; L100-V366 HydrophobicContact CD2-CG2 4.48Å; L100-K369 PolarHBondContact O-NZ 3.14Å
101	G	62	Low	67.8	Low	57 Å²	57	72.3 Å²	72.3	59%	0.588	38%	0.383	S	S	*	.	H	α-helix	trans	-84.6	-14.5	-175.3	0	0	0	0	0	116.1	Q97 F98 E103	Q97-G101 PolarHBondContact O-N 3.45Å; F98-G101 CarbonylContact O-C 3.59Å; F98-G101 PolarHBondContact O-N 2.93Å; G101-E103 PolarHBondContact O-N 2.93Å; G101-E103 VanDerWaalsContact O-N 3.17Å
102	T	61.8	Low	68.1	Low	37 Å²	37	72.9 Å²	72.9	23%	0.227	38%	0.381	C	S	.	.			trans	-67.8	112.6	169.1	54.5	0	0	0	0	109.3	F98 I99 D104 K369	F98-T102 HydrophobicContact CD1-CG2 4.49Å; F98-T102 HydrophobicContact CE1-CG2 4.04Å; F98-T102 HydrophobicContact CE2-CG2 4.24Å; F98-T102 HydrophobicContact CZ-CG2 3.9Å; F98-T102 PolarHBondContact O-N 3.45Å; I99-T102 PolarHBondContact O-OG1 3.5Å; T102-D104 PolarHBondContact O-N 3.38Å; T102-K369 PolarHBondContact O-NZ 3.23Å
103	E	47.6	Very low	68.5	Low	191 Å²	191	73.6 Å²	73.6	89%	0.893	38%	0.382	S	S	*	.			trans	-76.8	72.9	168.3	-65.7	-170	162.1	0	0	108.4	G101 D105	G101-E103 PolarHBondContact O-N 2.93Å; G101-E103 VanDerWaalsContact O-N 3.17Å; E103-D105 PolarHBondContact O-N 3.11Å
104	D	48.4	Very low	68.9	Low	83 Å²	83	73 Å²	73	44%	0.444	38%	0.377	S	S	.	.			trans	-77.4	120	169.8	-69.6	-21.9	0	0	0	107.8	T102 D106 K371	T102-D104 PolarHBondContact O-N 3.38Å; D104-D106 PolarHBondContact O-N 2.89Å; D104-D106 VanDerWaalsContact O-N 3.07Å; D104-K371 IonicContact OD2-NZ 3.52Å
105	D	48	Very low	69.5	Low	159 Å²	159	69 Å²	69	85%	0.85	36%	0.358	S	S	*	.			trans	-71.1	11.6	180	-98	-31.3	0	0	0	113.1	E103 L107	E103-D105 PolarHBondContact O-N 3.11Å; D105-L107 PolarHBondContact O-N 3.47Å
106	D	55.1	Low	70.1	Confident	103 Å²	103	66.1 Å²	66.1	55%	0.551	35%	0.347	S	S	*	.			trans	-73.5	107.3	-176.8	-68.3	-30.1	0	0	0	110.8	D104 E108 H109	D104-D106 PolarHBondContact O-N 2.89Å; D104-D106 VanDerWaalsContact O-N 3.07Å; D106-E108 PolarHBondContact O-N 2.78Å; D106-H109 PolarHBondContact O-N 3.04Å
107	L	57.7	Low	70.7	Confident	154 Å²	154	66 Å²	66	81%	0.806	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-15	177.7	-83.4	128.4	0	0	0	113.9	D105	D105-L107 PolarHBondContact O-N 3.47Å
108	E	57.7	Low	71.3	Confident	116 Å²	116	63.9 Å²	63.9	54%	0.542	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.3	-13.6	-174.6	-68.6	-174.5	175	0	0	114.8	D106 R332	D106-E108 PolarHBondContact O-N 2.78Å; E108-R332 PolarHBondContact O-NH2 2.63Å
109	H	69.3	Low	72	Confident	41 Å²	41	58.6 Å²	58.6	19%	0.19	31%	0.314	C	S	.	.	S	Bend	trans	-118.1	27.8	-177.7	-59.8	91.3	0	0	0	113	D106 P111 D179 Y368	D106-H109 PolarHBondContact O-N 3.04Å; H109-P111 WeakPolarHBondContact O-CD 3.29Å; H109-D179 IonicContact CD2-OD1 2.79Å; H109-D179 IonicContact NE2-OD1 2.68Å; H109-D179 PolarHBondContact NE2-OD1 3.5Å; H109-D179 IonicContact NE2-OD2 2.7Å; H109-Y368 PolarHBondContact CD2-O 3.02Å
110	I	75.1	Confident	72.5	Confident	78 Å²	78	60.7 Å²	60.7	40%	0.4	32%	0.323	S	S	.	.			trans	-72	124.7	175	-59.7	173.1	0	0	0	108.8	H112	I110-H112 PolarHBondContact O-CD2 2.98Å; I110-H112 PolarHBondContact O-N 2.98Å
111	P	76.1	Confident	73.1	Confident	22 Å²	22	60 Å²	60	14%	0.143	32%	0.319	C	S	.	.			trans	-64.9	125.1	178.9	13	-19.3	0	0	0	111.5	R54 H109 H364 D365 Y368	R54-P111 PolarHBondContact NH1-O 3.1Å; R54-P111 PolarHBondContact NH2-O 3.18Å; H109-P111 WeakPolarHBondContact O-CD 3.29Å; P111-H364 WeakPolarHBondContact CB-CE1 3.38Å; P111-D365 VanDerWaalsContact CB-OD1 3.25Å; P111-D365 WeakPolarHBondContact CB-OD1 3.28Å; P111-D365 WeakPolarHBondContact CG-OD1 3.43Å; P111-Y368 HydrophobicContact CB-CD2 4.16Å; P111-Y368 HydrophobicContact CB-CE2 4.49Å; P111-Y368 HydrophobicContact CB-CG 4.41Å
112	H	80.9	Confident	73.7	Confident	68 Å²	68	58.1 Å²	58.1	32%	0.315	30%	0.297	S	S	.	.			trans	-105	156.8	174.7	-76.7	-91.9	0	0	0	111.3	I110 L114 G291 E293 H364	I110-H112 PolarHBondContact O-CD2 2.98Å; I110-H112 PolarHBondContact O-N 2.98Å; H112-L114 PolarHBondContact O-N 3.14Å; H112-G291 PolarHBondContact ND1-O 2.81Å; H112-E293 HydrophobicContact CB-CB 4.49Å; H112-E293 HydrophobicContact CB-CG 3.9Å; H112-E293 IonicContact CD2-OE1 2.74Å; H112-E293 IonicContact CG-OE1 2.63Å; H112-H364 PolarHBondContact O-CE1 2.92Å; H112-H364 PolarHBondContact O-NE2 3.34Å
113	D	81.6	Confident	74	Confident	61 Å²	61	59.3 Å²	59.3	33%	0.326	30%	0.3	S	S	.	.			trans	-65.3	133.4	175.1	-66.1	-23.3	0	0	0	109.5	P289 A292 E293	D113-P289 HydrophobicContact CB-CB 4.12Å; D113-P289 HydrophobicContact CB-CG 3.94Å; D113-P289 WeakPolarHBondContact OD2-CB 3.24Å; D113-P289 WeakPolarHBondContact OD2-CG 3.27Å; D113-A292 HydrophobicContact CB-CB 4.49Å; D113-A292 CarbonylContact O-C 3.6Å; D113-A292 WeakPolarHBondContact O-CA 3.39Å; D113-A292 VanDerWaalsContact O-CB 3.27Å; D113-A292 WeakPolarHBondContact O-CB 3.5Å; D113-E293 PolarHBondContact O-N 3.4Å
114	L	83.6	Confident	74.5	Confident	17 Å²	17	57.7 Å²	57.7	9%	0.089	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	140.7	-178.9	-72.5	179.4	0	0	0	113.1	H112 E293 F333 M358 H364	H112-L114 PolarHBondContact O-N 3.14Å; L114-E293 CarbonylContact C-O 3.59Å; L114-E293 VanDerWaalsContact CA-O 3.3Å; L114-E293 WeakPolarHBondContact CA-O 3.4Å; L114-E293 HydrophobicContact CD2-CB 3.97Å; L114-F333 HydrophobicContact CD1-CD2 4.04Å; L114-F333 HydrophobicContact CD1-CE2 4.02Å; L114-F333 HydrophobicContact CD2-CD2 4.01Å; L114-F333 HydrophobicContact CD2-CE2 4.11Å; L114-M358 HydrophobicContact CD1-CB 4.45Å; L114-M358 HydrophobicContact CD1-CE 3.53Å; L114-H364 VanDerWaalsContact CD1-CD2 3.42Å; L114-H364 WeakPolarHBondContact CD1-CD2 3.42Å
115	F	88.9	Confident	74.3	Confident	1 Å²	1	63.2 Å²	63.2	0%	0.004	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	117.3	160.7	173.3	-111.7	0	0	0	108.1	E117 R136 L138 F284 E293 A294 S295	F115-E117 HydrophobicContact CE1-CB 4.23Å; F115-R136 HydrophobicContact CE2-CB 4.33Å; F115-R136 HydrophobicContact CZ-CB 4.44Å; F115-L138 HydrophobicContact CB-CD1 4.46Å; F115-L138 HydrophobicContact CD2-CD1 4.25Å; F115-F284 AromaticContact CE2-CE1 3.97Å; F115-F284 HydrophobicContact CE2-CE1 3.97Å; F115-F284 AromaticContact CE2-CZ 3.9Å; F115-F284 HydrophobicContact CE2-CZ 3.9Å; F115-F284 HydrophobicContact CZ-CE1 4.16Å; F115-F284 HydrophobicContact CZ-CZ 4.44Å; F115-E293 PolarHBondContact N-O 2.86Å; F115-A294 CarbonylContact O-C 3.59Å; F115-A294 VanDerWaalsContact O-CA 3.27Å; F115-A294 WeakPolarHBondContact O-CA 3.35Å; F115-S295 PolarHBondContact O-N 3.18Å
116	T	89.8	Confident	74.5	Confident	1 Å²	1	59 Å²	59	1%	0.006	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	137	179.5	58.8	0	0	0	0	110.6	R136 W137 S295 M358	T116-R136 CarbonylContact O-C 3.57Å; T116-R136 WeakPolarHBondContact O-CA 3.27Å; T116-W137 PolarHBondContact N-O 3.28Å; T116-W137 PolarHBondContact O-N 3.18Å; T116-W137 WeakPolarHBondContact OG1-CB 3.31Å; T116-W137 PolarHBondContact OG1-O 2.87Å; T116-S295 VanDerWaalsContact CA-O 3.3Å; T116-S295 WeakPolarHBondContact CA-O 3.3Å; T116-M358 HydrophobicContact CG2-CB 3.64Å
117	E	91.3	Very high	74.5	Confident	1 Å²	1	55.4 Å²	55.4	1%	0.005	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	132	-177.4	-172.5	173.9	-180	0	0	108.3	F115 E133 H220 S295 V297 T325 E326	F115-E117 HydrophobicContact CE1-CB 4.23Å; E117-E133 HydrophobicContact CG-CG 3.92Å; E117-H220 IonicContact OE1-CE1 3.57Å; E117-H220 IonicContact OE1-ND1 3.8Å; E117-S295 PolarHBondContact N-O 3.21Å; E117-V297 PolarHBondContact O-N 3.32Å; E117-T325 WeakPolarHBondContact OE2-CA 3.44Å; E117-E326 PolarHBondContact OE1-N 3.06Å; E117-E326 PolarHBondContact OE2-N 2.85Å
118	L	91.7	Very high	74.5	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	119.1	177.6	176.6	68.6	0	0	0	109.4	T134 A135 W137 V297 V299	L118-T134 PolarHBondContact O-N 2.85Å; L118-T134 PolarHBondContact O-OG1 2.73Å; L118-A135 HydrophobicContact CB-CB 4.32Å; L118-A135 HydrophobicContact CD2-CB 4.23Å; L118-A135 PolarHBondContact N-O 2.96Å; L118-W137 HydrophobicContact CB-CH2 4.04Å; L118-W137 HydrophobicContact CB-CZ3 3.69Å; L118-W137 HydrophobicContact CD2-CH2 4.11Å; L118-V297 WeakPolarHBondContact CA-O 3.45Å; L118-V297 HydrophobicContact CD1-CB 3.86Å; L118-V297 HydrophobicContact CD1-CG1 3.51Å; L118-V299 HydrophobicContact CD1-CB 4.46Å; L118-V299 HydrophobicContact CD1-CG2 3.8Å
119	D	91	Very high	74.9	Confident	1 Å²	1	46.4 Å²	46.4	1%	0.005	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	138.5	175.2	-71.2	-26.4	0	0	0	111.1	W131 R132 E133 H218 V297 L298 V299	D119-W131 HydrophobicContact CB-CB 4.37Å; D119-W131 HydrophobicContact CB-CE3 4Å; D119-R132 CarbonylContact C-O 3.54Å; D119-R132 WeakPolarHBondContact CA-O 3.4Å; D119-E133 WeakPolarHBondContact OD1-CA 3.37Å; D119-H218 IonicContact OD2-CE1 3.76Å; D119-H218 IonicContact OD2-CG 2.84Å; D119-H218 IonicContact OD2-ND1 2.67Å; D119-H218 PolarHBondContact OD2-ND1 3.13Å; D119-V297 PolarHBondContact N-O 3.48Å; D119-L298 HydrophobicContact CB-CD2 3.69Å; D119-V299 PolarHBondContact O-N 2.79Å
120	E	89.6	Confident	75.6	Confident	57 Å²	57	46.6 Å²	46.6	27%	0.266	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	137.9	175.5	-68.2	-168.4	168.7	0	0	113.7	S122 W131 R132 T134 V299 H348	E120-S122 PolarHBondContact O-N 3.26Å; E120-W131 CarbonylContact O-C 3.53Å; E120-W131 WeakPolarHBondContact O-CA 3.35Å; E120-R132 PolarHBondContact N-O 3.26Å; E120-R132 PolarHBondContact O-N 2.91Å; E120-T134 HydrophobicContact CB-CG2 3.87Å; E120-T134 HydrophobicContact CG-CG2 3.65Å; E120-V299 CarbonylContact C-O 3.59Å; E120-V299 VanDerWaalsContact CA-O 3.22Å; E120-V299 WeakPolarHBondContact CA-O 3.3Å; E120-H348 VanDerWaalsContact OE1-CB 3.27Å; E120-H348 WeakPolarHBondContact OE1-CB 3.5Å; E120-H348 IonicContact OE1-CE1 2.71Å; E120-H348 IonicContact OE1-CG 3.78Å; E120-H348 IonicContact OE1-ND1 2.89Å; E120-H348 PolarHBondContact OE1-ND1 2.95Å
121	L	87.3	Confident	76.2	Confident	11 Å²	11	42.9 Å²	42.9	6%	0.058	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	110.5	175.6	-167.9	64.6	0	0	0	110.7	A128 W131 K216 V299 V302 L338	L121-A128 HydrophobicContact CD1-CB 4.24Å; L121-A128 HydrophobicContact CD2-CB 3.73Å; L121-A128 HydrophobicContact CG-CB 3.92Å; L121-W131 HydrophobicContact CB-CD2 4.39Å; L121-W131 HydrophobicContact CB-CE3 4.03Å; L121-W131 HydrophobicContact CB-CH2 4.08Å; L121-W131 HydrophobicContact CB-CZ2 4.44Å; L121-W131 HydrophobicContact CB-CZ3 3.87Å; L121-W131 HydrophobicContact CD1-CD2 3.96Å; L121-W131 HydrophobicContact CD1-CE3 4.45Å; L121-W131 HydrophobicContact CD1-CG 4.26Å; L121-W131 HydrophobicContact CD1-CZ2 4.21Å; L121-K216 HydrophobicContact CD1-CD 4.34Å; L121-V299 PolarHBondContact N-O 2.91Å; L121-V302 HydrophobicContact CD2-CG1 3.97Å; L121-L338 HydrophobicContact CD2-CD2 4.44Å
122	S	74.6	Confident	76.6	Confident	18 Å²	18	45 Å²	45	13%	0.126	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	138.6	-178	70.7	0	0	0	0	113.5	E120 T129 E130 R132	E120-S122 PolarHBondContact O-N 3.26Å; S122-T129 PolarHBondContact O-N 3.12Å; S122-T129 PolarHBondContact O-OG1 3.47Å; S122-E130 PolarHBondContact N-O 3.16Å; S122-E130 WeakPolarHBondContact OG-CG 3.31Å; S122-E130 PolarHBondContact OG-O 2.97Å; S122-R132 PolarHBondContact OG-NE 2.89Å
123	F	69.1	Low	76.9	Confident	63 Å²	63	42.2 Å²	42.2	28%	0.276	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	126.3	175.8	-74.6	-95.6	0	0	0	111.4	G127 A128 E301 H341	F123-G127 WeakPolarHBondContact CA-O 3.42Å; F123-G127 VanDerWaalsContact CD1-C 3.47Å; F123-A128 HydrophobicContact CD1-CB 4.31Å; F123-A128 HydrophobicContact CE1-CB 3.74Å; F123-A128 VanDerWaalsContact CE1-N 3.35Å; F123-A128 HydrophobicContact CE2-CB 4.39Å; F123-A128 HydrophobicContact CZ-CB 3.76Å; F123-E301 HydrophobicContact CE2-CB 4.06Å; F123-E301 WeakPolarHBondContact CE2-O 3.24Å; F123-E301 WeakPolarHBondContact CZ-O 3.29Å; F123-H341 AromaticContact CD1-CE1 3.92Å; F123-H341 AromaticContact CD2-CE1 3.81Å; F123-H341 AromaticContact CE1-CE1 3.63Å; F123-H341 AromaticContact CE1-NE2 3.39Å; F123-H341 WeakPolarHBondContact CE1-NE2 3.33Å; F123-H341 AromaticContact CE2-CE1 3.53Å; F123-H341 AromaticContact CE2-NE2 3.89Å; F123-H341 AromaticContact CZ-CE1 3.44Å; F123-H341 VanDerWaalsContact CZ-CE1 3.44Å; F123-H341 WeakPolarHBondContact CZ-CE1 3.21Å; F123-H341 AromaticContact CZ-NE2 3.31Å; F123-H341 VanDerWaalsContact CZ-NE2 3.31Å; F123-H341 WeakPolarHBondContact CZ-NE2 3.42Å
124	R	57.3	Low	77.2	Confident	157 Å²	157	40.8 Å²	40.8	59%	0.592	22%	0.218	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-125.1	125.3	166.7	-93.3	-173.9	171.7	-176.2	0.2	108.5	G126 G127 T129	R124-G126 PolarHBondContact O-N 3.34Å; R124-G127 PolarHBondContact N-O 2.78Å; R124-T129 HydrophobicContact CB-CG2 4.33Å
125	H	44.9	Very low	77.4	Confident	198 Å²	198	40 Å²	40	92%	0.917	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.2	47.9	173	-65.4	56.9	0	0	0	114	G127	H125-G127 PolarHBondContact O-N 2.97Å
126	G	52.9	Low	77.4	Confident	72 Å²	72	40.7 Å²	40.7	74%	0.742	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	76.5	17.9	171.7	0	0	0	0	0	115.8	R124	R124-G126 PolarHBondContact O-N 3.34Å
127	G	54.3	Low	77.4	Confident	26 Å²	26	40.7 Å²	40.7	27%	0.268	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	145.9	167.1	0	0	0	0	0	111.8	F123 R124 H125 T129	F123-G127 WeakPolarHBondContact CA-O 3.42Å; F123-G127 VanDerWaalsContact CD1-C 3.47Å; R124-G127 PolarHBondContact N-O 2.78Å; H125-G127 PolarHBondContact O-N 2.97Å; G127-T129 PolarHBondContact O-N 2.63Å
128	A	57.9	Low	76.7	Confident	16 Å²	16	42.7 Å²	42.7	13%	0.132	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.8	130.9	166.1	0	0	0	0	0	108.2	L121 F123 K216	L121-A128 HydrophobicContact CD1-CB 4.24Å; L121-A128 HydrophobicContact CD2-CB 3.73Å; L121-A128 HydrophobicContact CG-CB 3.92Å; F123-A128 HydrophobicContact CD1-CB 4.31Å; F123-A128 HydrophobicContact CE1-CB 3.74Å; F123-A128 VanDerWaalsContact CE1-N 3.35Å; F123-A128 HydrophobicContact CE2-CB 4.39Å; F123-A128 HydrophobicContact CZ-CB 3.76Å; A128-K216 HydrophobicContact CB-CD 4.45Å; A128-K216 PolarHBondContact O-NZ 2.88Å
129	T	66	Low	75.8	Confident	65 Å²	65	45.6 Å²	45.6	40%	0.399	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	-41.7	-172.7	49.2	0	0	0	0	114	S122 R124 G127	S122-T129 PolarHBondContact O-N 3.12Å; S122-T129 PolarHBondContact O-OG1 3.47Å; R124-T129 HydrophobicContact CB-CG2 4.33Å; G127-T129 PolarHBondContact O-N 2.63Å
130	E	83	Confident	75.3	Confident	46 Å²	46	46.2 Å²	46.2	22%	0.215	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.3	147.3	-174.2	59	-172	-174.7	0	0	111.1	S122 R132	S122-E130 PolarHBondContact N-O 3.16Å; S122-E130 WeakPolarHBondContact OG-CG 3.31Å; S122-E130 PolarHBondContact OG-O 2.97Å; E130-R132 HydrophobicContact CG-CG 4.16Å; E130-R132 IonicContact OE1-CZ 2.78Å; E130-R132 IonicContact OE1-NE 3.71Å; E130-R132 PolarHBondContact OE1-NE 3.37Å; E130-R132 IonicContact OE1-NH2 3.12Å; E130-R132 PolarHBondContact OE1-NH2 3.22Å
131	W	87.6	Confident	75.1	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	133.5	167.2	-69	102.1	0	0	0	108.8	D119 E120 L121 A213 K217 H218 H219 L298 V299 L336 L338	D119-W131 HydrophobicContact CB-CB 4.37Å; D119-W131 HydrophobicContact CB-CE3 4Å; E120-W131 CarbonylContact O-C 3.53Å; E120-W131 WeakPolarHBondContact O-CA 3.35Å; L121-W131 HydrophobicContact CB-CD2 4.39Å; L121-W131 HydrophobicContact CB-CE3 4.03Å; L121-W131 HydrophobicContact CB-CH2 4.08Å; L121-W131 HydrophobicContact CB-CZ2 4.44Å; L121-W131 HydrophobicContact CB-CZ3 3.87Å; L121-W131 HydrophobicContact CD1-CD2 3.96Å; L121-W131 HydrophobicContact CD1-CE3 4.45Å; L121-W131 HydrophobicContact CD1-CG 4.26Å; L121-W131 HydrophobicContact CD1-CZ2 4.21Å; W131-A213 PolarHBondContact NE1-O 3.06Å; W131-K217 PolarHBondContact N-O 2.99Å; W131-H218 HydrophobicContact CB-CB 4.33Å; W131-H218 AromaticContact CD1-CD2 3.94Å; W131-H218 AromaticContact CD1-CE1 3.7Å; W131-H218 AromaticContact CD1-NE2 3.56Å; W131-H218 AromaticContact CG-CE1 3.67Å; W131-H218 AromaticContact CG-ND1 3.9Å; W131-H219 WeakPolarHBondContact O-CB 3.34Å; W131-H219 PolarHBondContact O-N 3.39Å; W131-L298 HydrophobicContact CE3-CB 4.42Å; W131-L298 HydrophobicContact CE3-CD2 4.41Å; W131-L298 HydrophobicContact CH2-CB 3.77Å; W131-L298 HydrophobicContact CZ2-CB 4.4Å; W131-L298 HydrophobicContact CZ3-CB 3.78Å; W131-V299 VanDerWaalsContact CZ3-O 3.3Å; W131-V299 WeakPolarHBondContact CZ3-O 3.18Å; W131-L336 HydrophobicContact CH2-CD1 4.28Å; W131-L338 HydrophobicContact CH2-CD2 3.92Å; W131-L338 HydrophobicContact CZ2-CD2 4.35Å
132	R	86.5	Confident	75	Confident	66 Å²	66	44 Å²	44	25%	0.249	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	131	179.9	-69.2	-170.7	175.7	167.6	7.5	110.5	D119 E120 S122 E130 T134	D119-R132 CarbonylContact C-O 3.54Å; D119-R132 WeakPolarHBondContact CA-O 3.4Å; E120-R132 PolarHBondContact N-O 3.26Å; E120-R132 PolarHBondContact O-N 2.91Å; S122-R132 PolarHBondContact OG-NE 2.89Å; E130-R132 HydrophobicContact CG-CG 4.16Å; E130-R132 IonicContact OE1-CZ 2.78Å; E130-R132 IonicContact OE1-NE 3.71Å; E130-R132 PolarHBondContact OE1-NE 3.37Å; E130-R132 IonicContact OE1-NH2 3.12Å; E130-R132 PolarHBondContact OE1-NH2 3.22Å; R132-T134 PolarHBondContact O-N 3.38Å
133	E	86.6	Confident	75.6	Confident	9 Å²	9	44.6 Å²	44.6	4%	0.042	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.3	126.3	173.6	-159.6	-171.1	171.1	0	0	110	E117 D119 W151	E117-E133 HydrophobicContact CG-CG 3.92Å; D119-E133 WeakPolarHBondContact OD1-CA 3.37Å; E133-W151 VanDerWaalsContact CD-CH2 3.42Å; E133-W151 HydrophobicContact CG-CH2 3.81Å; E133-W151 HydrophobicContact CG-CZ2 4.2Å; E133-W151 WeakPolarHBondContact OE1-CH2 3.49Å; E133-W151 WeakPolarHBondContact OE1-CZ2 3.35Å; E133-W151 WeakPolarHBondContact OE2-CZ2 3.48Å
134	T	86.7	Confident	76.2	Confident	31 Å²	31	43.2 Å²	43.2	19%	0.19	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	-34.8	-179.8	56.5	0	0	0	0	113.2	L118 E120 R132 V144	L118-T134 PolarHBondContact O-N 2.85Å; L118-T134 PolarHBondContact O-OG1 2.73Å; E120-T134 HydrophobicContact CB-CG2 3.87Å; E120-T134 HydrophobicContact CG-CG2 3.65Å; R132-T134 PolarHBondContact O-N 3.38Å; T134-V144 WeakPolarHBondContact O-CG2 3.5Å; T134-V144 PolarHBondContact O-N 2.99Å
135	A	88.4	Confident	77.1	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	156.5	-178.3	0	0	0	0	0	111.8	L118 W137 E142 D143	L118-A135 HydrophobicContact CB-CB 4.32Å; L118-A135 HydrophobicContact CD2-CB 4.23Å; L118-A135 PolarHBondContact N-O 2.96Å; A135-W137 HydrophobicContact CB-CH2 3.34Å; A135-W137 HydrophobicContact CB-CZ2 4.09Å; A135-W137 HydrophobicContact CB-CZ3 3.75Å; A135-E142 WeakPolarHBondContact CA-O 3.33Å; A135-D143 VanDerWaalsContact CB-OD1 3.22Å; A135-D143 WeakPolarHBondContact CB-OD1 3.44Å
136	R	89.4	Confident	77.7	Confident	16 Å²	16	37.9 Å²	37.9	6%	0.06	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	154.9	176.7	68.2	-177.2	-171.4	-156.7	-11.5	112.7	F115 T116 E142 W151 E326	F115-R136 HydrophobicContact CE2-CB 4.33Å; F115-R136 HydrophobicContact CZ-CB 4.44Å; T116-R136 CarbonylContact O-C 3.57Å; T116-R136 WeakPolarHBondContact O-CA 3.27Å; R136-E142 HydrophobicContact CG-CB 4.11Å; R136-E142 IonicContact CZ-OE2 2.72Å; R136-E142 VanDerWaalsContact CZ-OE2 3.27Å; R136-E142 PolarHBondContact N-O 3.27Å; R136-E142 IonicContact NE-OE2 3.15Å; R136-E142 PolarHBondContact NE-OE2 3.08Å; R136-E142 IonicContact NH2-OE2 3.9Å; R136-E142 PolarHBondContact NH2-OE2 3.46Å; R136-E142 PolarHBondContact O-N 3.35Å; R136-W151 HydrophobicContact CG-CE3 4.44Å; R136-W151 HydrophobicContact CG-CH2 4.18Å; R136-W151 HydrophobicContact CG-CZ3 4Å; R136-E326 IonicContact NH1-OE2 3.2Å
137	W	88.5	Confident	77.8	Confident	2 Å²	2	37.8 Å²	37.8	1%	0.008	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	138.8	174.4	-46.4	-120.2	0	0	0	112.4	T116 L118 A135 E141 R352 A355 T356 T359	T116-W137 PolarHBondContact N-O 3.28Å; T116-W137 PolarHBondContact O-N 3.18Å; T116-W137 WeakPolarHBondContact OG1-CB 3.31Å; T116-W137 PolarHBondContact OG1-O 2.87Å; L118-W137 HydrophobicContact CB-CH2 4.04Å; L118-W137 HydrophobicContact CB-CZ3 3.69Å; L118-W137 HydrophobicContact CD2-CH2 4.11Å; A135-W137 HydrophobicContact CB-CH2 3.34Å; A135-W137 HydrophobicContact CB-CZ2 4.09Å; A135-W137 HydrophobicContact CB-CZ3 3.75Å; W137-E141 HydrophobicContact CZ2-CG 3.72Å; W137-E141 PolarHBondContact NE1-OE2 3.28Å; W137-R352 HydrophobicContact CH2-CG 3.84Å; W137-R352 HydrophobicContact CZ2-CG 3.44Å; W137-R352 VanDerWaalsContact CZ2-CG 3.44Å; W137-A355 HydrophobicContact CD2-CB 3.96Å; W137-A355 HydrophobicContact CE3-CB 3.49Å; W137-A355 VanDerWaalsContact CE3-CB 3.49Å; W137-A355 HydrophobicContact CH2-CB 3.69Å; W137-A355 HydrophobicContact CZ2-CB 4.09Å; W137-A355 HydrophobicContact CZ3-CB 3.36Å; W137-T356 PolarHBondContact NE1-OG1 3.46Å; W137-T359 HydrophobicContact CB-CG2 3.45Å; W137-T359 VanDerWaalsContact CB-CG2 3.45Å; W137-T359 HydrophobicContact CG-CG2 3.94Å
138	L	77.3	Confident	77.9	Confident	43 Å²	43	37.3 Å²	37.3	23%	0.225	21%	0.212	C	C	.	.	S	Bend	trans	-116.2	-33.7	161.4	-165.2	72	0	0	0	111	F115 I288	F115-L138 HydrophobicContact CB-CD1 4.46Å; F115-L138 HydrophobicContact CD2-CD1 4.25Å; L138-I288 HydrophobicContact CD1-CG1 4.43Å
139	K	73.3	Confident	77.8	Confident	61 Å²	61	43.4 Å²	43.4	27%	0.265	24%	0.238	S	C	.	.	S	Bend	trans	-158.9	-36.8	174.7	-72	-169.6	-178.1	174.1	0	111.4	V50	V50-K139 HydrophobicContact CG1-CB 4.36Å
140	F	80.1	Confident	78.1	Confident	14 Å²	14	47.7 Å²	47.7	6%	0.061	25%	0.246	C	C	.	.	S	Bend	trans	-117.7	155.5	175.1	-61.8	-68.9	0	0	0	108	V50 P154 Y155 V156 P403	V50-F140 HydrophobicContact CG1-CE1 4.21Å; V50-F140 HydrophobicContact CG1-CZ 4.19Å; V50-F140 HydrophobicContact CG2-CD1 4.36Å; V50-F140 HydrophobicContact CG2-CE1 3.76Å; V50-F140 HydrophobicContact CG2-CZ 4.45Å; F140-P154 HydrophobicContact CB-CB 3.81Å; F140-Y155 WeakPolarHBondContact CB-O 3.19Å; F140-V156 HydrophobicContact CD1-CG2 4.34Å; F140-V156 HydrophobicContact CE1-CG2 4.23Å; F140-P403 HydrophobicContact CD1-CB 4.18Å; F140-P403 HydrophobicContact CD1-CG 3.86Å; F140-P403 HydrophobicContact CD2-CG 4.18Å; F140-P403 HydrophobicContact CE1-CB 3.59Å; F140-P403 HydrophobicContact CE1-CG 3.81Å; F140-P403 HydrophobicContact CE2-CB 4.03Å; F140-P403 HydrophobicContact CE2-CG 4.16Å; F140-P403 HydrophobicContact CG-CG 4.06Å; F140-P403 HydrophobicContact CZ-CB 3.54Å; F140-P403 HydrophobicContact CZ-CG 4Å
141	E	85.3	Confident	77.9	Confident	4 Å²	4	47.5 Å²	47.5	2%	0.019	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	133	178.7	-173	170.4	127.7	0	0	109.9	W137 P154 Y155 A157 R352	W137-E141 HydrophobicContact CZ2-CG 3.72Å; W137-E141 PolarHBondContact NE1-OE2 3.28Å; E141-P154 VanDerWaalsContact O-CA 3.29Å; E141-P154 WeakPolarHBondContact O-CA 3.34Å; E141-Y155 HydrophobicContact CB-CD2 4.41Å; E141-Y155 HydrophobicContact CB-CE2 3.99Å; E141-Y155 HydrophobicContact CG-CE2 4Å; E141-Y155 PolarHBondContact N-O 2.81Å; E141-Y155 PolarHBondContact O-N 3.11Å; E141-Y155 WeakPolarHBondContact OE1-CE2 3.22Å; E141-Y155 PolarHBondContact OE1-OH 2.84Å; E141-A157 HydrophobicContact CB-CB 4.33Å; E141-A157 WeakPolarHBondContact OE2-CA 3.48Å; E141-A157 WeakPolarHBondContact OE2-CB 3.32Å; E141-R352 WeakPolarHBondContact OE1-CD 3.28Å; E141-R352 IonicContact OE1-NE 3.88Å
142	E	85.8	Confident	77.5	Confident	18 Å²	18	47.8 Å²	47.8	8%	0.084	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	121.7	168.5	-67.9	-176.7	153.3	0	0	108.7	A135 R136 W151 P154 P863	A135-E142 WeakPolarHBondContact CA-O 3.33Å; R136-E142 HydrophobicContact CG-CB 4.11Å; R136-E142 IonicContact CZ-OE2 2.72Å; R136-E142 VanDerWaalsContact CZ-OE2 3.27Å; R136-E142 PolarHBondContact N-O 3.27Å; R136-E142 IonicContact NE-OE2 3.15Å; R136-E142 PolarHBondContact NE-OE2 3.08Å; R136-E142 IonicContact NH2-OE2 3.9Å; R136-E142 PolarHBondContact NH2-OE2 3.46Å; R136-E142 PolarHBondContact O-N 3.35Å; E142-W151 HydrophobicContact CB-CE3 4.28Å; E142-W151 WeakPolarHBondContact O-CZ3 3.47Å; E142-P154 HydrophobicContact CG-CB 3.95Å; E142-P863 WeakPolarHBondContact OE1-CB 3.41Å
143	D	85.9	Confident	77	Confident	30 Å²	30	50.9 Å²	50.9	16%	0.16	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	155.8	-179.2	-78.2	4.4	0	0	0	111.2	A135 W151 S152 Y155	A135-D143 VanDerWaalsContact CB-OD1 3.22Å; A135-D143 WeakPolarHBondContact CB-OD1 3.44Å; D143-W151 CarbonylContact O-C 3.53Å; D143-S152 PolarHBondContact N-OG 2.89Å; D143-S152 WeakPolarHBondContact O-CB 3.28Å; D143-S152 PolarHBondContact O-N 2.8Å; D143-S152 PolarHBondContact O-OG 3.02Å; D143-Y155 PolarHBondContact OD1-OH 3.36Å; D143-Y155 PolarHBondContact OD2-OH 3.38Å
144	V	81.9	Confident	76.6	Confident	33 Å²	33	51.3 Å²	51.3	20%	0.2	27%	0.265	C	S	.	.	B	Isolated β-bridge	trans	-77.3	122.8	169.4	-179	0	0	0	0	109.6	T134 W151	T134-V144 WeakPolarHBondContact O-CG2 3.5Å; T134-V144 PolarHBondContact O-N 2.99Å; V144-W151 HydrophobicContact CG2-CD2 4.38Å; V144-W151 HydrophobicContact CG2-CE3 3.87Å; V144-W151 HydrophobicContact CG2-CH2 3.57Å; V144-W151 HydrophobicContact CG2-CZ2 4.11Å; V144-W151 HydrophobicContact CG2-CZ3 3.44Å; V144-W151 VanDerWaalsContact CG2-CZ3 3.44Å
145	E	76.3	Confident	76.1	Confident	63 Å²	63	50.6 Å²	50.6	29%	0.294	26%	0.259	S	S	.	.			trans	-69.2	148	179.9	-66.3	179.5	166.4	0	0	112.3	G147 G148 R150	E145-G147 PolarHBondContact O-N 3.29Å; E145-G148 PolarHBondContact O-N 2.97Å; E145-R150 PolarHBondContact N-O 3.04Å; E145-R150 WeakPolarHBondContact OE2-CD 3.4Å; E145-R150 IonicContact OE2-NE 3.17Å
146	D	57.3	Low	75.7	Confident	181 Å²	181	51.3 Å²	51.3	97%	0.968	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.6	103.5	177.3	-71.7	-37.9	0	0	0	111.3
147	G	55.7	Low	75.3	Confident	69 Å²	69	51 Å²	51	71%	0.711	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	134.6	-18	-168.3	0	0	0	0	0	112.9	E145 E149	E145-G147 PolarHBondContact O-N 3.29Å; G147-E149 PolarHBondContact O-N 2.95Å
148	G	56.2	Low	75	Confident	16 Å²	16	51.7 Å²	51.7	17%	0.165	27%	0.268	C	S	.	.	S	Bend	trans	65.2	32.5	164.3	0	0	0	0	0	114.6	E145 Q221 R224	E145-G148 PolarHBondContact O-N 2.97Å; G148-Q221 PolarHBondContact O-NE2 3.32Å; G148-Q221 PolarHBondContact O-OE1 3.09Å; G148-R224 PolarHBondContact O-NH1 2.79Å
149	E	57.2	Low	75.3	Confident	144 Å²	144	49.7 Å²	49.7	67%	0.673	26%	0.258	S	S	*	.	S	Bend	trans	-123.7	-14.2	176.3	-68.7	-160	161.7	0	0	114	G147	G147-E149 PolarHBondContact O-N 2.95Å
150	R	72.1	Confident	75.8	Confident	155 Å²	155	47.4 Å²	47.4	59%	0.585	25%	0.249	S	C	*	.			trans	-142.1	136.9	-168.9	-179.9	172	179.1	-169.2	1.4	112.6	E145	E145-R150 PolarHBondContact N-O 3.04Å; E145-R150 WeakPolarHBondContact OE2-CD 3.4Å; E145-R150 IonicContact OE2-NE 3.17Å
151	W	78.7	Confident	75.8	Confident	42 Å²	42	48.9 Å²	48.9	16%	0.159	26%	0.258	C	S	.	.	B	Isolated β-bridge	trans	-74.9	139.8	166.9	-69.4	106.7	0	0	0	111.2	E133 R136 E142 D143 V144 Q221	E133-W151 VanDerWaalsContact CD-CH2 3.42Å; E133-W151 HydrophobicContact CG-CH2 3.81Å; E133-W151 HydrophobicContact CG-CZ2 4.2Å; E133-W151 WeakPolarHBondContact OE1-CH2 3.49Å; E133-W151 WeakPolarHBondContact OE1-CZ2 3.35Å; E133-W151 WeakPolarHBondContact OE2-CZ2 3.48Å; R136-W151 HydrophobicContact CG-CE3 4.44Å; R136-W151 HydrophobicContact CG-CH2 4.18Å; R136-W151 HydrophobicContact CG-CZ3 4Å; E142-W151 HydrophobicContact CB-CE3 4.28Å; E142-W151 WeakPolarHBondContact O-CZ3 3.47Å; D143-W151 CarbonylContact O-C 3.53Å; V144-W151 HydrophobicContact CG2-CD2 4.38Å; V144-W151 HydrophobicContact CG2-CE3 3.87Å; V144-W151 HydrophobicContact CG2-CH2 3.57Å; V144-W151 HydrophobicContact CG2-CZ2 4.11Å; V144-W151 HydrophobicContact CG2-CZ3 3.44Å; V144-W151 VanDerWaalsContact CG2-CZ3 3.44Å; W151-Q221 HydrophobicContact CZ2-CB 4.33Å
152	S	78.3	Confident	75.8	Confident	6 Å²	6	53.9 Å²	53.9	4%	0.042	28%	0.281	C	S	.	.	P	Polyproline II helix	trans	-62.6	167.9	173.4	75.6	0	0	0	0	111.4	D143	D143-S152 PolarHBondContact N-OG 2.89Å; D143-S152 WeakPolarHBondContact O-CB 3.28Å; D143-S152 PolarHBondContact O-N 2.8Å; D143-S152 PolarHBondContact O-OG 3.02Å
153	K	75.4	Confident	75.9	Confident	131 Å²	131	53.1 Å²	53.1	57%	0.57	28%	0.277	S	S	*	.	P	Polyproline II helix	trans	-66.6	147.9	160.3	-69.2	179.3	-172.4	166.6	0	108.7	Y155	K153-Y155 VanDerWaalsContact O-CD1 3.24Å; K153-Y155 WeakPolarHBondContact O-CD1 3.4Å
154	P	78.6	Confident	75.9	Confident	18 Å²	18	51.7 Å²	51.7	12%	0.117	27%	0.27	C	S	.	.	P	Polyproline II helix	trans	-65.8	134.5	173.6	28.5	-38.8	0	0	0	111.3	F140 E141 E142 P863	F140-P154 HydrophobicContact CB-CB 3.81Å; E141-P154 VanDerWaalsContact O-CA 3.29Å; E141-P154 WeakPolarHBondContact O-CA 3.34Å; E142-P154 HydrophobicContact CG-CB 3.95Å; P154-P863 HydrophobicContact CB-CB 4.21Å; P154-P863 WeakPolarHBondContact CB-O 2.94Å; P154-P863 HydrophobicContact CG-CB 3.59Å; P154-P863 WeakPolarHBondContact CG-O 3.42Å
155	Y	76.9	Confident	76.2	Confident	17 Å²	17	55.5 Å²	55.5	7%	0.067	28%	0.284	C	S	.	.	B	Isolated β-bridge	trans	-139.8	169	178.3	58.6	-90.9	0	0	0	112.1	F140 E141 D143 K153 A157 R400 I401	F140-Y155 WeakPolarHBondContact CB-O 3.19Å; E141-Y155 HydrophobicContact CB-CD2 4.41Å; E141-Y155 HydrophobicContact CB-CE2 3.99Å; E141-Y155 HydrophobicContact CG-CE2 4Å; E141-Y155 PolarHBondContact N-O 2.81Å; E141-Y155 PolarHBondContact O-N 3.11Å; E141-Y155 WeakPolarHBondContact OE1-CE2 3.22Å; E141-Y155 PolarHBondContact OE1-OH 2.84Å; D143-Y155 PolarHBondContact OD1-OH 3.36Å; D143-Y155 PolarHBondContact OD2-OH 3.38Å; K153-Y155 VanDerWaalsContact O-CD1 3.24Å; K153-Y155 WeakPolarHBondContact O-CD1 3.4Å; Y155-A157 PolarHBondContact O-N 3.02Å; Y155-R400 HydrophobicContact CD1-CB 4.17Å; Y155-R400 HydrophobicContact CD1-CG 3.81Å; Y155-R400 HydrophobicContact CD2-CB 4.42Å; Y155-R400 HydrophobicContact CD2-CG 4.23Å; Y155-R400 HydrophobicContact CE1-CG 4.08Å; Y155-R400 HydrophobicContact CE2-CG 4.49Å; Y155-R400 HydrophobicContact CG-CB 3.93Å; Y155-R400 HydrophobicContact CG-CG 3.92Å; Y155-I401 WeakPolarHBondContact CB-O 3.01Å
156	V	80.8	Confident	76.8	Confident	15 Å²	15	54.5 Å²	54.5	9%	0.091	28%	0.279	C	S	.	.			trans	-75.1	123.1	175.9	-177.7	0	0	0	0	109.3	F140 T158 I401	F140-V156 HydrophobicContact CD1-CG2 4.34Å; F140-V156 HydrophobicContact CE1-CG2 4.23Å; V156-T158 PolarHBondContact O-N 3.38Å; V156-I401 HydrophobicContact CB-CB 4.21Å; V156-I401 HydrophobicContact CB-CG2 4.29Å; V156-I401 HydrophobicContact CG2-CG2 4.17Å; V156-I401 PolarHBondContact N-O 3.17Å
157	A	80.4	Confident	78.4	Confident	10 Å²	10	45.9 Å²	45.9	8%	0.083	23%	0.233	C	C	.	.			trans	-59.1	126.6	177.2	0	0	0	0	0	111.3	E141 Y155 T356	E141-A157 HydrophobicContact CB-CB 4.33Å; E141-A157 WeakPolarHBondContact OE2-CA 3.48Å; E141-A157 WeakPolarHBondContact OE2-CB 3.32Å; Y155-A157 PolarHBondContact O-N 3.02Å; A157-T356 HydrophobicContact CB-CG2 3.73Å
158	T	82.3	Confident	80	Confident	16 Å²	16	46.9 Å²	46.9	10%	0.098	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	114.9	169.7	51	0	0	0	0	108.4	V156 L390 I401	V156-T158 PolarHBondContact O-N 3.38Å; T158-L390 HydrophobicContact CG2-CD1 3.96Å; T158-I401 HydrophobicContact CG2-CD1 3.93Å
159	L	83.3	Confident	81.6	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	148	-177.4	-61	178.2	0	0	0	110.6	Y45 V46 V48 L164 T356 F383	Y45-L159 CarbonylContact C-O 3.58Å; Y45-L159 WeakPolarHBondContact CA-O 3.35Å; V46-L159 PolarHBondContact N-O 2.97Å; V46-L159 PolarHBondContact O-N 3.42Å; V48-L159 HydrophobicContact CG2-CD1 4.21Å; V48-L159 HydrophobicContact CG2-CG 4.48Å; L159-L164 HydrophobicContact CB-CD1 4.37Å; L159-L164 HydrophobicContact CD1-CD1 4.25Å; L159-L164 HydrophobicContact CD1-CD2 4.19Å; L159-L164 HydrophobicContact CD1-CG 4.38Å; L159-T356 HydrophobicContact CD1-CG2 3.82Å; L159-T356 HydrophobicContact CD2-CG2 4.44Å; L159-T356 HydrophobicContact CG-CG2 4.27Å; L159-F383 HydrophobicContact CD1-CE1 4.5Å; L159-F383 HydrophobicContact CD1-CZ 4.47Å
160	S	82.9	Confident	83.1	Confident	13 Å²	13	42.7 Å²	42.7	9%	0.091	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	140	166	87.2	0	0	0	0	109.7	H162 S163	S160-H162 PolarHBondContact O-N 2.79Å; S160-S163 PolarHBondContact O-N 2.91Å; S160-S163 PolarHBondContact O-OG 2.98Å; S160-S163 WeakPolarHBondContact OG-CB 3.3Å; S160-S163 PolarHBondContact OG-N 2.86Å; S160-S163 PolarHBondContact OG-OG 2.94Å
161	L	82	Confident	84	Confident	45 Å²	45	35.4 Å²	35.4	24%	0.236	17%	0.172	C	C	.	.	H	α-helix	trans	-66.3	-31	175.5	-162.4	151.2	0	0	0	110.9	V44 V46 L164 F165	V44-L161 HydrophobicContact CB-CB 4.23Å; V44-L161 HydrophobicContact CB-CD1 4.41Å; V44-L161 HydrophobicContact CG1-CB 4.47Å; V44-L161 HydrophobicContact CG1-CD1 3.98Å; V44-L161 VanDerWaalsContact O-CB 3.26Å; V44-L161 WeakPolarHBondContact O-CB 3.3Å; V44-L161 PolarHBondContact O-N 2.85Å; V46-L161 HydrophobicContact CG2-CB 3.74Å; V46-L161 HydrophobicContact CG2-CD1 3.79Å; V46-L161 HydrophobicContact CG2-CG 3.98Å; L161-L164 PolarHBondContact O-N 2.79Å; L161-F165 HydrophobicContact CD2-CD2 3.42Å; L161-F165 VanDerWaalsContact CD2-CD2 3.42Å; L161-F165 HydrophobicContact CD2-CE2 3.04Å; L161-F165 HydrophobicContact CD2-CZ 3.86Å; L161-F165 HydrophobicContact CG-CE2 4.38Å; L161-F165 PolarHBondContact O-N 2.95Å
162	H	84.6	Confident	84.5	Confident	110 Å²	110	37 Å²	37	51%	0.509	18%	0.184	S	C	.	.	H	α-helix	trans	-62	-47.3	177.3	-171.6	62	0	0	0	112.1	S160 L164 F165 E166 Q346	S160-H162 PolarHBondContact O-N 2.79Å; H162-L164 VanDerWaalsContact C-N 3.28Å; H162-L164 PolarHBondContact O-N 2.87Å; H162-F165 PolarHBondContact O-N 2.59Å; H162-E166 IonicContact CD2-OE2 2.89Å; H162-E166 IonicContact CE1-OE1 3.04Å; H162-E166 IonicContact NE2-OE1 3.14Å; H162-E166 PolarHBondContact NE2-OE1 2.91Å; H162-E166 IonicContact NE2-OE2 2.94Å; H162-E166 WeakPolarHBondContact O-CG 3.27Å; H162-E166 PolarHBondContact O-N 3.33Å; H162-Q346 PolarHBondContact NE2-NE2 3.05Å
163	S	86.6	Confident	84.9	Confident	1 Å²	1	41.6 Å²	41.6	1%	0.007	21%	0.208	C	C	.	.	H	α-helix	trans	-63.8	-31.8	179.1	60.4	0	0	0	0	112.9	S160 E166 L167 S353	S160-S163 PolarHBondContact O-N 2.91Å; S160-S163 PolarHBondContact O-OG 2.98Å; S160-S163 WeakPolarHBondContact OG-CB 3.3Å; S160-S163 PolarHBondContact OG-N 2.86Å; S160-S163 PolarHBondContact OG-OG 2.94Å; S163-E166 PolarHBondContact O-N 2.91Å; S163-L167 VanDerWaalsContact O-CB 3.3Å; S163-L167 WeakPolarHBondContact O-CB 3.37Å; S163-L167 PolarHBondContact O-N 3.49Å; S163-S353 WeakPolarHBondContact CB-OG 3.46Å; S163-S353 PolarHBondContact OG-OG 3.14Å
164	L	86.4	Confident	85.4	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-68.5	-40.9	174	-75.8	166.4	0	0	0	112.6	V46 L159 L161 H162 L167 R168 L357 F383 L384	V46-L164 HydrophobicContact CG1-CD1 4.19Å; L159-L164 HydrophobicContact CB-CD1 4.37Å; L159-L164 HydrophobicContact CD1-CD1 4.25Å; L159-L164 HydrophobicContact CD1-CD2 4.19Å; L159-L164 HydrophobicContact CD1-CG 4.38Å; L161-L164 PolarHBondContact O-N 2.79Å; H162-L164 VanDerWaalsContact C-N 3.28Å; H162-L164 PolarHBondContact O-N 2.87Å; L164-L167 PolarHBondContact O-N 3.49Å; L164-R168 WeakPolarHBondContact O-CB 3.31Å; L164-R168 PolarHBondContact O-N 3.11Å; L164-L357 HydrophobicContact CD2-CD1 4.06Å; L164-L357 HydrophobicContact CD2-CG 4.32Å; L164-F383 HydrophobicContact CD1-CE1 4.02Å; L164-F383 HydrophobicContact CD2-CD1 4.38Å; L164-F383 HydrophobicContact CD2-CE1 4.05Å; L164-L384 HydrophobicContact CB-CD2 3.94Å; L164-L384 HydrophobicContact CD1-CD2 3.79Å; L164-L384 HydrophobicContact CG-CD2 4.42Å
165	F	87.9	Confident	85.9	Confident	113 Å²	113	35.1 Å²	35.1	50%	0.496	18%	0.179	S	C	.	.	H	α-helix	trans	-67.8	-36.9	174.4	-78.6	-45.4	0	0	0	112.5	L161 H162 R168 S169 L384	L161-F165 HydrophobicContact CD2-CD2 3.42Å; L161-F165 VanDerWaalsContact CD2-CD2 3.42Å; L161-F165 HydrophobicContact CD2-CE2 3.04Å; L161-F165 HydrophobicContact CD2-CZ 3.86Å; L161-F165 HydrophobicContact CG-CE2 4.38Å; L161-F165 PolarHBondContact O-N 2.95Å; H162-F165 PolarHBondContact O-N 2.59Å; F165-R168 WeakPolarHBondContact O-CB 3.46Å; F165-R168 PolarHBondContact O-N 2.98Å; F165-S169 PolarHBondContact O-N 3.33Å; F165-L384 HydrophobicContact CD1-CD1 4.33Å; F165-L384 HydrophobicContact CE1-CD1 4.06Å
166	E	89.3	Confident	86.6	Confident	43 Å²	43	35.7 Å²	35.7	20%	0.201	18%	0.184	C	C	.	.	H	α-helix	trans	-65.8	-42.1	173.6	-70	-166.8	140.5	0	0	111.5	H162 S163 R168 S169 C170 Q346 I350	H162-E166 IonicContact CD2-OE2 2.89Å; H162-E166 IonicContact CE1-OE1 3.04Å; H162-E166 IonicContact NE2-OE1 3.14Å; H162-E166 PolarHBondContact NE2-OE1 2.91Å; H162-E166 IonicContact NE2-OE2 2.94Å; H162-E166 WeakPolarHBondContact O-CG 3.27Å; H162-E166 PolarHBondContact O-N 3.33Å; S163-E166 PolarHBondContact O-N 2.91Å; E166-R168 VanDerWaalsContact C-N 3.32Å; E166-R168 PolarHBondContact O-N 3.05Å; E166-S169 CarbonylContact O-C 3.54Å; E166-S169 WeakPolarHBondContact O-CB 3.33Å; E166-S169 PolarHBondContact O-N 3.07Å; E166-S169 VanDerWaalsContact O-N 3.15Å; E166-C170 WeakPolarHBondContact O-CB 3.27Å; E166-C170 PolarHBondContact O-N 3.34Å; E166-C170 PolarHBondContact O-SG 2.95Å; E166-Q346 PolarHBondContact OE1-NE2 3.37Å; E166-Q346 WeakPolarHBondContact OE2-CG 3.42Å; E166-Q346 PolarHBondContact OE2-NE2 3.26Å; E166-I350 HydrophobicContact CB-CD1 3.9Å; E166-I350 HydrophobicContact CB-CG1 4.05Å
167	L	90.4	Very high	87.1	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-59.2	-43.2	173.5	178.8	61.4	0	0	0	111.8	S163 L164 S169 C170 I171 F335 I350 M354 L357	S163-L167 VanDerWaalsContact O-CB 3.3Å; S163-L167 WeakPolarHBondContact O-CB 3.37Å; S163-L167 PolarHBondContact O-N 3.49Å; L164-L167 PolarHBondContact O-N 3.49Å; L167-S169 VanDerWaalsContact C-N 3.34Å; L167-S169 PolarHBondContact O-N 2.98Å; L167-C170 WeakPolarHBondContact O-CB 3.08Å; L167-C170 PolarHBondContact O-N 3.41Å; L167-C170 VanDerWaalsContact O-N 3.14Å; L167-I171 HydrophobicContact CD1-CD1 4.03Å; L167-I171 HydrophobicContact CD1-CG1 4.43Å; L167-I171 HydrophobicContact CG-CD1 4.19Å; L167-I171 PolarHBondContact O-N 3.43Å; L167-F335 HydrophobicContact CD1-CE2 3.94Å; L167-F335 HydrophobicContact CD1-CZ 3.73Å; L167-I350 HydrophobicContact CB-CG2 4.19Å; L167-I350 HydrophobicContact CD1-CG2 3.94Å; L167-M354 HydrophobicContact CD1-CB 4.03Å; L167-M354 HydrophobicContact CD1-CG 4.47Å; L167-M354 HydrophobicContact CD1-SD 4.23Å; L167-M354 HydrophobicContact CD2-CB 3.93Å; L167-M354 HydrophobicContact CD2-SD 4.15Å; L167-L357 HydrophobicContact CD2-CD1 3.43Å; L167-L357 VanDerWaalsContact CD2-CD1 3.43Å
168	R	91	Very high	87.5	Confident	89 Å²	89	38.7 Å²	38.7	34%	0.336	20%	0.197	S	C	.	.	H	α-helix	trans	-58.6	-45.3	174.3	-176.1	-176.8	175.6	-80.3	-1.4	111.4	L164 F165 E166 C170 I171 L172 L377 I380 D381	L164-R168 WeakPolarHBondContact O-CB 3.31Å; L164-R168 PolarHBondContact O-N 3.11Å; F165-R168 WeakPolarHBondContact O-CB 3.46Å; F165-R168 PolarHBondContact O-N 2.98Å; E166-R168 VanDerWaalsContact C-N 3.32Å; E166-R168 PolarHBondContact O-N 3.05Å; R168-C170 VanDerWaalsContact C-N 3.32Å; R168-C170 PolarHBondContact O-N 3.48Å; R168-I171 PolarHBondContact O-N 3.17Å; R168-L172 WeakPolarHBondContact O-CB 3.27Å; R168-L172 PolarHBondContact O-N 3.42Å; R168-L172 VanDerWaalsContact O-N 3.09Å; R168-L377 HydrophobicContact CG-CD2 3.86Å; R168-L377 WeakPolarHBondContact O-CD2 3.24Å; R168-I380 HydrophobicContact CB-CG2 4.35Å; R168-D381 WeakPolarHBondContact CD-OD1 3.48Å; R168-D381 IonicContact CZ-OD1 3.72Å; R168-D381 IonicContact NE-OD1 2.77Å; R168-D381 PolarHBondContact NE-OD1 3.4Å; R168-D381 IonicContact NE-OD2 3.45Å; R168-D381 IonicContact NH2-OD2 3.83Å
169	S	89.7	Confident	87.8	Confident	56 Å²	56	40.9 Å²	40.9	39%	0.392	21%	0.208	S	C	.	.	H	α-helix	trans	-63.4	-37.7	174.6	-169.9	0	0	0	0	112.2	F165 E166 L167 L172 N173	F165-S169 PolarHBondContact O-N 3.33Å; E166-S169 CarbonylContact O-C 3.54Å; E166-S169 WeakPolarHBondContact O-CB 3.33Å; E166-S169 PolarHBondContact O-N 3.07Å; E166-S169 VanDerWaalsContact O-N 3.15Å; L167-S169 VanDerWaalsContact C-N 3.34Å; L167-S169 PolarHBondContact O-N 2.98Å; S169-L172 PolarHBondContact O-N 2.68Å; S169-N173 WeakPolarHBondContact O-CB 3.5Å; S169-N173 PolarHBondContact O-N 3.48Å; S169-N173 PolarHBondContact O-ND2 3.43Å
170	C	88.1	Confident	88	Confident	17 Å²	17	41.4 Å²	41.4	12%	0.115	21%	0.211	C	C	.	.	H	α-helix	trans	-64.4	-42.3	178.1	-70.8	0	0	0	0	112.2	E166 L167 R168 G174 I310	E166-C170 WeakPolarHBondContact O-CB 3.27Å; E166-C170 PolarHBondContact O-N 3.34Å; E166-C170 PolarHBondContact O-SG 2.95Å; L167-C170 WeakPolarHBondContact O-CB 3.08Å; L167-C170 PolarHBondContact O-N 3.41Å; L167-C170 VanDerWaalsContact O-N 3.14Å; R168-C170 VanDerWaalsContact C-N 3.32Å; R168-C170 PolarHBondContact O-N 3.48Å; C170-G174 VanDerWaalsContact O-CA 3.23Å; C170-G174 WeakPolarHBondContact O-CA 3.4Å; C170-G174 PolarHBondContact O-N 2.99Å; C170-I310 HydrophobicContact CB-CD1 3.62Å; C170-I310 HydrophobicContact CB-CG1 3.85Å; C170-I310 HydrophobicContact CB-CG2 4.19Å
171	I	89.9	Confident	88.2	Confident	2 Å²	2	49.4 Å²	49.4	1%	0.01	24%	0.239	C	C	.	.	H	α-helix	trans	-73.1	-32.5	177.9	-71.3	166.9	0	0	0	111.5	L167 R168 V176 M354 L376 L377 I380	L167-I171 HydrophobicContact CD1-CD1 4.03Å; L167-I171 HydrophobicContact CD1-CG1 4.43Å; L167-I171 HydrophobicContact CG-CD1 4.19Å; L167-I171 PolarHBondContact O-N 3.43Å; R168-I171 PolarHBondContact O-N 3.17Å; I171-V176 HydrophobicContact CG2-CG2 4.45Å; I171-M354 HydrophobicContact CD1-SD 4.43Å; I171-L376 HydrophobicContact CG2-CB 4.43Å; I171-L377 HydrophobicContact CB-CD2 4.28Å; I171-L377 HydrophobicContact CG2-CD2 4.04Å; I171-L377 HydrophobicContact CG2-CG 4.25Å; I171-I380 HydrophobicContact CD1-CD1 3.52Å
172	L	89.2	Confident	88.4	Confident	76 Å²	76	47.5 Å²	47.5	40%	0.398	23%	0.23	S	C	.	.	H	α-helix	trans	-64.7	-48.1	176.2	-177.5	66.9	0	0	0	111.7	R168 S169 R373 L377	R168-L172 WeakPolarHBondContact O-CB 3.27Å; R168-L172 PolarHBondContact O-N 3.42Å; R168-L172 VanDerWaalsContact O-N 3.09Å; S169-L172 PolarHBondContact O-N 2.68Å; L172-R373 PolarHBondContact O-NH1 2.93Å; L172-L377 HydrophobicContact CB-CD1 4.32Å; L172-L377 HydrophobicContact CB-CD2 4.37Å; L172-L377 HydrophobicContact CD1-CD1 3.63Å
173	N	86.5	Confident	88.5	Confident	102 Å²	102	48 Å²	48	55%	0.545	24%	0.236	S	C	.	.	H	α-helix	trans	-92.3	-15.8	-174.5	-65.4	-32.4	0	0	0	113.8	S169 Q201	S169-N173 WeakPolarHBondContact O-CB 3.5Å; S169-N173 PolarHBondContact O-N 3.48Å; S169-N173 PolarHBondContact O-ND2 3.43Å; N173-Q201 PolarHBondContact O-NE2 3.16Å
174	G	86.2	Confident	88.5	Confident	3 Å²	3	50.1 Å²	50.1	3%	0.031	25%	0.251	C	S	.	.	S	Bend	trans	-80.7	176.7	-175.9	0	0	0	0	0	114.9	C170	C170-G174 VanDerWaalsContact O-CA 3.23Å; C170-G174 WeakPolarHBondContact O-CA 3.4Å; C170-G174 PolarHBondContact O-N 2.99Å
175	T	89.7	Confident	88.5	Confident	9 Å²	9	51.8 Å²	51.8	6%	0.055	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	119.7	174.2	-66.4	0	0	0	0	109.6	M177 Q201 I310 A311 F312	T175-M177 HydrophobicContact CG2-CG 4.01Å; T175-M177 HydrophobicContact CG2-SD 4.37Å; T175-Q201 PolarHBondContact OG1-OE1 3.25Å; T175-I310 PolarHBondContact N-O 2.79Å; T175-A311 CarbonylContact O-C 3.52Å; T175-A311 VanDerWaalsContact O-CA 3.3Å; T175-A311 WeakPolarHBondContact O-CA 3.48Å; T175-F312 PolarHBondContact O-N 3.14Å
176	V	91.5	Very high	88.6	Confident	29 Å²	29	51.5 Å²	51.5	18%	0.176	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	117.1	178.5	176	0	0	0	0	108.7	I171 L178 F312 R373 L376	I171-V176 HydrophobicContact CG2-CG2 4.45Å; V176-L178 HydrophobicContact CG1-CD1 4.45Å; V176-L178 HydrophobicContact CG1-CD2 4.23Å; V176-L178 HydrophobicContact CG1-CG 4.05Å; V176-F312 WeakPolarHBondContact CA-O 3.09Å; V176-F312 HydrophobicContact CG1-CD1 4.24Å; V176-F312 HydrophobicContact CG2-CB 4.44Å; V176-R373 HydrophobicContact CB-CB 4.34Å; V176-R373 HydrophobicContact CG1-CB 4.42Å; V176-R373 HydrophobicContact CG2-CB 4.13Å; V176-L376 HydrophobicContact CG1-CD1 4.13Å
177	M	90.6	Very high	88.6	Confident	48 Å²	48	53.3 Å²	53.3	24%	0.236	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	108.3	179.2	-61.6	-172.7	77.7	0	0	109.8	T175 M180 V192 F312 V313 R314	T175-M177 HydrophobicContact CG2-CG 4.01Å; T175-M177 HydrophobicContact CG2-SD 4.37Å; M177-M180 HydrophobicContact CB-CE 3.83Å; M177-M180 HydrophobicContact CE-CE 3.49Å; M177-M180 VanDerWaalsContact CE-CE 3.49Å; M177-M180 HydrophobicContact CG-CE 4.2Å; M177-M180 HydrophobicContact SD-CE 3.32Å; M177-M180 WeakPolarHBondContact SD-CE 3.5Å; M177-V192 HydrophobicContact SD-CG2 4.2Å; M177-F312 PolarHBondContact N-O 2.88Å; M177-V313 WeakPolarHBondContact O-CA 3.32Å; M177-R314 PolarHBondContact O-N 3.39Å
178	L	89.7	Confident	88.6	Confident	40 Å²	40	53.4 Å²	53.4	21%	0.209	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	141.3	179.8	-59.9	174.3	0	0	0	110.2	V176 M180 F312 R314 A370 K371 L376	V176-L178 HydrophobicContact CG1-CD1 4.45Å; V176-L178 HydrophobicContact CG1-CD2 4.23Å; V176-L178 HydrophobicContact CG1-CG 4.05Å; L178-M180 PolarHBondContact O-N 2.86Å; L178-F312 HydrophobicContact CD2-CD1 4.33Å; L178-F312 HydrophobicContact CD2-CE1 4.03Å; L178-R314 HydrophobicContact CD2-CB 3.94Å; L178-A370 HydrophobicContact CD1-CB 4.4Å; L178-K371 WeakPolarHBondContact CD1-O 3.42Å; L178-L376 HydrophobicContact CD2-CD1 4.5Å
179	D	87.8	Confident	88.6	Confident	62 Å²	62	49.2 Å²	49.2	33%	0.332	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	59	41.2	179	-54.1	-43.6	0	0	0	115	H109 R314	H109-D179 IonicContact CD2-OD1 2.79Å; H109-D179 IonicContact NE2-OD1 2.68Å; H109-D179 PolarHBondContact NE2-OD1 3.5Å; H109-D179 IonicContact NE2-OD2 2.7Å; D179-R314 CarbonylContact C-O 3.33Å; D179-R314 WeakPolarHBondContact CA-O 3.34Å; D179-R314 PolarHBondContact N-O 3.44Å; D179-R314 IonicContact OD1-CZ 2.97Å; D179-R314 VanDerWaalsContact OD1-CZ 3.28Å; D179-R314 IonicContact OD1-NE 3.92Å; D179-R314 PolarHBondContact OD1-NE 3.45Å; D179-R314 IonicContact OD1-NH2 3.25Å; D179-R314 PolarHBondContact OD1-NH2 3.43Å; D179-R314 IonicContact OD2-CZ 2.84Å; D179-R314 IonicContact OD2-NH2 3.2Å; D179-R314 PolarHBondContact OD2-NH2 2.9Å
180	M	88.3	Confident	88.6	Confident	11 Å²	11	48.7 Å²	48.7	5%	0.054	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	131.3	174.7	178.1	-176.7	-72.2	0	0	111.2	M177 L178 A182 I188 M191 V192 V313 R314 L315 S316	M177-M180 HydrophobicContact CB-CE 3.83Å; M177-M180 HydrophobicContact CE-CE 3.49Å; M177-M180 VanDerWaalsContact CE-CE 3.49Å; M177-M180 HydrophobicContact CG-CE 4.2Å; M177-M180 HydrophobicContact SD-CE 3.32Å; M177-M180 WeakPolarHBondContact SD-CE 3.5Å; L178-M180 PolarHBondContact O-N 2.86Å; M180-A182 HydrophobicContact CG-CB 4.26Å; M180-A182 HydrophobicContact SD-CB 4.35Å; M180-I188 HydrophobicContact SD-CB 4.42Å; M180-I188 HydrophobicContact SD-CG1 4.19Å; M180-I188 HydrophobicContact SD-CG2 4.12Å; M180-M191 HydrophobicContact CE-CB 4.18Å; M180-M191 HydrophobicContact CE-CE 4.26Å; M180-M191 HydrophobicContact CG-CE 3.4Å; M180-M191 HydrophobicContact CG-SD 4.42Å; M180-M191 HydrophobicContact SD-CE 3.54Å; M180-M191 VanDerWaalsContact SD-CE 3.54Å; M180-V192 HydrophobicContact CE-CG2 3.99Å; M180-V313 HydrophobicContact CB-CG1 4.1Å; M180-V313 HydrophobicContact CE-CG1 3.82Å; M180-V313 HydrophobicContact CE-CG2 4.33Å; M180-V313 HydrophobicContact CG-CG1 4.47Å; M180-V313 HydrophobicContact SD-CG1 3.55Å; M180-V313 VanDerWaalsContact SD-CG1 3.55Å; M180-R314 PolarHBondContact N-O 2.67Å; M180-L315 HydrophobicContact CB-CD2 4.19Å; M180-L315 HydrophobicContact CG-CD2 4.14Å; M180-L315 CarbonylContact O-C 3.39Å; M180-L315 VanDerWaalsContact O-CA 3.27Å; M180-L315 WeakPolarHBondContact O-CA 3.39Å; M180-L315 HydrophobicContact SD-CD2 4.12Å; M180-S316 PolarHBondContact O-N 2.75Å
181	R	87.6	Confident	88.8	Confident	182 Å²	182	50.7 Å²	50.7	69%	0.687	25%	0.254	S	S	*	.			trans	-99.9	101.3	173.9	-51.6	-161.3	174.4	-160.4	-7	109.2	S316	R181-S316 WeakPolarHBondContact CG-O 3.33Å
182	A	86.6	Confident	88.8	Confident	4 Å²	4	50.7 Å²	50.7	3%	0.033	25%	0.254	C	S	.	.			trans	-141.9	142.9	178.5	0	0	0	0	0	110.4	M180 E187 I188 M191 L315 V319	M180-A182 HydrophobicContact CG-CB 4.26Å; M180-A182 HydrophobicContact SD-CB 4.35Å; A182-E187 WeakPolarHBondContact CA-OE2 3.12Å; A182-E187 HydrophobicContact CB-CB 4.32Å; A182-E187 HydrophobicContact CB-CG 4.25Å; A182-I188 HydrophobicContact CB-CD1 4.29Å; A182-I188 HydrophobicContact CB-CG1 3.43Å; A182-I188 VanDerWaalsContact CB-CG1 3.43Å; A182-M191 HydrophobicContact CB-CE 3.61Å; A182-L315 HydrophobicContact CB-CD2 4.14Å; A182-V319 WeakPolarHBondContact O-CG2 3.23Å
183	N	85.3	Confident	88.9	Confident	122 Å²	122	47.1 Å²	47.1	65%	0.652	24%	0.235	S	C	*	.	S	Bend	trans	-107.5	-8.4	-177.3	-66.7	-30.1	0	0	0	113.7	E187	N183-E187 PolarHBondContact N-OE2 3.04Å
184	S	86.9	Confident	89.2	Confident	45 Å²	45	45.7 Å²	45.7	32%	0.315	23%	0.228	S	C	.	.	S	Bend	trans	-143.5	155.5	-178	69.5	0	0	0	0	111.6	E186 E187 I188	S184-E186 PolarHBondContact O-N 2.89Å; S184-E187 PolarHBondContact O-N 2.85Å; S184-E187 WeakPolarHBondContact OG-CB 3.4Å; S184-E187 PolarHBondContact OG-N 2.87Å; S184-I188 WeakPolarHBondContact O-CG1 3.11Å; S184-I188 PolarHBondContact O-N 2.78Å; S184-I188 VanDerWaalsContact O-N 3.11Å
185	I	87.3	Confident	89.3	Confident	34 Å²	34	47.5 Å²	47.5	17%	0.174	24%	0.24	C	C	.	.	H	α-helix	trans	-63	-29.6	175.2	-170.8	60.6	0	0	0	112.3	I188 A189 L215 I321 L334	I185-I188 PolarHBondContact O-N 2.84Å; I185-A189 VanDerWaalsContact O-CB 3.31Å; I185-A189 WeakPolarHBondContact O-CB 3.34Å; I185-A189 PolarHBondContact O-N 2.83Å; I185-L215 HydrophobicContact CG2-CD2 3.96Å; I185-I321 HydrophobicContact CB-CG2 3.99Å; I185-I321 HydrophobicContact CG2-CG2 4.44Å; I185-L334 HydrophobicContact CD1-CD2 4.31Å
186	E	89.1	Confident	89.3	Confident	108 Å²	108	47 Å²	47	51%	0.505	24%	0.237	S	C	.	.	H	α-helix	trans	-63.1	-47.3	175.1	-65.3	179	-172.7	0	0	111.4	S184 I188 A189 D190 L215	S184-E186 PolarHBondContact O-N 2.89Å; E186-I188 PolarHBondContact O-N 2.87Å; E186-A189 PolarHBondContact O-N 3.37Å; E186-D190 PolarHBondContact O-N 3.45Å; E186-L215 HydrophobicContact CB-CD2 4.39Å; E186-L215 HydrophobicContact CG-CD1 4.23Å; E186-L215 HydrophobicContact CG-CD2 3.65Å
187	E	90.3	Very high	89.1	Confident	81 Å²	81	47.3 Å²	47.3	38%	0.379	24%	0.239	S	C	.	.	H	α-helix	trans	-66	-38.3	178.4	-165.8	-177.6	-169.3	0	0	111.8	A182 N183 S184 M191	A182-E187 WeakPolarHBondContact CA-OE2 3.12Å; A182-E187 HydrophobicContact CB-CB 4.32Å; A182-E187 HydrophobicContact CB-CG 4.25Å; N183-E187 PolarHBondContact N-OE2 3.04Å; S184-E187 PolarHBondContact O-N 2.85Å; S184-E187 WeakPolarHBondContact OG-CB 3.4Å; S184-E187 PolarHBondContact OG-N 2.87Å; E187-M191 HydrophobicContact CG-CE 4.16Å; E187-M191 WeakPolarHBondContact O-CB 3.32Å; E187-M191 WeakPolarHBondContact O-CG 3.4Å; E187-M191 PolarHBondContact O-N 2.8Å; E187-M191 VanDerWaalsContact O-N 3.08Å
188	I	89.6	Confident	89	Confident	2 Å²	2	49.3 Å²	49.3	1%	0.01	26%	0.263	C	S	.	.	H	α-helix	trans	-62.9	-48.1	173.3	-63.3	167.9	0	0	0	110.1	M180 A182 S184 I185 E186 D190 M191 V192 L315 I321 L334	M180-I188 HydrophobicContact SD-CB 4.42Å; M180-I188 HydrophobicContact SD-CG1 4.19Å; M180-I188 HydrophobicContact SD-CG2 4.12Å; A182-I188 HydrophobicContact CB-CD1 4.29Å; A182-I188 HydrophobicContact CB-CG1 3.43Å; A182-I188 VanDerWaalsContact CB-CG1 3.43Å; S184-I188 WeakPolarHBondContact O-CG1 3.11Å; S184-I188 PolarHBondContact O-N 2.78Å; S184-I188 VanDerWaalsContact O-N 3.11Å; I185-I188 PolarHBondContact O-N 2.84Å; E186-I188 PolarHBondContact O-N 2.87Å; I188-D190 PolarHBondContact O-N 3.34Å; I188-M191 PolarHBondContact O-N 3.37Å; I188-V192 HydrophobicContact CG2-CG2 4.16Å; I188-V192 WeakPolarHBondContact O-CB 3.15Å; I188-V192 WeakPolarHBondContact O-CG2 3.37Å; I188-V192 PolarHBondContact O-N 2.76Å; I188-L315 HydrophobicContact CD1-CD1 3.96Å; I188-L315 HydrophobicContact CD1-CD2 3.87Å; I188-L315 HydrophobicContact CD1-CG 4.5Å; I188-L315 HydrophobicContact CG1-CD2 4.07Å; I188-I321 HydrophobicContact CD1-CD1 3.67Å; I188-L334 HydrophobicContact CG2-CD2 3.8Å
189	A	90	Very high	88.7	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-60.2	-47	179.9	0	0	0	0	0	111.6	I185 E186 V192 I193 M214	I185-A189 VanDerWaalsContact O-CB 3.31Å; I185-A189 WeakPolarHBondContact O-CB 3.34Å; I185-A189 PolarHBondContact O-N 2.83Å; E186-A189 PolarHBondContact O-N 3.37Å; A189-V192 PolarHBondContact O-N 2.93Å; A189-I193 VanDerWaalsContact O-CB 3.29Å; A189-I193 WeakPolarHBondContact O-CB 3.41Å; A189-I193 VanDerWaalsContact O-CD1 3.32Å; A189-I193 WeakPolarHBondContact O-CD1 3.39Å; A189-I193 WeakPolarHBondContact O-CG1 3.39Å; A189-I193 PolarHBondContact O-N 2.93Å; A189-M214 HydrophobicContact CB-CB 4.23Å; A189-M214 HydrophobicContact CB-CE 3.71Å; A189-M214 HydrophobicContact CB-SD 3.86Å
190	D	91.4	Very high	88.4	Confident	46 Å²	46	50.7 Å²	50.7	25%	0.246	29%	0.291	C	S	.	.	H	α-helix	trans	-63.6	-45.1	-179.3	-71.9	-27.6	0	0	0	111.5	E186 I188 I193 D194 R211	E186-D190 PolarHBondContact O-N 3.45Å; I188-D190 PolarHBondContact O-N 3.34Å; D190-I193 PolarHBondContact O-N 2.79Å; D190-D194 WeakPolarHBondContact O-CB 3.42Å; D190-D194 VanDerWaalsContact O-CG 3.26Å; D190-D194 PolarHBondContact O-N 3.48Å; D190-R211 VanDerWaalsContact OD1-CD 3.3Å; D190-R211 WeakPolarHBondContact OD1-CD 3.41Å; D190-R211 IonicContact OD1-CZ 3.59Å; D190-R211 IonicContact OD1-NE 3.81Å; D190-R211 PolarHBondContact OD1-NE 3.36Å; D190-R211 IonicContact OD1-NH2 2.78Å; D190-R211 IonicContact OD2-NE 3.68Å; D190-R211 IonicContact OD2-NH2 3.11Å
191	M	91.3	Very high	88.1	Confident	59 Å²	59	53.8 Å²	53.8	29%	0.291	31%	0.306	S	S	.	.	H	α-helix	trans	-66.5	-40	177.7	-73.3	-165.9	-68.9	0	0	113.6	M180 A182 E187 I188 S195	M180-M191 HydrophobicContact CE-CB 4.18Å; M180-M191 HydrophobicContact CE-CE 4.26Å; M180-M191 HydrophobicContact CG-CE 3.4Å; M180-M191 HydrophobicContact CG-SD 4.42Å; M180-M191 HydrophobicContact SD-CE 3.54Å; M180-M191 VanDerWaalsContact SD-CE 3.54Å; A182-M191 HydrophobicContact CB-CE 3.61Å; E187-M191 HydrophobicContact CG-CE 4.16Å; E187-M191 WeakPolarHBondContact O-CB 3.32Å; E187-M191 WeakPolarHBondContact O-CG 3.4Å; E187-M191 PolarHBondContact O-N 2.8Å; E187-M191 VanDerWaalsContact O-N 3.08Å; I188-M191 PolarHBondContact O-N 3.37Å; M191-S195 WeakPolarHBondContact O-CB 3.47Å; M191-S195 PolarHBondContact O-N 3.16Å; M191-S195 VanDerWaalsContact O-N 3.09Å
192	V	90.9	Very high	88	Confident	2 Å²	2	45.6 Å²	45.6	1%	0.012	28%	0.275	C	S	.	.	H	α-helix	trans	-64.3	-45.5	176.7	169.7	0	0	0	0	110.1	M177 M180 I188 A189 S195 M196 A311 V313	M177-V192 HydrophobicContact SD-CG2 4.2Å; M180-V192 HydrophobicContact CE-CG2 3.99Å; I188-V192 HydrophobicContact CG2-CG2 4.16Å; I188-V192 WeakPolarHBondContact O-CB 3.15Å; I188-V192 WeakPolarHBondContact O-CG2 3.37Å; I188-V192 PolarHBondContact O-N 2.76Å; A189-V192 PolarHBondContact O-N 2.93Å; V192-S195 PolarHBondContact O-N 3.2Å; V192-M196 HydrophobicContact CG1-CE 3.43Å; V192-M196 VanDerWaalsContact CG1-CE 3.43Å; V192-M196 HydrophobicContact CG1-SD 3.83Å; V192-M196 VanDerWaalsContact O-CG 3.28Å; V192-M196 WeakPolarHBondContact O-CG 3.3Å; V192-M196 PolarHBondContact O-N 3.42Å; V192-A311 HydrophobicContact CG1-CB 3.6Å; V192-V313 HydrophobicContact CG2-CG2 3.65Å
193	I	91.4	Very high	87.9	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-66.3	-42.8	-179.8	-67.7	165.7	0	0	0	111.2	A189 D190 S195 M196 V197 L202 R207 V210 R211 M214	A189-I193 VanDerWaalsContact O-CB 3.29Å; A189-I193 WeakPolarHBondContact O-CB 3.41Å; A189-I193 VanDerWaalsContact O-CD1 3.32Å; A189-I193 WeakPolarHBondContact O-CD1 3.39Å; A189-I193 WeakPolarHBondContact O-CG1 3.39Å; A189-I193 PolarHBondContact O-N 2.93Å; D190-I193 PolarHBondContact O-N 2.79Å; I193-S195 VanDerWaalsContact C-N 3.29Å; I193-S195 PolarHBondContact O-N 2.98Å; I193-M196 PolarHBondContact O-N 3.3Å; I193-M196 VanDerWaalsContact O-N 3.11Å; I193-V197 HydrophobicContact CG2-CG2 4.37Å; I193-V197 WeakPolarHBondContact O-CG2 3.22Å; I193-V197 PolarHBondContact O-N 3.46Å; I193-L202 HydrophobicContact CG2-CD2 3.9Å; I193-R207 HydrophobicContact CG2-CB 4.21Å; I193-R207 HydrophobicContact CG2-CG 3.72Å; I193-V210 HydrophobicContact CD1-CB 4.41Å; I193-V210 HydrophobicContact CD1-CG1 4.12Å; I193-V210 HydrophobicContact CG1-CG1 4.09Å; I193-R211 HydrophobicContact CD1-CB 3.66Å; I193-R211 HydrophobicContact CD1-CG 4.28Å; I193-M214 HydrophobicContact CD1-SD 4.3Å; I193-M214 HydrophobicContact CG1-SD 4.45Å
194	D	91.1	Very high	87.9	Confident	72 Å²	72	50.1 Å²	50.1	39%	0.385	29%	0.29	S	S	.	.	H	α-helix	trans	-59.3	-40.9	175.7	-76.9	-24.2	0	0	0	111.5	D190 V197 A198 R207	D190-D194 WeakPolarHBondContact O-CB 3.42Å; D190-D194 VanDerWaalsContact O-CG 3.26Å; D190-D194 PolarHBondContact O-N 3.48Å; D194-V197 PolarHBondContact O-N 2.95Å; D194-A198 VanDerWaalsContact O-CB 3.28Å; D194-A198 WeakPolarHBondContact O-CB 3.23Å; D194-A198 PolarHBondContact O-N 3.1Å; D194-R207 IonicContact OD1-CZ 3.61Å; D194-R207 IonicContact OD1-NH1 3.98Å; D194-R207 PolarHBondContact OD1-NH1 3.48Å; D194-R207 IonicContact OD1-NH2 2.83Å; D194-R207 PolarHBondContact OD1-NH2 3.36Å; D194-R207 IonicContact OD2-NH2 2.71Å
195	S	89.7	Confident	87.8	Confident	41 Å²	41	54.7 Å²	54.7	29%	0.287	31%	0.311	S	S	.	.	H	α-helix	trans	-66	-37.9	174.5	-175.6	0	0	0	0	112.7	M191 V192 I193 A198 S199	M191-S195 WeakPolarHBondContact O-CB 3.47Å; M191-S195 PolarHBondContact O-N 3.16Å; M191-S195 VanDerWaalsContact O-N 3.09Å; V192-S195 PolarHBondContact O-N 3.2Å; I193-S195 VanDerWaalsContact C-N 3.29Å; I193-S195 PolarHBondContact O-N 2.98Å; S195-A198 PolarHBondContact O-N 3.03Å; S195-S199 WeakPolarHBondContact O-CB 3.36Å; S195-S199 PolarHBondContact O-N 3.49Å; S195-S199 PolarHBondContact O-OG 3.49Å
196	M	88.3	Confident	87.7	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-69.5	-37	178	-73.1	169.8	173.2	0	0	112.6	V192 I193 S199 G200 Q201 L202 I309 A311	V192-M196 HydrophobicContact CG1-CE 3.43Å; V192-M196 VanDerWaalsContact CG1-CE 3.43Å; V192-M196 HydrophobicContact CG1-SD 3.83Å; V192-M196 VanDerWaalsContact O-CG 3.28Å; V192-M196 WeakPolarHBondContact O-CG 3.3Å; V192-M196 PolarHBondContact O-N 3.42Å; I193-M196 PolarHBondContact O-N 3.3Å; I193-M196 VanDerWaalsContact O-N 3.11Å; M196-S199 WeakPolarHBondContact CA-OG 3.38Å; M196-S199 PolarHBondContact O-OG 3.14Å; M196-G200 PolarHBondContact O-N 2.79Å; M196-Q201 HydrophobicContact CB-CB 4.49Å; M196-Q201 PolarHBondContact O-N 3.37Å; M196-L202 HydrophobicContact CB-CB 4.03Å; M196-L202 PolarHBondContact O-N 3.24Å; M196-I309 HydrophobicContact CE-CG2 3.24Å; M196-I309 HydrophobicContact CG-CG2 4.39Å; M196-I309 HydrophobicContact SD-CG2 3.28Å; M196-I309 WeakPolarHBondContact SD-CG2 3.37Å; M196-A311 HydrophobicContact CE-CB 3.41Å; M196-A311 VanDerWaalsContact CE-CB 3.41Å
197	V	88.6	Confident	87.6	Confident	35 Å²	35	53 Å²	53	21%	0.212	30%	0.3	C	S	.	.	H	α-helix	trans	-66.4	-48.2	172.3	167.3	0	0	0	0	110.1	I193 D194 S199 G200 L202 E204	I193-V197 HydrophobicContact CG2-CG2 4.37Å; I193-V197 WeakPolarHBondContact O-CG2 3.22Å; I193-V197 PolarHBondContact O-N 3.46Å; D194-V197 PolarHBondContact O-N 2.95Å; V197-S199 VanDerWaalsContact C-N 3.26Å; V197-S199 PolarHBondContact O-N 3.45Å; V197-G200 PolarHBondContact O-N 2.64Å; V197-L202 HydrophobicContact CG2-CB 4.27Å; V197-L202 HydrophobicContact CG2-CD2 4.28Å; V197-L202 HydrophobicContact CG2-CG 4.39Å; V197-E204 WeakPolarHBondContact CG1-OE2 3.36Å
198	A	87.5	Confident	87.4	Confident	90 Å²	90	52.5 Å²	52.5	74%	0.744	31%	0.31	S	S	*	.	H	α-helix	trans	-61.6	-33.6	-179	0	0	0	0	0	112.9	D194 S195 G200	D194-A198 VanDerWaalsContact O-CB 3.28Å; D194-A198 WeakPolarHBondContact O-CB 3.23Å; D194-A198 PolarHBondContact O-N 3.1Å; S195-A198 PolarHBondContact O-N 3.03Å; A198-G200 VanDerWaalsContact C-N 3.3Å
199	S	83.7	Confident	87.3	Confident	66 Å²	66	57.2 Å²	57.2	46%	0.462	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83	-1.7	175.9	56.8	0	0	0	0	114.1	S195 M196 V197 Q201	S195-S199 WeakPolarHBondContact O-CB 3.36Å; S195-S199 PolarHBondContact O-N 3.49Å; S195-S199 PolarHBondContact O-OG 3.49Å; M196-S199 WeakPolarHBondContact CA-OG 3.38Å; M196-S199 PolarHBondContact O-OG 3.14Å; V197-S199 VanDerWaalsContact C-N 3.26Å; V197-S199 PolarHBondContact O-N 3.45Å; S199-Q201 PolarHBondContact O-N 2.75Å; S199-Q201 WeakPolarHBondContact OG-CG 3.46Å
200	G	81.8	Confident	87.2	Confident	65 Å²	65	57.2 Å²	57.2	67%	0.67	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.8	13.4	-179.3	0	0	0	0	0	114.5	M196 V197 A198	M196-G200 PolarHBondContact O-N 2.79Å; V197-G200 PolarHBondContact O-N 2.64Å; A198-G200 VanDerWaalsContact C-N 3.3Å
201	Q	81.1	Confident	87	Confident	76 Å²	76	59.4 Å²	59.4	36%	0.355	34%	0.335	S	S	.	.	S	Bend	trans	-75.2	-28.8	176.1	-65.1	-172.2	-11.9	0	0	112	N173 T175 M196 S199	N173-Q201 PolarHBondContact O-NE2 3.16Å; T175-Q201 PolarHBondContact OG1-OE1 3.25Å; M196-Q201 HydrophobicContact CB-CB 4.49Å; M196-Q201 PolarHBondContact O-N 3.37Å; S199-Q201 PolarHBondContact O-N 2.75Å; S199-Q201 WeakPolarHBondContact OG-CG 3.46Å
202	L	85.3	Confident	86.9	Confident	10 Å²	10	62.4 Å²	62.4	5%	0.052	35%	0.348	C	S	.	.	S	Bend	trans	-124.1	132.7	-178.8	-174.7	61.8	0	0	0	111.1	I193 M196 V197 L206 V210 L305 I309	I193-L202 HydrophobicContact CG2-CD2 3.9Å; M196-L202 HydrophobicContact CB-CB 4.03Å; M196-L202 PolarHBondContact O-N 3.24Å; V197-L202 HydrophobicContact CG2-CB 4.27Å; V197-L202 HydrophobicContact CG2-CD2 4.28Å; V197-L202 HydrophobicContact CG2-CG 4.39Å; L202-L206 HydrophobicContact CD1-CB 3.56Å; L202-L206 HydrophobicContact CD1-CD1 4.23Å; L202-L206 HydrophobicContact CG-CB 4.38Å; L202-V210 HydrophobicContact CD1-CG2 4.02Å; L202-V210 HydrophobicContact CD2-CB 4.42Å; L202-V210 HydrophobicContact CD2-CG2 4.11Å; L202-L305 HydrophobicContact CD1-CD2 4.3Å; L202-I309 HydrophobicContact CD1-CD1 3.67Å
203	K	86	Confident	86.6	Confident	120 Å²	120	62.5 Å²	62.5	52%	0.522	35%	0.349	S	S	.	.			trans	-72.9	140.4	170	-63.9	174	-176.4	162.9	0	109.3	D205 L206 E306	K203-D205 PolarHBondContact O-N 2.93Å; K203-D205 VanDerWaalsContact O-N 3.14Å; K203-L206 HydrophobicContact CB-CD1 4.36Å; K203-L206 HydrophobicContact CB-CG 4.48Å; K203-L206 PolarHBondContact O-N 3.31Å; K203-E306 IonicContact NZ-OE2 3.22Å; K203-E306 PolarHBondContact NZ-OE2 2.69Å
204	E	84.9	Confident	86.4	Confident	101 Å²	101	62.6 Å²	62.6	47%	0.472	35%	0.35	S	S	.	.	G	3₁₀ helix	trans	-54.3	-36.6	-178.9	-163.3	67.3	-149.1	0	0	112.6	V197 L206 R207	V197-E204 WeakPolarHBondContact CG1-OE2 3.36Å; E204-L206 PolarHBondContact O-N 2.84Å; E204-L206 VanDerWaalsContact O-N 3.1Å; E204-R207 WeakPolarHBondContact O-CB 3.44Å; E204-R207 PolarHBondContact O-N 2.67Å; E204-R207 VanDerWaalsContact O-N 3.1Å; E204-R207 VanDerWaalsContact OE1-CD 3.26Å; E204-R207 WeakPolarHBondContact OE1-CD 3.49Å; E204-R207 IonicContact OE1-NH1 3.74Å; E204-R207 PolarHBondContact OE1-NH1 3.25Å; E204-R207 VanDerWaalsContact OE1-NH1 3.14Å
205	D	84.6	Confident	86.2	Confident	141 Å²	141	61.9 Å²	61.9	75%	0.754	35%	0.345	S	S	*	.	G	3₁₀ helix	trans	-61.5	-22.1	179.8	-56.6	-31	0	0	0	113.8	K203	K203-D205 PolarHBondContact O-N 2.93Å; K203-D205 VanDerWaalsContact O-N 3.14Å
206	L	85.9	Confident	86	Confident	30 Å²	30	61.8 Å²	61.8	16%	0.157	34%	0.34	C	S	.	.	G	3₁₀ helix	trans	-95.8	-9.1	-177.8	-62.2	176.3	0	0	0	112.7	L202 K203 E204 A208 K209 V210 F304 L305	L202-L206 HydrophobicContact CD1-CB 3.56Å; L202-L206 HydrophobicContact CD1-CD1 4.23Å; L202-L206 HydrophobicContact CG-CB 4.38Å; K203-L206 HydrophobicContact CB-CD1 4.36Å; K203-L206 HydrophobicContact CB-CG 4.48Å; K203-L206 PolarHBondContact O-N 3.31Å; E204-L206 PolarHBondContact O-N 2.84Å; E204-L206 VanDerWaalsContact O-N 3.1Å; L206-A208 PolarHBondContact O-N 3.13Å; L206-K209 HydrophobicContact CD2-CD 4.32Å; L206-K209 PolarHBondContact O-N 3.39Å; L206-K209 VanDerWaalsContact O-N 3.15Å; L206-V210 WeakPolarHBondContact O-CG2 3.36Å; L206-V210 PolarHBondContact O-N 3.12Å; L206-F304 HydrophobicContact CD2-CB 4.4Å; L206-F304 HydrophobicContact CD2-CD2 4.13Å; L206-L305 HydrophobicContact CD1-CD2 4.2Å
207	R	87.1	Confident	85.6	Confident	75 Å²	75	68 Å²	68	28%	0.283	37%	0.367	S	S	.	.	H	α-helix	trans	-50.4	-51.9	178.9	170.8	171.3	-174.7	157.6	12.5	112.6	I193 D194 E204 K209 V210 R211	I193-R207 HydrophobicContact CG2-CB 4.21Å; I193-R207 HydrophobicContact CG2-CG 3.72Å; D194-R207 IonicContact OD1-CZ 3.61Å; D194-R207 IonicContact OD1-NH1 3.98Å; D194-R207 PolarHBondContact OD1-NH1 3.48Å; D194-R207 IonicContact OD1-NH2 2.83Å; D194-R207 PolarHBondContact OD1-NH2 3.36Å; D194-R207 IonicContact OD2-NH2 2.71Å; E204-R207 WeakPolarHBondContact O-CB 3.44Å; E204-R207 PolarHBondContact O-N 2.67Å; E204-R207 VanDerWaalsContact O-N 3.1Å; E204-R207 VanDerWaalsContact OE1-CD 3.26Å; E204-R207 WeakPolarHBondContact OE1-CD 3.49Å; E204-R207 IonicContact OE1-NH1 3.74Å; E204-R207 PolarHBondContact OE1-NH1 3.25Å; E204-R207 VanDerWaalsContact OE1-NH1 3.14Å; R207-K209 VanDerWaalsContact C-N 3.3Å; R207-K209 PolarHBondContact O-N 3.19Å; R207-V210 PolarHBondContact O-N 2.72Å; R207-R211 WeakPolarHBondContact O-CB 3.21Å; R207-R211 PolarHBondContact O-N 3.31Å
208	A	86	Confident	85.3	Confident	71 Å²	71	67.1 Å²	67.1	59%	0.587	36%	0.36	S	S	*	.	H	α-helix	trans	-63.4	-36.9	-177	0	0	0	0	0	112.3	L206 E212	L206-A208 PolarHBondContact O-N 3.13Å; A208-E212 WeakPolarHBondContact O-CB 3.45Å; A208-E212 PolarHBondContact O-N 2.7Å
209	K	86.9	Confident	84.8	Confident	102 Å²	102	64.3 Å²	64.3	44%	0.443	33%	0.332	S	S	.	.	H	α-helix	trans	-72.9	-40.2	-179.3	-63.3	-176.9	-178.9	177.1	0	112.4	L206 R207 E212 A213 F304	L206-K209 HydrophobicContact CD2-CD 4.32Å; L206-K209 PolarHBondContact O-N 3.39Å; L206-K209 VanDerWaalsContact O-N 3.15Å; R207-K209 VanDerWaalsContact C-N 3.3Å; R207-K209 PolarHBondContact O-N 3.19Å; K209-E212 PolarHBondContact O-N 3.44Å; K209-A213 PolarHBondContact O-N 2.81Å; K209-F304 HydrophobicContact CB-CD1 4.2Å; K209-F304 HydrophobicContact CB-CD2 4.01Å; K209-F304 HydrophobicContact CB-CE1 3.95Å; K209-F304 HydrophobicContact CB-CE2 3.76Å; K209-F304 HydrophobicContact CB-CG 4.22Å; K209-F304 HydrophobicContact CB-CZ 3.73Å; K209-F304 HydrophobicContact CD-CB 3.99Å; K209-F304 HydrophobicContact CD-CD1 4.1Å; K209-F304 HydrophobicContact CD-CD2 4.16Å; K209-F304 HydrophobicContact CD-CG 3.81Å
210	V	86.7	Confident	84.6	Confident	0 Å²	0	62.1 Å²	62.1	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-66.7	-43.4	175.3	176.9	0	0	0	0	110.6	I193 L202 L206 R207 E212 A213 M214 F304 L305 I309 L338	I193-V210 HydrophobicContact CD1-CB 4.41Å; I193-V210 HydrophobicContact CD1-CG1 4.12Å; I193-V210 HydrophobicContact CG1-CG1 4.09Å; L202-V210 HydrophobicContact CD1-CG2 4.02Å; L202-V210 HydrophobicContact CD2-CB 4.42Å; L202-V210 HydrophobicContact CD2-CG2 4.11Å; L206-V210 WeakPolarHBondContact O-CG2 3.36Å; L206-V210 PolarHBondContact O-N 3.12Å; R207-V210 PolarHBondContact O-N 2.72Å; V210-E212 VanDerWaalsContact C-N 3.33Å; V210-E212 PolarHBondContact O-N 2.81Å; V210-A213 WeakPolarHBondContact O-CB 3.5Å; V210-A213 PolarHBondContact O-N 2.77Å; V210-A213 VanDerWaalsContact O-N 3.15Å; V210-M214 HydrophobicContact CG1-SD 4.43Å; V210-M214 PolarHBondContact O-N 3.13Å; V210-F304 HydrophobicContact CG2-CE2 3.82Å; V210-F304 HydrophobicContact CG2-CZ 4.43Å; V210-L305 HydrophobicContact CG2-CD2 4.37Å; V210-I309 HydrophobicContact CG2-CD1 4.28Å; V210-L338 HydrophobicContact CG1-CD1 4.27Å
211	R	88.8	Confident	83.7	Confident	91 Å²	91	60 Å²	60	34%	0.343	29%	0.287	S	S	.	.	H	α-helix	trans	-58.4	-45.1	174.8	-171.3	178.4	-176.5	-91.3	-2.6	111.8	D190 I193 R207 A213 M214 L215	D190-R211 VanDerWaalsContact OD1-CD 3.3Å; D190-R211 WeakPolarHBondContact OD1-CD 3.41Å; D190-R211 IonicContact OD1-CZ 3.59Å; D190-R211 IonicContact OD1-NE 3.81Å; D190-R211 PolarHBondContact OD1-NE 3.36Å; D190-R211 IonicContact OD1-NH2 2.78Å; D190-R211 IonicContact OD2-NE 3.68Å; D190-R211 IonicContact OD2-NH2 3.11Å; I193-R211 HydrophobicContact CD1-CB 3.66Å; I193-R211 HydrophobicContact CD1-CG 4.28Å; R207-R211 WeakPolarHBondContact O-CB 3.21Å; R207-R211 PolarHBondContact O-N 3.31Å; R211-A213 VanDerWaalsContact C-N 3.33Å; R211-A213 PolarHBondContact O-N 3.26Å; R211-M214 PolarHBondContact O-N 3.36Å; R211-L215 HydrophobicContact CG-CD1 4.03Å; R211-L215 WeakPolarHBondContact O-CG 3.46Å; R211-L215 PolarHBondContact O-N 3.49Å; R211-L215 VanDerWaalsContact O-N 3.16Å
212	E	87.7	Confident	82.6	Confident	123 Å²	123	58.7 Å²	58.7	58%	0.575	28%	0.282	S	S	*	.	H	α-helix	trans	-61.6	-40.9	175.7	-169.5	-169.4	149.9	0	0	111.8	A208 K209 V210 L215 K216	A208-E212 WeakPolarHBondContact O-CB 3.45Å; A208-E212 PolarHBondContact O-N 2.7Å; K209-E212 PolarHBondContact O-N 3.44Å; V210-E212 VanDerWaalsContact C-N 3.33Å; V210-E212 PolarHBondContact O-N 2.81Å; E212-L215 PolarHBondContact O-N 2.78Å; E212-K216 VanDerWaalsContact O-CG 3.25Å; E212-K216 WeakPolarHBondContact O-CG 3.36Å; E212-K216 PolarHBondContact O-N 3.06Å
213	A	86.1	Confident	81.1	Confident	3 Å²	3	61.5 Å²	61.5	3%	0.025	30%	0.295	C	S	.	.	H	α-helix	trans	-64.5	-42.5	177.7	0	0	0	0	0	112.7	W131 K209 V210 R211 L215 K216	W131-A213 PolarHBondContact NE1-O 3.06Å; K209-A213 PolarHBondContact O-N 2.81Å; V210-A213 WeakPolarHBondContact O-CB 3.5Å; V210-A213 PolarHBondContact O-N 2.77Å; V210-A213 VanDerWaalsContact O-N 3.15Å; R211-A213 VanDerWaalsContact C-N 3.33Å; R211-A213 PolarHBondContact O-N 3.26Å; A213-L215 VanDerWaalsContact C-N 3.32Å; A213-L215 PolarHBondContact O-N 3.48Å; A213-K216 PolarHBondContact O-N 2.87Å
214	M	85.9	Confident	79.1	Confident	3 Å²	3	59.8 Å²	59.8	2%	0.015	29%	0.285	C	S	.	.	H	α-helix	trans	-66.9	-30.8	177.7	-70.4	-177	68.9	0	0	113.2	A189 I193 V210 R211 L336	A189-M214 HydrophobicContact CB-CB 4.23Å; A189-M214 HydrophobicContact CB-CE 3.71Å; A189-M214 HydrophobicContact CB-SD 3.86Å; I193-M214 HydrophobicContact CD1-SD 4.3Å; I193-M214 HydrophobicContact CG1-SD 4.45Å; V210-M214 HydrophobicContact CG1-SD 4.43Å; V210-M214 PolarHBondContact O-N 3.13Å; R211-M214 PolarHBondContact O-N 3.36Å; M214-L336 HydrophobicContact CE-CD2 3.83Å; M214-L336 HydrophobicContact CG-CD2 3.99Å; M214-L336 HydrophobicContact SD-CD2 3.63Å
215	L	86.9	Confident	77.3	Confident	56 Å²	56	61.2 Å²	61.2	29%	0.293	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91	5.7	-177.7	-64.2	176.7	0	0	0	114	I185 E186 R211 E212 A213	I185-L215 HydrophobicContact CG2-CD2 3.96Å; E186-L215 HydrophobicContact CB-CD2 4.39Å; E186-L215 HydrophobicContact CG-CD1 4.23Å; E186-L215 HydrophobicContact CG-CD2 3.65Å; R211-L215 HydrophobicContact CG-CD1 4.03Å; R211-L215 WeakPolarHBondContact O-CG 3.46Å; R211-L215 PolarHBondContact O-N 3.49Å; R211-L215 VanDerWaalsContact O-N 3.16Å; E212-L215 PolarHBondContact O-N 2.78Å; A213-L215 VanDerWaalsContact C-N 3.32Å; A213-L215 PolarHBondContact O-N 3.48Å
216	K	86.3	Confident	75.3	Confident	40 Å²	40	60.4 Å²	60.4	17%	0.174	29%	0.285	C	S	.	.	S	Bend	trans	-63.1	152.6	175.9	-67.5	-162.7	172.6	171.3	0	111.1	L121 A128 E212 A213 H218	L121-K216 HydrophobicContact CD1-CD 4.34Å; A128-K216 HydrophobicContact CB-CD 4.45Å; A128-K216 PolarHBondContact O-NZ 2.88Å; E212-K216 VanDerWaalsContact O-CG 3.25Å; E212-K216 WeakPolarHBondContact O-CG 3.36Å; E212-K216 PolarHBondContact O-N 3.06Å; A213-K216 PolarHBondContact O-N 2.87Å; K216-H218 PolarHBondContact O-CD2 3.42Å; K216-H218 PolarHBondContact O-N 3.5Å
217	K	80.1	Confident	73.1	Confident	129 Å²	129	63.3 Å²	63.3	56%	0.561	31%	0.308	S	S	*	.	P	Polyproline II helix	trans	-64.3	131.7	-179.2	-166.9	-171.4	174.5	-153.4	0	109.8	W131 E223	W131-K217 PolarHBondContact N-O 2.99Å; K217-E223 IonicContact NZ-OE1 3.75Å; K217-E223 PolarHBondContact NZ-OE1 3.19Å; K217-E223 IonicContact NZ-OE2 3.35Å; K217-E223 PolarHBondContact NZ-OE2 2.85Å
218	H	82.9	Confident	70.8	Confident	17 Å²	17	66.2 Å²	66.2	8%	0.079	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	124.8	167.2	-63.7	-109.4	0	0	0	109.6	D119 W131 K216 G323 L324	D119-H218 IonicContact OD2-CE1 3.76Å; D119-H218 IonicContact OD2-CG 2.84Å; D119-H218 IonicContact OD2-ND1 2.67Å; D119-H218 PolarHBondContact OD2-ND1 3.13Å; W131-H218 HydrophobicContact CB-CB 4.33Å; W131-H218 AromaticContact CD1-CD2 3.94Å; W131-H218 AromaticContact CD1-CE1 3.7Å; W131-H218 AromaticContact CD1-NE2 3.56Å; W131-H218 AromaticContact CG-CE1 3.67Å; W131-H218 AromaticContact CG-ND1 3.9Å; K216-H218 PolarHBondContact O-CD2 3.42Å; K216-H218 PolarHBondContact O-N 3.5Å; H218-G323 WeakPolarHBondContact CB-O 3.45Å; H218-L324 WeakPolarHBondContact CE1-CD1 3.45Å; H218-L324 WeakPolarHBondContact NE2-CD1 3.35Å
219	H	77.1	Confident	68.6	Low	32 Å²	32	72.8 Å²	72.8	15%	0.148	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	108.7	-179.5	-173.9	60.6	0	0	0	109.7	W131 E223	W131-H219 WeakPolarHBondContact O-CB 3.34Å; W131-H219 PolarHBondContact O-N 3.39Å; H219-E223 IonicContact CE1-OE2 2.76Å; H219-E223 IonicContact ND1-OE2 3.11Å; H219-E223 PolarHBondContact ND1-OE2 2.98Å
220	H	78.4	Confident	66.3	Low	19 Å²	19	75.1 Å²	75.1	9%	0.088	36%	0.355	C	S	.	.			trans	-88.5	142.5	-179.2	-62.4	-62.8	0	0	0	111.3	E117 N222 E223 G323 T325 E326	E117-H220 IonicContact OE1-CE1 3.57Å; E117-H220 IonicContact OE1-ND1 3.8Å; H220-N222 PolarHBondContact O-N 2.92Å; H220-E223 PolarHBondContact O-N 2.93Å; H220-G323 PolarHBondContact NE2-O 3.47Å; H220-T325 VanDerWaalsContact CE1-C 3.4Å; H220-E326 HydrophobicContact CB-CB 4.33Å; H220-E326 HydrophobicContact CB-CG 4.31Å; H220-E326 PolarHBondContact CE1-N 2.85Å; H220-E326 VanDerWaalsContact CE1-N 3.29Å; H220-E326 PolarHBondContact ND1-N 2.94Å
221	Q	63.4	Low	63.8	Low	21 Å²	21	81 Å²	81	10%	0.098	39%	0.393	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.5	-31.2	-172.6	-175.2	55.6	24.1	0	0	113.9	G148 W151	G148-Q221 PolarHBondContact O-NE2 3.32Å; G148-Q221 PolarHBondContact O-OE1 3.09Å; W151-Q221 HydrophobicContact CZ2-CB 4.33Å
222	N	56.8	Low	61.2	Low	48 Å²	48	83.9 Å²	83.9	26%	0.257	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-14.4	-179.4	-88.8	-31.7	0	0	0	115.2	H220 R224 K225 E326	H220-N222 PolarHBondContact O-N 2.92Å; N222-R224 VanDerWaalsContact C-N 3.28Å; N222-R224 PolarHBondContact O-N 2.94Å; N222-K225 PolarHBondContact O-N 2.87Å; N222-E326 VanDerWaalsContact CG-OE1 3.31Å; N222-E326 PolarHBondContact ND2-OE1 2.97Å
223	E	54.2	Low	58.6	Low	69 Å²	69	84.3 Å²	84.3	32%	0.322	43%	0.425	S	S	.	.	H	α-helix	trans	-64.8	-30.1	176.7	-71.6	-165.6	147.6	0	0	112.1	K217 H219 H220 K225 L226 S227	K217-E223 IonicContact NZ-OE1 3.75Å; K217-E223 PolarHBondContact NZ-OE1 3.19Å; K217-E223 IonicContact NZ-OE2 3.35Å; K217-E223 PolarHBondContact NZ-OE2 2.85Å; H219-E223 IonicContact CE1-OE2 2.76Å; H219-E223 IonicContact ND1-OE2 3.11Å; H219-E223 PolarHBondContact ND1-OE2 2.98Å; H220-E223 PolarHBondContact O-N 2.93Å; E223-K225 PolarHBondContact O-N 2.86Å; E223-L226 PolarHBondContact O-N 2.86Å; E223-S227 PolarHBondContact O-N 2.95Å
224	R	44.5	Very low	56	Low	85 Å²	85	95.4 Å²	95.4	32%	0.321	47%	0.466	S	S	.	.	H	α-helix	trans	-66.8	-30.7	177.9	-74.5	-175.8	176.2	-171	-2.2	114.5	G148 N222 L226 S227	G148-R224 PolarHBondContact O-NH1 2.79Å; N222-R224 VanDerWaalsContact C-N 3.28Å; N222-R224 PolarHBondContact O-N 2.94Å; R224-L226 VanDerWaalsContact C-N 3.29Å; R224-L226 PolarHBondContact O-N 3Å; R224-S227 PolarHBondContact O-OG 2.87Å
225	K	46.5	Very low	53.4	Low	130 Å²	130	99.6 Å²	99.6	57%	0.565	50%	0.495	S	S	*	.	H	α-helix	trans	-74.1	-21.5	-179.8	-77.3	177.5	-177.7	161.6	0	113.1	N222 E223	N222-K225 PolarHBondContact O-N 2.87Å; E223-K225 PolarHBondContact O-N 2.86Å
226	L	42.4	Very low	51.1	Low	124 Å²	124	104.2 Å²	104.2	65%	0.649	52%	0.519	S	S	*	.	H	α-helix	trans	-91.3	-31.5	-176.5	-115.9	148.2	0	0	0	112.4	E223 R224	E223-L226 PolarHBondContact O-N 2.86Å; R224-L226 VanDerWaalsContact C-N 3.29Å; R224-L226 PolarHBondContact O-N 3Å
227	S	39.8	Very low	48.7	Very low	91 Å²	91	106.4 Å²	106.4	64%	0.636	54%	0.544	S	S	*	.	H	α-helix	trans	-73.1	-29.2	176.4	57.1	0	0	0	0	113.6	E223 R224	E223-S227 PolarHBondContact O-N 2.95Å; R224-S227 PolarHBondContact O-OG 2.87Å
228	N	40.4	Very low	46.5	Very low	137 Å²	137	106.8 Å²	106.8	73%	0.733	55%	0.553	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.5	4.2	-179.5	-79.3	-8.5	0	0	0	115
229	R	39.8	Very low	44.4	Very low	209 Å²	209	113.1 Å²	113.1	79%	0.789	59%	0.586	S	S	*	*			trans	-105.1	102.3	176.3	-87.9	-176.2	175.2	174.7	0.6	111.8
230	I	37.7	Very low	42.2	Very low	151 Å²	151	115.2 Å²	115.2	77%	0.774	62%	0.616	S	S	*	*			trans	-53.5	132.7	158.6	-58.6	167.8	0	0	0	108	L232	I230-L232 PolarHBondContact O-N 3.45Å
231	P	34.5	Very low	40.2	Very low	123 Å²	123	123.2 Å²	123.2	80%	0.799	65%	0.65	S	S	*	*	S	Bend	trans	-82.8	83.7	-175.6	33.5	-32.1	0	0	0	109.8
232	L	34.2	Very low	38.7	Very low	152 Å²	152	131.2 Å²	131.2	80%	0.796	69%	0.685	S	S	*	*			trans	-141	128.6	165.5	-141.4	93.5	0	0	0	110.2	I230	I230-L232 PolarHBondContact O-N 3.45Å
233	V	32.6	Very low	37.4	Very low	132 Å²	132	138 Å²	138	80%	0.8	72%	0.715	S	S	*	*			trans	82	91.7	176.8	-162.3	0	0	0	0	115.7	S235	V233-S235 PolarHBondContact O-N 3.05Å
234	R	32	Very low	36.1	Very low	235 Å²	235	140 Å²	140	89%	0.887	74%	0.736	S	S	*	*			trans	-60.5	118	164.2	-142.3	174.3	-166.7	140.5	1.6	108.8
235	S	30.4	Very low	35.2	Very low	91 Å²	91	144.2 Å²	144.2	64%	0.636	77%	0.765	S	S	*	*			trans	-65.3	136.1	174.9	178.1	0	0	0	0	111	V233 A237	V233-S235 PolarHBondContact O-N 3.05Å; S235-A237 PolarHBondContact O-N 3.26Å
236	I	38.3	Very low	34.4	Very low	153 Å²	153	143 Å²	143	79%	0.785	77%	0.771	S	S	*	*	G	3₁₀ helix	trans	-62.3	-3.7	-174.6	-79.4	167	0	0	0	114.3	D238	I236-D238 VanDerWaalsContact C-N 3.33Å; I236-D238 PolarHBondContact O-N 3.38Å
237	A	37.2	Very low	33.6	Very low	86 Å²	86	144.5 Å²	144.5	71%	0.711	78%	0.778	S	S	*	*	G	3₁₀ helix	trans	-74.3	-12.7	-178.5	0	0	0	0	0	115.5	S235	S235-A237 PolarHBondContact O-N 3.26Å
238	D	34.5	Very low	33.1	Very low	138 Å²	138	148.9 Å²	148.9	74%	0.738	79%	0.794	S	S	*	*	G	3₁₀ helix	trans	-99	2.1	-174.3	-80.1	-27.7	0	0	0	115.6	I236	I236-D238 VanDerWaalsContact C-N 3.33Å; I236-D238 PolarHBondContact O-N 3.38Å
239	I	37.2	Very low	32.6	Very low	149 Å²	149	148.9 Å²	148.9	76%	0.764	79%	0.793	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.4	-15.3	-178.9	-76.7	167.7	0	0	0	113.2	K241	I239-K241 PolarHBondContact O-N 2.95Å
240	G	32.3	Very low	32	Very low	76 Å²	76	146.6 Å²	146.6	78%	0.784	79%	0.791	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.8	3.1	-170.8	0	0	0	0	0	118
241	K	36.3	Very low	31.5	Very low	188 Å²	188	148.8 Å²	148.8	82%	0.817	79%	0.79	S	S	*	*			trans	-113.9	34.4	-172.1	-78.5	-173.4	-175.6	165.7	0	115.6	I239	I239-K241 PolarHBondContact O-N 2.95Å
242	K	31.3	Very low	30.9	Very low	189 Å²	189	149.8 Å²	149.8	82%	0.822	79%	0.789	S	S	*	*			trans	-130.5	91.6	162.2	-72.7	-174.4	178.2	-177.9	0	108.3
243	H	28.6	Very low	30.4	Very low	191 Å²	191	146.1 Å²	146.1	88%	0.884	79%	0.788	S	S	*	*			trans	168.7	99.9	146.5	-89.3	-58.6	0	0	0	108.7
244	S	27.2	Very low	30.2	Very low	111 Å²	111	146.2 Å²	146.2	78%	0.776	79%	0.791	S	S	*	*			trans	164	85	137.6	58.2	0	0	0	0	110.4
245	D	25.6	Very low	29.8	Very low	172 Å²	172	143.5 Å²	143.5	92%	0.92	79%	0.79	S	S	*	*			trans	-123.2	117.4	145.3	-87.1	-30	0	0	0	106.2
246	P	29.8	Very low	29.5	Very low	106 Å²	106	146 Å²	146	69%	0.688	80%	0.802	S	S	*	*			trans	-110.4	128.8	161.3	25.5	-9.2	0	0	0	110.9
247	L	26.8	Very low	28.8	Very low	154 Å²	154	142.8 Å²	142.8	81%	0.806	79%	0.792	S	S	*	*			trans	74.2	97.3	145.7	-57.4	168.7	0	0	0	118.7
248	L	28.6	Very low	28.3	Very low	184 Å²	184	144.8 Å²	144.8	96%	0.963	80%	0.798	S	S	*	*				-138	105.8	129.3	-83.7	-177.1	0	0	0	110.1
249	L	30.2	Very low	27.8	Very low	137 Å²	137	146.5 Å²	146.5	72%	0.717	80%	0.801	S	S	*	*			trans	-90.1	130.1	165.9	-117.1	161.9	0	0	0	108.1
250	E	26.1	Very low	27.2	Very low	160 Å²	160	143.8 Å²	143.8	75%	0.748	80%	0.796	S	S	*	*			trans	62.3	139	143.8	-91.6	-175.9	155.5	0	0	118.9
251	R	26.8	Very low	27	Very low	197 Å²	197	147.7 Å²	147.7	74%	0.743	80%	0.798	S	S	*	*			cis	175.1	135.2	33.8	147.2	174.8	-172.9	161	0.4	108.3
252	N	22.9	Very low	26.9	Very low	145 Å²	145	144 Å²	144	78%	0.775	79%	0.793	S	S	*	*				-173.9	138	93.4	-91.4	-40.8	0	0	0	109.9
253	G	23.5	Very low	26.6	Very low	75 Å²	75	141.8 Å²	141.8	77%	0.773	79%	0.79	S	S	*	*			trans	-83.5	-150.4	-173.9	0	0	0	0	0	116.7
254	P	27.8	Very low	26.6	Very low	134 Å²	134	139.5 Å²	139.5	87%	0.87	79%	0.785	S	S	*	*			cis	-129.8	166.5	12.8	38.5	-20	0	0	0	117.4
255	M	24.5	Very low	26.7	Very low	177 Å²	177	140.3 Å²	140.3	87%	0.872	78%	0.779	S	S	*	*			trans	-82.7	150.2	171	-66.8	170.3	77.3	0	0	113
256	V	24.5	Very low	26.8	Very low	145 Å²	145	139.3 Å²	139.3	88%	0.879	77%	0.774	S	S	*	*			trans	-154.8	99.2	146.7	179.5	0	0	0	0	107.2
257	S	22.7	Very low	26.6	Very low	84 Å²	84	137.7 Å²	137.7	59%	0.587	78%	0.777	S	S	*	*				93.2	125.7	95.3	-171.8	0	0	0	0	115.3
258	P	27.7	Very low	26.6	Very low	129 Å²	129	138.1 Å²	138.1	84%	0.838	78%	0.78	S	S	*	*			trans	-113.3	110.7	150.9	32	-17.5	0	0	0	110.6
259	H	23.5	Very low	26.8	Very low	173 Å²	173	139.4 Å²	139.4	80%	0.801	78%	0.778	S	S	*	*			trans	-122.4	143.7	157.6	-91.4	-49.7	0	0	0	104.8
260	S	25.5	Very low	26.7	Very low	93 Å²	93	137.5 Å²	137.5	65%	0.65	78%	0.782	S	S	*	*			cis	176	163.9	21.2	37.4	0	0	0	0	108
261	L	28.1	Very low	26.9	Very low	157 Å²	157	138 Å²	138	82%	0.822	79%	0.786	S	S	*	*			trans	125.7	144.5	144.4	-71.9	172.8	0	0	0	116.2
262	P	33.6	Very low	26.8	Very low	111 Å²	111	137.6 Å²	137.6	72%	0.721	79%	0.793	S	S	*	*				-136.4	176.8	-100.8	41.6	-23.3	0	0	0	116.7
263	N	25.1	Very low	26.9	Very low	143 Å²	143	141.3 Å²	141.3	77%	0.765	80%	0.796	S	S	*	*			trans	-22.7	145.7	167.1	-74.4	-5.8	0	0	0	121.5
264	N	27.3	Very low	26.9	Very low	142 Å²	142	148.9 Å²	148.9	76%	0.759	80%	0.801	S	S	*	*				147.1	143.9	124.4	-81	-24.6	0	0	0	110
265	L	30.4	Very low	26.9	Very low	128 Å²	128	148.5 Å²	148.5	67%	0.67	80%	0.799	S	S	*	*			cis	-162.3	144.8	7.8	-141.3	89.9	0	0	0	108.3
266	D	26.7	Very low	27	Very low	152 Å²	152	144.9 Å²	144.9	81%	0.813	79%	0.791	S	S	*	*			trans	56	128.2	146.8	-64.9	-22	0	0	0	125.3
267	G	25.8	Very low	27.4	Very low	72 Å²	72	148.1 Å²	148.1	74%	0.742	79%	0.793	S	S	*	*			trans	141.5	94.4	138.6	0	0	0	0	0	119
268	N	26.6	Very low	28.1	Very low	163 Å²	163	149.3 Å²	149.3	87%	0.872	80%	0.797	S	S	*	*			trans	65.3	114.7	149.3	-83.3	-16.8	0	0	0	122.9
269	K	33.8	Very low	28.5	Very low	210 Å²	210	146 Å²	146	91%	0.913	79%	0.787	S	S	*	*			trans	22.6	103.3	146.8	-76	179.7	175.3	174.4	0	118.5
270	A	27	Very low	29.5	Very low	98 Å²	98	140 Å²	140	81%	0.81	76%	0.762	S	S	*	*			trans	-139.8	137.5	140.2	0	0	0	0	0	109.9	E272	A270-E272 PolarHBondContact O-N 3.06Å
271	M	31.7	Very low	30.8	Very low	170 Å²	170	139.1 Å²	139.1	84%	0.837	75%	0.75	S	S	*	*			trans	-62.8	103	-178.1	176.2	87.2	74.5	0	0	111.7	R273	M271-R273 HydrophobicContact CG-CG 4.2Å; M271-R273 PolarHBondContact O-N 3.3Å
272	E	24.5	Very low	32	Very low	189 Å²	189	137.7 Å²	137.7	88%	0.883	74%	0.74	S	S	*	*			trans	-86.6	99.4	160.5	-87	-172.2	163.1	0	0	109.8	A270 R274	A270-E272 PolarHBondContact O-N 3.06Å; E272-R274 PolarHBondContact O-N 3.39Å; E272-R274 VanDerWaalsContact O-N 3.13Å
273	R	25.3	Very low	33.1	Very low	222 Å²	222	137.6 Å²	137.6	84%	0.838	73%	0.734	S	S	*	*			trans	-62.7	107.8	163.2	-74.4	179	176.1	177.7	-0.9	108.1	M271	M271-R273 HydrophobicContact CG-CG 4.2Å; M271-R273 PolarHBondContact O-N 3.3Å
274	R	23.4	Very low	34.9	Very low	234 Å²	234	131.8 Å²	131.8	88%	0.883	70%	0.702	S	S	*	*	P	Polyproline II helix	trans	-53.7	132.1	159.4	-70.8	179	178.5	174.9	-0.6	108.2	E272 S276	E272-R274 PolarHBondContact O-N 3.39Å; E272-R274 VanDerWaalsContact O-N 3.13Å; R274-S276 PolarHBondContact O-N 2.8Å; R274-S276 VanDerWaalsContact O-N 3.07Å
275	P	27.9	Very low	36.6	Very low	127 Å²	127	128.6 Å²	128.6	83%	0.825	68%	0.683	S	S	*	*	P	Polyproline II helix	trans	-63.9	117.6	173	25.4	-29.7	0	0	0	107.8	K277	P275-K277 PolarHBondContact O-N 2.93Å
276	S	25.8	Very low	38	Very low	101 Å²	101	129.7 Å²	129.7	71%	0.706	68%	0.683	S	S	*	*	P	Polyproline II helix	trans	-54.5	124.3	171.9	45	0	0	0	0	108.9	R274 V278	R274-S276 PolarHBondContact O-N 2.8Å; R274-S276 VanDerWaalsContact O-N 3.07Å; S276-V278 PolarHBondContact O-N 2.95Å
277	K	32.2	Very low	40	Very low	212 Å²	212	127.2 Å²	127.2	92%	0.922	67%	0.665	S	S	*	*			trans	-52	106.1	167.4	-81.4	179.9	172.6	-179.6	0	108.6	P275 G279	P275-K277 PolarHBondContact O-N 2.93Å; K277-G279 PolarHBondContact O-N 3.47Å
278	V	38.2	Very low	42.2	Very low	110 Å²	110	124.7 Å²	124.7	67%	0.667	63%	0.634	S	S	*	*			trans	-59.6	120.6	168.2	-179.7	0	0	0	0	106.6	S276 V280	S276-V278 PolarHBondContact O-N 2.95Å; V278-V280 PolarHBondContact O-N 2.89Å
279	G	35.9	Very low	44.2	Very low	60 Å²	60	118.7 Å²	118.7	62%	0.619	60%	0.604	S	S	*	*			trans	-72.7	88.7	-179.1	0	0	0	0	0	110.3	K277	K277-G279 PolarHBondContact O-N 3.47Å
280	V	45.7	Very low	45.8	Very low	47 Å²	47	115.2 Å²	115.2	29%	0.285	60%	0.602	S	S	.	*			trans	-63.5	134.9	175.3	-171.6	0	0	0	0	109.9	V278 M282 M285	V278-V280 PolarHBondContact O-N 2.89Å; V280-M282 PolarHBondContact O-N 3.46Å; V280-M285 HydrophobicContact CG1-CG 4.2Å
281	D	51.4	Low	48	Very low	74 Å²	74	113.1 Å²	113.1	40%	0.396	59%	0.591	S	S	.	*			trans	-68.3	96.3	177.8	-162.5	-11.1	0	0	0	110.9	N283 F284 M285	D281-N283 PolarHBondContact O-N 2.99Å; D281-N283 PolarHBondContact OD1-N 3.15Å; D281-F284 PolarHBondContact O-N 3.09Å; D281-F284 VanDerWaalsContact O-N 3.13Å; D281-M285 PolarHBondContact O-N 3.38Å
282	M	53.5	Low	50.4	Low	126 Å²	126	105.4 Å²	105.4	62%	0.621	55%	0.554	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.5	-13	-177.2	-67.6	-72.6	157.9	0	0	113.9	V280	V280-M282 PolarHBondContact O-N 3.46Å
283	N	56.3	Low	53.5	Low	109 Å²	109	97.5 Å²	97.5	58%	0.583	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.6	-33.3	178	-68.5	-30	0	0	0	112.5	D281	D281-N283 PolarHBondContact O-N 2.99Å; D281-N283 PolarHBondContact OD1-N 3.15Å
284	F	62.9	Low	56.5	Low	22 Å²	22	87 Å²	87	10%	0.096	48%	0.477	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.9	-38.2	176.7	-172.4	-107.2	0	0	0	111.5	F115 D281 K286 K287 I288 V327	F115-F284 AromaticContact CE2-CE1 3.97Å; F115-F284 HydrophobicContact CE2-CE1 3.97Å; F115-F284 AromaticContact CE2-CZ 3.9Å; F115-F284 HydrophobicContact CE2-CZ 3.9Å; F115-F284 HydrophobicContact CZ-CE1 4.16Å; F115-F284 HydrophobicContact CZ-CZ 4.44Å; D281-F284 PolarHBondContact O-N 3.09Å; D281-F284 VanDerWaalsContact O-N 3.13Å; F284-K286 PolarHBondContact O-N 3.42Å; F284-K287 HydrophobicContact CD2-CD 3.89Å; F284-K287 HydrophobicContact CE2-CD 4.33Å; F284-K287 WeakPolarHBondContact O-CA 3.46Å; F284-K287 VanDerWaalsContact O-CB 3.28Å; F284-K287 WeakPolarHBondContact O-CB 3.09Å; F284-K287 PolarHBondContact O-N 2.95Å; F284-I288 HydrophobicContact CD1-CD1 4.13Å; F284-I288 HydrophobicContact CE1-CD1 3.89Å; F284-I288 HydrophobicContact CE1-CG1 4.33Å; F284-V327 HydrophobicContact CD1-CG2 3.69Å; F284-V327 HydrophobicContact CE1-CG2 3.85Å
285	M	63	Low	59.8	Low	74 Å²	74	76 Å²	76	37%	0.365	44%	0.436	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.4	-30.4	172.1	-83.5	-70.2	-75.9	0	0	114.4	V280 D281 K287 V327 P328	V280-M285 HydrophobicContact CG1-CG 4.2Å; D281-M285 PolarHBondContact O-N 3.38Å; M285-K287 VanDerWaalsContact C-N 3.28Å; M285-K287 PolarHBondContact O-N 2.74Å; M285-V327 HydrophobicContact CG-CG1 3.99Å; M285-V327 HydrophobicContact SD-CG1 3.09Å; M285-V327 WeakPolarHBondContact SD-CG1 3.44Å; M285-P328 HydrophobicContact CE-CG 4.46Å; M285-P328 HydrophobicContact SD-CG 4.47Å
286	K	60.4	Low	62.9	Low	152 Å²	152	69.9 Å²	69.9	66%	0.661	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.8	-16.1	176.5	-72.4	174.4	-174	163.8	0	113.9	F284	F284-K286 PolarHBondContact O-N 3.42Å
287	K	67.9	Low	66.1	Low	100 Å²	100	65.1 Å²	65.1	44%	0.435	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.2	-24.9	179.1	-58.5	-179.2	-177.2	176	0	111.9	F284 M285 P863	F284-K287 HydrophobicContact CD2-CD 3.89Å; F284-K287 HydrophobicContact CE2-CD 4.33Å; F284-K287 WeakPolarHBondContact O-CA 3.46Å; F284-K287 VanDerWaalsContact O-CB 3.28Å; F284-K287 WeakPolarHBondContact O-CB 3.09Å; F284-K287 PolarHBondContact O-N 2.95Å; M285-K287 VanDerWaalsContact C-N 3.28Å; M285-K287 PolarHBondContact O-N 2.74Å; K287-P863 HydrophobicContact CD-CG 4.09Å
288	I	72.3	Confident	69	Low	18 Å²	18	55.1 Å²	55.1	9%	0.092	32%	0.32	C	S	.	.	S	Bend	trans	-80.5	134	180	-59.2	169.4	0	0	0	109.5	L138 F284 A292 V327 V329	L138-I288 HydrophobicContact CD1-CG1 4.43Å; F284-I288 HydrophobicContact CD1-CD1 4.13Å; F284-I288 HydrophobicContact CE1-CD1 3.89Å; F284-I288 HydrophobicContact CE1-CG1 4.33Å; I288-A292 HydrophobicContact CG2-CB 3.52Å; I288-V327 HydrophobicContact CD1-CB 4.35Å; I288-V327 HydrophobicContact CD1-CG1 3.78Å; I288-V327 HydrophobicContact CD1-CG2 4.31Å; I288-V329 HydrophobicContact CD1-CG2 4.26Å
289	P	69.8	Low	71.6	Confident	37 Å²	37	50 Å²	50	24%	0.24	29%	0.289	C	S	.	.	P	Polyproline II helix	trans	-58.3	144.3	175.4	-23.6	33.8	0	0	0	112.8	D113 G291 A292	D113-P289 HydrophobicContact CB-CB 4.12Å; D113-P289 HydrophobicContact CB-CG 3.94Å; D113-P289 WeakPolarHBondContact OD2-CB 3.24Å; D113-P289 WeakPolarHBondContact OD2-CG 3.27Å; P289-G291 PolarHBondContact O-N 2.76Å; P289-A292 WeakPolarHBondContact O-CB 3.27Å; P289-A292 PolarHBondContact O-N 2.88Å
290	P	66.2	Low	74.1	Confident	137 Å²	137	47.4 Å²	47.4	89%	0.89	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.1	124.2	177.1	27.6	-33.1	0	0	0	110.6
291	G	72.9	Confident	76.1	Confident	55 Å²	55	47 Å²	47	57%	0.567	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.4	23	-176.4	0	0	0	0	0	114.2	H112 P289	H112-G291 PolarHBondContact ND1-O 2.81Å; P289-G291 PolarHBondContact O-N 2.76Å
292	A	82.8	Confident	77.8	Confident	7 Å²	7	43.5 Å²	43.5	6%	0.058	24%	0.239	C	C	.	.			trans	-68.1	152.1	168.6	0	0	0	0	0	111.7	D113 I288 P289 V329	D113-A292 HydrophobicContact CB-CB 4.49Å; D113-A292 CarbonylContact O-C 3.6Å; D113-A292 WeakPolarHBondContact O-CA 3.39Å; D113-A292 VanDerWaalsContact O-CB 3.27Å; D113-A292 WeakPolarHBondContact O-CB 3.5Å; I288-A292 HydrophobicContact CG2-CB 3.52Å; P289-A292 WeakPolarHBondContact O-CB 3.27Å; P289-A292 PolarHBondContact O-N 2.88Å; A292-V329 VanDerWaalsContact O-CG1 3.25Å; A292-V329 WeakPolarHBondContact O-CG1 3.4Å
293	E	89.2	Confident	79.2	Confident	23 Å²	23	42.9 Å²	42.9	11%	0.107	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	157.6	174.2	-63.5	-175.7	171.5	0	0	109.7	H112 D113 L114 F115 A318 P330 R332 Y368	H112-E293 HydrophobicContact CB-CB 4.49Å; H112-E293 HydrophobicContact CB-CG 3.9Å; H112-E293 IonicContact CD2-OE1 2.74Å; H112-E293 IonicContact CG-OE1 2.63Å; D113-E293 PolarHBondContact O-N 3.4Å; L114-E293 CarbonylContact C-O 3.59Å; L114-E293 VanDerWaalsContact CA-O 3.3Å; L114-E293 WeakPolarHBondContact CA-O 3.4Å; L114-E293 HydrophobicContact CD2-CB 3.97Å; F115-E293 PolarHBondContact N-O 2.86Å; E293-A318 HydrophobicContact CG-CB 4.37Å; E293-P330 CarbonylContact C-O 3.55Å; E293-P330 WeakPolarHBondContact CA-O 3.26Å; E293-R332 HydrophobicContact CB-CB 4.06Å; E293-R332 WeakPolarHBondContact OE2-CB 3.25Å; E293-R332 WeakPolarHBondContact OE2-CD 3.48Å; E293-R332 WeakPolarHBondContact OE2-CG 3.46Å; E293-Y368 PolarHBondContact OE2-OH 3.09Å
294	A	89.4	Confident	80.5	Confident	1 Å²	1	40.3 Å²	40.3	1%	0.008	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	145.7	-179.6	0	0	0	0	0	112	F115 T325 V329 P330 T331 R332 F333	F115-A294 CarbonylContact O-C 3.59Å; F115-A294 VanDerWaalsContact O-CA 3.27Å; F115-A294 WeakPolarHBondContact O-CA 3.35Å; A294-T325 HydrophobicContact CB-CG2 3.95Å; A294-V329 HydrophobicContact CB-CB 4.19Å; A294-V329 HydrophobicContact CB-CG1 4Å; A294-P330 PolarHBondContact N-O 3.18Å; A294-T331 WeakPolarHBondContact O-CA 3.33Å; A294-R332 PolarHBondContact O-N 3.49Å; A294-F333 PolarHBondContact O-N 2.97Å
295	S	92.4	Very high	81.6	Confident	3 Å²	3	39.7 Å²	39.7	2%	0.021	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	105.5	172	171	0	0	0	0	108.7	F115 T116 E117 F333	F115-S295 PolarHBondContact O-N 3.18Å; T116-S295 VanDerWaalsContact CA-O 3.3Å; T116-S295 WeakPolarHBondContact CA-O 3.3Å; E117-S295 PolarHBondContact N-O 3.21Å; S295-F333 WeakPolarHBondContact CA-O 3.38Å
296	N	92.3	Very high	82.5	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	130.2	-177	-69.9	99.1	0	0	0	110.6	L324 T325 T331 F333 L334 F335	N296-L324 HydrophobicContact CB-CD2 4.27Å; N296-L324 HydrophobicContact CB-CG 4.48Å; N296-T325 WeakPolarHBondContact ND2-CG2 3.49Å; N296-T325 WeakPolarHBondContact OD1-CG2 3.47Å; N296-T331 HydrophobicContact CB-CG2 4.49Å; N296-T331 WeakPolarHBondContact OD1-CG2 3.34Å; N296-T331 PolarHBondContact OD1-OG1 3.13Å; N296-F333 PolarHBondContact N-O 3.03Å; N296-L334 HydrophobicContact CB-CD1 3.69Å; N296-L334 CarbonylContact O-C 3.58Å; N296-L334 WeakPolarHBondContact O-CA 3.27Å; N296-F335 PolarHBondContact O-N 3.39Å
297	V	94.1	Very high	83.6	Confident	1 Å²	1	43.9 Å²	43.9	1%	0.006	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	113.6	177.4	-173.6	0	0	0	0	107.8	E117 L118 D119 V299 F335 A355	E117-V297 PolarHBondContact O-N 3.32Å; L118-V297 WeakPolarHBondContact CA-O 3.45Å; L118-V297 HydrophobicContact CD1-CB 3.86Å; L118-V297 HydrophobicContact CD1-CG1 3.51Å; D119-V297 PolarHBondContact N-O 3.48Å; V297-V299 HydrophobicContact CG1-CG2 4.24Å; V297-F335 HydrophobicContact CG1-CB 4.41Å; V297-F335 HydrophobicContact CG1-CD1 3.75Å; V297-F335 HydrophobicContact CG1-CG 4.49Å; V297-A355 HydrophobicContact CG2-CB 4.04Å
298	L	92.6	Very high	84.6	Confident	1 Å²	1	42.2 Å²	42.2	1%	0.005	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	117.7	-176.3	-56.2	-173.4	0	0	0	109.5	D119 W131 L334 F335 L336 L337	D119-L298 HydrophobicContact CB-CD2 3.69Å; W131-L298 HydrophobicContact CE3-CB 4.42Å; W131-L298 HydrophobicContact CE3-CD2 4.41Å; W131-L298 HydrophobicContact CH2-CB 3.77Å; W131-L298 HydrophobicContact CZ2-CB 4.4Å; W131-L298 HydrophobicContact CZ3-CB 3.78Å; L298-L334 HydrophobicContact CD1-CD1 3.84Å; L298-L334 HydrophobicContact CG-CD1 3.97Å; L298-F335 PolarHBondContact N-O 3.01Å; L298-L336 HydrophobicContact CB-CD1 3.8Å; L298-L336 HydrophobicContact CD1-CD1 4.31Å; L298-L336 CarbonylContact O-C 3.51Å; L298-L336 WeakPolarHBondContact O-CA 3.3Å; L298-L337 PolarHBondContact O-N 3.38Å
299	V	92.8	Very high	85.4	Confident	4 Å²	4	41.6 Å²	41.6	2%	0.024	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	132.8	-178.7	-178.9	0	0	0	0	111.7	L118 D119 E120 L121 W131 V297 L337 Y347	L118-V299 HydrophobicContact CD1-CB 4.46Å; L118-V299 HydrophobicContact CD1-CG2 3.8Å; D119-V299 PolarHBondContact O-N 2.79Å; E120-V299 CarbonylContact C-O 3.59Å; E120-V299 VanDerWaalsContact CA-O 3.22Å; E120-V299 WeakPolarHBondContact CA-O 3.3Å; L121-V299 PolarHBondContact N-O 2.91Å; W131-V299 VanDerWaalsContact CZ3-O 3.3Å; W131-V299 WeakPolarHBondContact CZ3-O 3.18Å; V297-V299 HydrophobicContact CG1-CG2 4.24Å; V299-L337 CarbonylContact C-O 3.57Å; V299-L337 WeakPolarHBondContact CA-O 3.38Å; V299-L337 HydrophobicContact CG1-CD2 4.33Å; V299-L337 HydrophobicContact CG2-CB 4.37Å; V299-Y347 VanDerWaalsContact CG1-C 3.46Å; V299-Y347 WeakPolarHBondContact CG1-O 3.38Å
300	G	88.6	Confident	86.5	Confident	4 Å²	4	40.5 Å²	40.5	4%	0.041	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.4	150.6	178.6	0	0	0	0	0	115	L337 L338 G339	G300-L337 PolarHBondContact N-O 3.26Å; G300-L338 CarbonylContact O-C 3.53Å; G300-L338 VanDerWaalsContact O-CA 3.31Å; G300-L338 WeakPolarHBondContact O-CA 3.42Å; G300-G339 PolarHBondContact O-N 3.09Å
301	E	88.1	Confident	87.7	Confident	38 Å²	38	34 Å²	34	18%	0.178	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	154.6	162.3	-61.1	-167.4	135.3	0	0	109.9	F123 G339 H341 G342 K343 G344 Y347	F123-E301 HydrophobicContact CE2-CB 4.06Å; F123-E301 WeakPolarHBondContact CE2-O 3.24Å; F123-E301 WeakPolarHBondContact CZ-O 3.29Å; E301-G339 CarbonylContact C-O 3.59Å; E301-G339 VanDerWaalsContact CA-O 3.3Å; E301-G339 WeakPolarHBondContact CA-O 3.33Å; E301-H341 IonicContact OE2-CE1 3.22Å; E301-H341 IonicContact OE2-CG 3.2Å; E301-H341 IonicContact OE2-ND1 3.14Å; E301-H341 PolarHBondContact OE2-ND1 3.42Å; E301-G342 PolarHBondContact OE1-N 2.77Å; E301-K343 PolarHBondContact OE1-N 2.73Å; E301-G344 WeakPolarHBondContact OE1-CA 3.47Å; E301-G344 PolarHBondContact OE1-N 3.03Å; E301-Y347 HydrophobicContact CG-CD2 4.05Å; E301-Y347 HydrophobicContact CG-CE2 4.28Å
302	V	86.1	Confident	88.7	Confident	2 Å²	2	31.6 Å²	31.6	1%	0.012	16%	0.158	C	C	.	.			trans	-150.9	138.4	172.2	-74	0	0	0	0	111.4	L121 F304 L305 L338 G339 H341	L121-V302 HydrophobicContact CD2-CG1 3.97Å; V302-F304 VanDerWaalsContact C-N 3.29Å; V302-F304 HydrophobicContact CB-CD1 4.11Å; V302-F304 HydrophobicContact CB-CE1 3.71Å; V302-F304 HydrophobicContact CB-CE2 4.44Å; V302-F304 HydrophobicContact CB-CZ 3.89Å; V302-F304 HydrophobicContact CG1-CE1 3.78Å; V302-F304 HydrophobicContact CG1-CZ 3.86Å; V302-F304 HydrophobicContact CG2-CE1 4.37Å; V302-F304 HydrophobicContact CG2-CE2 4.23Å; V302-F304 HydrophobicContact CG2-CZ 4.09Å; V302-F304 PolarHBondContact O-N 3.4Å; V302-L305 HydrophobicContact CG2-CB 3.84Å; V302-L305 HydrophobicContact CG2-CD1 3.32Å; V302-L305 HydrophobicContact CG2-CG 3.44Å; V302-L305 VanDerWaalsContact CG2-CG 3.44Å; V302-L338 HydrophobicContact CG2-CB 4.46Å; V302-G339 PolarHBondContact N-O 2.87Å; V302-H341 VanDerWaalsContact C-CD2 3.42Å
303	D	83.3	Confident	89.2	Confident	113 Å²	113	31.4 Å²	31.4	60%	0.604	16%	0.156	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.9	-21.7	-178	-64.9	-60.8	0	0	0	115.1	H341	D303-H341 VanDerWaalsContact CG-NE2 3.34Å; D303-H341 PolarHBondContact N-CD2 3.03Å; D303-H341 VanDerWaalsContact N-CD2 3.29Å; D303-H341 PolarHBondContact N-NE2 3.48Å; D303-H341 IonicContact OD1-CD2 2.86Å; D303-H341 PolarHBondContact OD1-CD2 2.99Å; D303-H341 IonicContact OD1-CG 3.89Å; D303-H341 IonicContact OD1-NE2 3.83Å; D303-H341 PolarHBondContact OD1-NE2 3.48Å; D303-H341 VanDerWaalsContact OD1-NE2 3.11Å; D303-H341 IonicContact OD2-NE2 3.88Å
304	F	84.3	Confident	89.4	Confident	54 Å²	54	30.5 Å²	30.5	24%	0.237	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.6	-5.3	-169.9	59	-100.1	0	0	0	114.5	L206 K209 V210 V302	L206-F304 HydrophobicContact CD2-CB 4.4Å; L206-F304 HydrophobicContact CD2-CD2 4.13Å; K209-F304 HydrophobicContact CB-CD1 4.2Å; K209-F304 HydrophobicContact CB-CD2 4.01Å; K209-F304 HydrophobicContact CB-CE1 3.95Å; K209-F304 HydrophobicContact CB-CE2 3.76Å; K209-F304 HydrophobicContact CB-CG 4.22Å; K209-F304 HydrophobicContact CB-CZ 3.73Å; K209-F304 HydrophobicContact CD-CB 3.99Å; K209-F304 HydrophobicContact CD-CD1 4.1Å; K209-F304 HydrophobicContact CD-CD2 4.16Å; K209-F304 HydrophobicContact CD-CG 3.81Å; V210-F304 HydrophobicContact CG2-CE2 3.82Å; V210-F304 HydrophobicContact CG2-CZ 4.43Å; V302-F304 VanDerWaalsContact C-N 3.29Å; V302-F304 HydrophobicContact CB-CD1 4.11Å; V302-F304 HydrophobicContact CB-CE1 3.71Å; V302-F304 HydrophobicContact CB-CE2 4.44Å; V302-F304 HydrophobicContact CB-CZ 3.89Å; V302-F304 HydrophobicContact CG1-CE1 3.78Å; V302-F304 HydrophobicContact CG1-CZ 3.86Å; V302-F304 HydrophobicContact CG2-CE1 4.37Å; V302-F304 HydrophobicContact CG2-CE2 4.23Å; V302-F304 HydrophobicContact CG2-CZ 4.09Å; V302-F304 PolarHBondContact O-N 3.4Å
305	L	84.9	Confident	89.5	Confident	9 Å²	9	30.5 Å²	30.5	5%	0.047	15%	0.151	C	C	.	.			trans	-96.3	132.1	177.6	-67.8	-177.9	0	0	0	110.6	L202 L206 V210 V302 I309 L338 P340	L202-L305 HydrophobicContact CD1-CD2 4.3Å; L206-L305 HydrophobicContact CD1-CD2 4.2Å; V210-L305 HydrophobicContact CG2-CD2 4.37Å; V302-L305 HydrophobicContact CG2-CB 3.84Å; V302-L305 HydrophobicContact CG2-CD1 3.32Å; V302-L305 HydrophobicContact CG2-CG 3.44Å; V302-L305 VanDerWaalsContact CG2-CG 3.44Å; L305-I309 HydrophobicContact CD1-CB 4.5Å; L305-I309 HydrophobicContact CD1-CD1 3.64Å; L305-I309 HydrophobicContact CD1-CG1 4.01Å; L305-I309 HydrophobicContact CD2-CD1 3.52Å; L305-I309 HydrophobicContact CD2-CG1 4.39Å; L305-I309 HydrophobicContact CG-CD1 4.26Å; L305-L338 HydrophobicContact CD1-CB 3.92Å; L305-P340 WeakPolarHBondContact O-CB 3.31Å
306	E	82.3	Confident	89.1	Confident	155 Å²	155	30.6 Å²	30.6	72%	0.724	15%	0.152	S	C	*	.	S	Bend	trans	-86.8	-23.7	172.4	-66.7	170.9	169.5	0	0	112	K203	K203-E306 IonicContact NZ-OE2 3.22Å; K203-E306 PolarHBondContact NZ-OE2 2.69Å
307	K	84.3	Confident	88.8	Confident	160 Å²	160	34.6 Å²	34.6	70%	0.696	18%	0.178	S	C	*	.	S	Bend	trans	-135.1	147.3	-178.2	-66.5	-176.9	-178.6	179.6	0	109.9
308	P	87.8	Confident	88.4	Confident	64 Å²	64	35.8 Å²	35.8	42%	0.416	19%	0.188	S	C	.	.			trans	-68.5	143.8	176.7	29.5	-34.5	0	0	0	111.7	L337 L338	P308-L337 HydrophobicContact CB-CD1 4.47Å; P308-L338 CarbonylContact C-O 3.39Å; P308-L338 VanDerWaalsContact CA-O 3.27Å; P308-L338 WeakPolarHBondContact CA-O 3.42Å
309	I	89.8	Confident	88.2	Confident	5 Å²	5	36.8 Å²	36.8	3%	0.026	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	130.6	177.9	-63.1	174.8	0	0	0	108	M196 L202 V210 L305 L337 L338	M196-I309 HydrophobicContact CE-CG2 3.24Å; M196-I309 HydrophobicContact CG-CG2 4.39Å; M196-I309 HydrophobicContact SD-CG2 3.28Å; M196-I309 WeakPolarHBondContact SD-CG2 3.37Å; L202-I309 HydrophobicContact CD1-CD1 3.67Å; V210-I309 HydrophobicContact CG2-CD1 4.28Å; L305-I309 HydrophobicContact CD1-CB 4.5Å; L305-I309 HydrophobicContact CD1-CD1 3.64Å; L305-I309 HydrophobicContact CD1-CG1 4.01Å; L305-I309 HydrophobicContact CD2-CD1 3.52Å; L305-I309 HydrophobicContact CD2-CG1 4.39Å; L305-I309 HydrophobicContact CG-CD1 4.26Å; I309-L337 WeakPolarHBondContact O-CA 3.16Å; I309-L338 PolarHBondContact N-O 3.4Å; I309-L338 PolarHBondContact O-N 3.08Å
310	I	91.9	Very high	87.8	Confident	14 Å²	14	40.9 Å²	40.9	7%	0.072	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	132.5	-179.3	-60	120.1	0	0	0	109.8	C170 T175 F335 L336 L337	C170-I310 HydrophobicContact CB-CD1 3.62Å; C170-I310 HydrophobicContact CB-CG1 3.85Å; C170-I310 HydrophobicContact CB-CG2 4.19Å; T175-I310 PolarHBondContact N-O 2.79Å; I310-F335 HydrophobicContact CG2-CE2 3.94Å; I310-F335 HydrophobicContact CG2-CZ 4.22Å; I310-L336 CarbonylContact C-O 3.6Å; I310-L336 VanDerWaalsContact CA-O 3.31Å; I310-L336 WeakPolarHBondContact CA-O 3.15Å; I310-L337 HydrophobicContact CD1-CD1 4.29Å; I310-L337 HydrophobicContact CG1-CD1 3.51Å
311	A	92.3	Very high	87.6	Confident	2 Å²	2	41.2 Å²	41.2	2%	0.017	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	130.7	169.7	0	0	0	0	0	110.8	T175 V192 M196 F335 L336	T175-A311 CarbonylContact O-C 3.52Å; T175-A311 VanDerWaalsContact O-CA 3.3Å; T175-A311 WeakPolarHBondContact O-CA 3.48Å; V192-A311 HydrophobicContact CG1-CB 3.6Å; M196-A311 HydrophobicContact CE-CB 3.41Å; M196-A311 VanDerWaalsContact CE-CB 3.41Å; A311-F335 CarbonylContact O-C 3.53Å; A311-F335 WeakPolarHBondContact O-CA 3.11Å; A311-L336 HydrophobicContact CB-CB 4.08Å; A311-L336 PolarHBondContact N-O 2.92Å; A311-L336 PolarHBondContact O-N 3.13Å
312	F	94.5	Very high	87	Confident	4 Å²	4	45.7 Å²	45.7	2%	0.018	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	120.8	164.9	-179.7	-100	0	0	0	109.3	T175 V176 M177 L178 F333 F335 M354 L376	T175-F312 PolarHBondContact O-N 3.14Å; V176-F312 WeakPolarHBondContact CA-O 3.09Å; V176-F312 HydrophobicContact CG1-CD1 4.24Å; V176-F312 HydrophobicContact CG2-CB 4.44Å; M177-F312 PolarHBondContact N-O 2.88Å; L178-F312 HydrophobicContact CD2-CD1 4.33Å; L178-F312 HydrophobicContact CD2-CE1 4.03Å; F312-F333 HydrophobicContact CE2-CD1 4.42Å; F312-F333 AromaticContact CZ-CD1 3.83Å; F312-F333 HydrophobicContact CZ-CD1 3.83Å; F312-F333 HydrophobicContact CZ-CE1 4.35Å; F312-F335 HydrophobicContact CB-CD2 4.46Å; F312-F335 HydrophobicContact CD2-CD2 4.17Å; F312-M354 HydrophobicContact CD2-CE 3.51Å; F312-M354 HydrophobicContact CE2-CE 3.19Å; F312-M354 HydrophobicContact CZ-CE 4.21Å; F312-L376 HydrophobicContact CD1-CD1 3.59Å; F312-L376 HydrophobicContact CE1-CD1 3.5Å; F312-L376 VanDerWaalsContact CE1-CD1 3.5Å; F312-L376 HydrophobicContact CE1-CD2 4.22Å; F312-L376 HydrophobicContact CZ-CD1 4.38Å; F312-L376 HydrophobicContact CZ-CD2 4.5Å
313	V	93.3	Very high	86.3	Confident	2 Å²	2	47.9 Å²	47.9	1%	0.012	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	128.7	-174.2	-177.8	0	0	0	0	110.1	M177 M180 V192 L315 F333 L334	M177-V313 WeakPolarHBondContact O-CA 3.32Å; M180-V313 HydrophobicContact CB-CG1 4.1Å; M180-V313 HydrophobicContact CE-CG1 3.82Å; M180-V313 HydrophobicContact CE-CG2 4.33Å; M180-V313 HydrophobicContact CG-CG1 4.47Å; M180-V313 HydrophobicContact SD-CG1 3.55Å; M180-V313 VanDerWaalsContact SD-CG1 3.55Å; V192-V313 HydrophobicContact CG2-CG2 3.65Å; V313-L315 HydrophobicContact CG1-CD2 4.21Å; V313-F333 WeakPolarHBondContact O-CA 3.28Å; V313-L334 HydrophobicContact CB-CB 4.25Å; V313-L334 PolarHBondContact N-O 3.44Å; V313-L334 PolarHBondContact O-N 3.16Å
314	R	92.8	Very high	86.2	Confident	4 Å²	4	42.7 Å²	42.7	2%	0.015	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	120.5	166.1	179.4	178.1	77.7	-155.2	0.3	109.3	M177 L178 D179 M180 F333 A367 Y368 A370	M177-R314 PolarHBondContact O-N 3.39Å; L178-R314 HydrophobicContact CD2-CB 3.94Å; D179-R314 CarbonylContact C-O 3.33Å; D179-R314 WeakPolarHBondContact CA-O 3.34Å; D179-R314 PolarHBondContact N-O 3.44Å; D179-R314 IonicContact OD1-CZ 2.97Å; D179-R314 VanDerWaalsContact OD1-CZ 3.28Å; D179-R314 IonicContact OD1-NE 3.92Å; D179-R314 PolarHBondContact OD1-NE 3.45Å; D179-R314 IonicContact OD1-NH2 3.25Å; D179-R314 PolarHBondContact OD1-NH2 3.43Å; D179-R314 IonicContact OD2-CZ 2.84Å; D179-R314 IonicContact OD2-NH2 3.2Å; D179-R314 PolarHBondContact OD2-NH2 2.9Å; M180-R314 PolarHBondContact N-O 2.67Å; R314-F333 HydrophobicContact CB-CD1 4.13Å; R314-F333 HydrophobicContact CB-CE1 4.11Å; R314-F333 HydrophobicContact CG-CD1 4.15Å; R314-F333 HydrophobicContact CG-CE1 3.76Å; R314-F333 HydrophobicContact CG-CZ 4.5Å; R314-A367 PolarHBondContact NH1-O 3.47Å; R314-Y368 PolarHBondContact NH1-O 3.47Å; R314-A370 VanDerWaalsContact CZ-O 3.3Å; R314-A370 PolarHBondContact NH1-O 3.01Å; R314-A370 PolarHBondContact NH2-O 3.19Å
315	L	90.5	Very high	85.9	Confident	1 Å²	1	40.7 Å²	40.7	1%	0.005	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85	144.7	178.8	-64.5	171.7	0	0	0	111.7	M180 A182 I188 V313 R332	M180-L315 HydrophobicContact CB-CD2 4.19Å; M180-L315 HydrophobicContact CG-CD2 4.14Å; M180-L315 CarbonylContact O-C 3.39Å; M180-L315 VanDerWaalsContact O-CA 3.27Å; M180-L315 WeakPolarHBondContact O-CA 3.39Å; M180-L315 HydrophobicContact SD-CD2 4.12Å; A182-L315 HydrophobicContact CB-CD2 4.14Å; I188-L315 HydrophobicContact CD1-CD1 3.96Å; I188-L315 HydrophobicContact CD1-CD2 3.87Å; I188-L315 HydrophobicContact CD1-CG 4.5Å; I188-L315 HydrophobicContact CG1-CD2 4.07Å; V313-L315 HydrophobicContact CG1-CD2 4.21Å; L315-R332 PolarHBondContact N-O 3.31Å; L315-R332 VanDerWaalsContact O-CD 3.24Å; L315-R332 WeakPolarHBondContact O-CD 3.47Å; L315-R332 PolarHBondContact O-NE 3.07Å; L315-R332 VanDerWaalsContact O-NE 3.13Å; L315-R332 PolarHBondContact O-NH1 2.97Å
316	S	84.9	Confident	85.3	Confident	6 Å²	6	41.7 Å²	41.7	4%	0.042	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	109.1	169.6	-174.4	0	0	0	0	110.2	M180 R181	M180-S316 PolarHBondContact O-N 2.75Å; R181-S316 WeakPolarHBondContact CG-O 3.33Å
317	P	85.9	Confident	85	Confident	83 Å²	83	34.5 Å²	34.5	54%	0.539	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	cis	-77.5	175	-0.8	33.8	-37.3	0	0	0	114.1	V319	P317-V319 WeakPolarHBondContact O-CG2 3.3Å
318	A	85.8	Confident	84.7	Confident	26 Å²	26	30 Å²	30	22%	0.215	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68	133.3	169.9	0	0	0	0	0	110.6	E293 P330 T331 R332	E293-A318 HydrophobicContact CG-CB 4.37Å; A318-P330 HydrophobicContact CB-CB 4.02Å; A318-P330 HydrophobicContact CB-CG 4.48Å; A318-T331 WeakPolarHBondContact CA-O 3.24Å; A318-R332 HydrophobicContact CB-CB 4.23Å
319	V	87.7	Confident	84.5	Confident	22 Å²	22	27.3 Å²	27.3	13%	0.133	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	137.1	-170.9	178.5	0	0	0	0	111.2	A182 P317 I321 P330 T331	A182-V319 WeakPolarHBondContact O-CG2 3.23Å; P317-V319 WeakPolarHBondContact O-CG2 3.3Å; V319-I321 HydrophobicContact CG1-CG1 4.46Å; V319-I321 PolarHBondContact O-N 3.01Å; V319-I321 VanDerWaalsContact O-N 3.17Å; V319-P330 CarbonylContact O-C 3.6Å; V319-T331 PolarHBondContact N-O 3.09Å; V319-T331 PolarHBondContact O-N 2.91Å
320	L	85.1	Confident	84.5	Confident	91 Å²	91	29.2 Å²	29.2	48%	0.476	19%	0.187	S	C	.	.			trans	-77.6	98.5	173.1	-175.6	71.5	0	0	0	110.1	T322 P328	L320-T322 PolarHBondContact O-N 3.05Å; L320-P328 VanDerWaalsContact CD1-C 3.46Å; L320-P328 HydrophobicContact CD1-CB 4.06Å
321	I	84.2	Confident	84.4	Confident	10 Å²	10	28.6 Å²	28.6	5%	0.051	18%	0.184	C	C	.	.			trans	-87	109.1	176.3	-57.3	174	0	0	0	108.6	I185 I188 V319 G323 L324	I185-I321 HydrophobicContact CB-CG2 3.99Å; I185-I321 HydrophobicContact CG2-CG2 4.44Å; I188-I321 HydrophobicContact CD1-CD1 3.67Å; V319-I321 HydrophobicContact CG1-CG1 4.46Å; V319-I321 PolarHBondContact O-N 3.01Å; V319-I321 VanDerWaalsContact O-N 3.17Å; I321-G323 PolarHBondContact O-N 2.83Å; I321-L324 HydrophobicContact CB-CB 4.02Å; I321-L324 HydrophobicContact CB-CD2 4.11Å; I321-L324 HydrophobicContact CD1-CD2 3.78Å; I321-L324 HydrophobicContact CG2-CB 3.73Å; I321-L324 HydrophobicContact CG2-CD2 4.12Å; I321-L324 PolarHBondContact O-N 2.83Å
322	T	76	Confident	84.3	Confident	132 Å²	132	28.8 Å²	28.8	81%	0.81	18%	0.184	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.6	122	-177.8	52.6	0	0	0	0	111.3	L320	L320-T322 PolarHBondContact O-N 3.05Å
323	G	71.6	Confident	84.3	Confident	48 Å²	48	28.6 Å²	28.6	50%	0.495	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	94.4	-9.9	175.5	0	0	0	0	0	114.9	H218 H220 I321	H218-G323 WeakPolarHBondContact CB-O 3.45Å; H220-G323 PolarHBondContact NE2-O 3.47Å; I321-G323 PolarHBondContact O-N 2.83Å
324	L	79.9	Confident	84.3	Confident	5 Å²	5	28.8 Å²	28.8	3%	0.026	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.9	-37.5	178.2	-175.4	64.8	0	0	0	112.7	H218 N296 I321 T331	H218-L324 WeakPolarHBondContact CE1-CD1 3.45Å; H218-L324 WeakPolarHBondContact NE2-CD1 3.35Å; N296-L324 HydrophobicContact CB-CD2 4.27Å; N296-L324 HydrophobicContact CB-CG 4.48Å; I321-L324 HydrophobicContact CB-CB 4.02Å; I321-L324 HydrophobicContact CB-CD2 4.11Å; I321-L324 HydrophobicContact CD1-CD2 3.78Å; I321-L324 HydrophobicContact CG2-CB 3.73Å; I321-L324 HydrophobicContact CG2-CD2 4.12Å; I321-L324 PolarHBondContact O-N 2.83Å; L324-T331 HydrophobicContact CD2-CG2 4.36Å
325	T	78.4	Confident	84.4	Confident	11 Å²	11	28.7 Å²	28.7	7%	0.067	18%	0.184	C	C	.	.	S	Bend	trans	-112.9	148	178.9	45.3	0	0	0	0	111	E117 H220 A294 N296 V327	E117-T325 WeakPolarHBondContact OE2-CA 3.44Å; H220-T325 VanDerWaalsContact CE1-C 3.4Å; A294-T325 HydrophobicContact CB-CG2 3.95Å; N296-T325 WeakPolarHBondContact ND2-CG2 3.49Å; N296-T325 WeakPolarHBondContact OD1-CG2 3.47Å; T325-V327 WeakPolarHBondContact CB-O 3.35Å; T325-V327 PolarHBondContact O-N 2.97Å; T325-V327 PolarHBondContact OG1-O 2.91Å
326	E	73.1	Confident	84.5	Confident	30 Å²	30	28.7 Å²	28.7	14%	0.14	18%	0.184	C	C	.	.	S	Bend	trans	-58.3	-34.6	174.1	-179.4	-177.3	-156.3	0	0	111.2	E117 R136 H220 N222	E117-E326 PolarHBondContact OE1-N 3.06Å; E117-E326 PolarHBondContact OE2-N 2.85Å; R136-E326 IonicContact NH1-OE2 3.2Å; H220-E326 HydrophobicContact CB-CB 4.33Å; H220-E326 HydrophobicContact CB-CG 4.31Å; H220-E326 PolarHBondContact CE1-N 2.85Å; H220-E326 VanDerWaalsContact CE1-N 3.29Å; H220-E326 PolarHBondContact ND1-N 2.94Å; N222-E326 VanDerWaalsContact CG-OE1 3.31Å; N222-E326 PolarHBondContact ND2-OE1 2.97Å
327	V	76	Confident	84.9	Confident	4 Å²	4	28.5 Å²	28.5	2%	0.024	18%	0.182	C	C	.	.	S	Bend	trans	-114.8	139.3	-170.5	-171.2	0	0	0	0	109.9	F284 M285 I288 T325 V329	F284-V327 HydrophobicContact CD1-CG2 3.69Å; F284-V327 HydrophobicContact CE1-CG2 3.85Å; M285-V327 HydrophobicContact CG-CG1 3.99Å; M285-V327 HydrophobicContact SD-CG1 3.09Å; M285-V327 WeakPolarHBondContact SD-CG1 3.44Å; I288-V327 HydrophobicContact CD1-CB 4.35Å; I288-V327 HydrophobicContact CD1-CG1 3.78Å; I288-V327 HydrophobicContact CD1-CG2 4.31Å; T325-V327 WeakPolarHBondContact CB-O 3.35Å; T325-V327 PolarHBondContact O-N 2.97Å; T325-V327 PolarHBondContact OG1-O 2.91Å; V327-V329 HydrophobicContact CB-CG2 4.11Å; V327-V329 HydrophobicContact CG1-CG2 3.79Å; V327-V329 PolarHBondContact O-N 2.77Å
328	P	76.7	Confident	85.1	Confident	65 Å²	65	24.5 Å²	24.5	42%	0.422	16%	0.156	S	C	.	.			trans	-73.8	68	-177.8	32.5	-38.2	0	0	0	112.7	M285 L320	M285-P328 HydrophobicContact CE-CG 4.46Å; M285-P328 HydrophobicContact SD-CG 4.47Å; L320-P328 VanDerWaalsContact CD1-C 3.46Å; L320-P328 HydrophobicContact CD1-CB 4.06Å
329	V	84.6	Confident	85.3	Confident	9 Å²	9	23.3 Å²	23.3	6%	0.055	15%	0.146	C	C	.	.			trans	-108.2	134.9	175.9	-175.3	0	0	0	0	107.7	I288 A292 A294 V327 T331	I288-V329 HydrophobicContact CD1-CG2 4.26Å; A292-V329 VanDerWaalsContact O-CG1 3.25Å; A292-V329 WeakPolarHBondContact O-CG1 3.4Å; A294-V329 HydrophobicContact CB-CB 4.19Å; A294-V329 HydrophobicContact CB-CG1 4Å; V327-V329 HydrophobicContact CB-CG2 4.11Å; V327-V329 HydrophobicContact CG1-CG2 3.79Å; V327-V329 PolarHBondContact O-N 2.77Å; V329-T331 PolarHBondContact O-N 3.39Å
330	P	88.9	Confident	85.3	Confident	44 Å²	44	23.8 Å²	23.8	29%	0.286	15%	0.15	S	C	.	.			trans	-67.7	129.7	179.8	28.8	-34.9	0	0	0	111	E293 A294 A318 V319	E293-P330 CarbonylContact C-O 3.55Å; E293-P330 WeakPolarHBondContact CA-O 3.26Å; A294-P330 PolarHBondContact N-O 3.18Å; A318-P330 HydrophobicContact CB-CB 4.02Å; A318-P330 HydrophobicContact CB-CG 4.48Å; V319-P330 CarbonylContact O-C 3.6Å
331	T	90.1	Very high	85.1	Confident	1 Å²	1	22.9 Å²	22.9	1%	0.006	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	129.8	177.3	-57.4	0	0	0	0	110.1	A294 N296 A318 V319 L324 V329 F333	A294-T331 WeakPolarHBondContact O-CA 3.33Å; N296-T331 HydrophobicContact CB-CG2 4.49Å; N296-T331 WeakPolarHBondContact OD1-CG2 3.34Å; N296-T331 PolarHBondContact OD1-OG1 3.13Å; A318-T331 WeakPolarHBondContact CA-O 3.24Å; V319-T331 PolarHBondContact N-O 3.09Å; V319-T331 PolarHBondContact O-N 2.91Å; L324-T331 HydrophobicContact CD2-CG2 4.36Å; V329-T331 PolarHBondContact O-N 3.39Å; T331-F333 WeakPolarHBondContact CG2-O 3.49Å
332	R	91.3	Very high	84.9	Confident	7 Å²	7	25.8 Å²	25.8	3%	0.026	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	-39.1	175.4	-179.2	68.2	176.3	-169	-10.2	112.2	E108 E293 A294 L315 A318 Y368	E108-R332 PolarHBondContact O-NH2 2.63Å; E293-R332 HydrophobicContact CB-CB 4.06Å; E293-R332 WeakPolarHBondContact OE2-CB 3.25Å; E293-R332 WeakPolarHBondContact OE2-CD 3.48Å; E293-R332 WeakPolarHBondContact OE2-CG 3.46Å; A294-R332 PolarHBondContact O-N 3.49Å; L315-R332 PolarHBondContact N-O 3.31Å; L315-R332 VanDerWaalsContact O-CD 3.24Å; L315-R332 WeakPolarHBondContact O-CD 3.47Å; L315-R332 PolarHBondContact O-NE 3.07Å; L315-R332 VanDerWaalsContact O-NE 3.13Å; L315-R332 PolarHBondContact O-NH1 2.97Å; A318-R332 HydrophobicContact CB-CB 4.23Å; R332-Y368 HydrophobicContact CG-CE1 4.19Å
333	F	93.8	Very high	85.2	Confident	0 Å²	0	24.2 Å²	24.2	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	140.9	-178.3	-58.8	-83.1	0	0	0	110.6	L114 A294 S295 N296 F312 V313 R314 T331 M358 A367 Y368	L114-F333 HydrophobicContact CD1-CD2 4.04Å; L114-F333 HydrophobicContact CD1-CE2 4.02Å; L114-F333 HydrophobicContact CD2-CD2 4.01Å; L114-F333 HydrophobicContact CD2-CE2 4.11Å; A294-F333 PolarHBondContact O-N 2.97Å; S295-F333 WeakPolarHBondContact CA-O 3.38Å; N296-F333 PolarHBondContact N-O 3.03Å; F312-F333 HydrophobicContact CE2-CD1 4.42Å; F312-F333 AromaticContact CZ-CD1 3.83Å; F312-F333 HydrophobicContact CZ-CD1 3.83Å; F312-F333 HydrophobicContact CZ-CE1 4.35Å; V313-F333 WeakPolarHBondContact O-CA 3.28Å; R314-F333 HydrophobicContact CB-CD1 4.13Å; R314-F333 HydrophobicContact CB-CE1 4.11Å; R314-F333 HydrophobicContact CG-CD1 4.15Å; R314-F333 HydrophobicContact CG-CE1 3.76Å; R314-F333 HydrophobicContact CG-CZ 4.5Å; T331-F333 WeakPolarHBondContact CG2-O 3.49Å; F333-M358 HydrophobicContact CB-CE 3.95Å; F333-M358 HydrophobicContact CD1-CE 3.98Å; F333-M358 HydrophobicContact CD2-CE 3.46Å; F333-M358 VanDerWaalsContact CD2-CE 3.46Å; F333-M358 HydrophobicContact CE1-CE 4.34Å; F333-M358 HydrophobicContact CE2-CE 3.88Å; F333-M358 HydrophobicContact CG-CE 3.52Å; F333-M358 HydrophobicContact CZ-CE 4.29Å; F333-A367 HydrophobicContact CE1-CB 4.01Å; F333-A367 HydrophobicContact CZ-CB 4.15Å; F333-Y368 HydrophobicContact CE2-CD2 4.11Å; F333-Y368 HydrophobicContact CE2-CE1 4.26Å; F333-Y368 AromaticContact CE2-CE2 3.57Å; F333-Y368 HydrophobicContact CE2-CE2 3.57Å; F333-Y368 AromaticContact CE2-CZ 3.68Å; F333-Y368 HydrophobicContact CZ-CD1 4.34Å; F333-Y368 AromaticContact CZ-CD2 3.86Å; F333-Y368 HydrophobicContact CZ-CD2 3.86Å; F333-Y368 HydrophobicContact CZ-CE1 4.33Å; F333-Y368 AromaticContact CZ-CE2 3.81Å; F333-Y368 HydrophobicContact CZ-CE2 3.81Å; F333-Y368 HydrophobicContact CZ-CG 4.13Å
334	L	93.2	Very high	85.6	Confident	5 Å²	5	22.9 Å²	22.9	3%	0.026	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	124	173.3	-179.3	72.2	0	0	0	108.9	I185 I188 N296 L298 V313	I185-L334 HydrophobicContact CD1-CD2 4.31Å; I188-L334 HydrophobicContact CG2-CD2 3.8Å; N296-L334 HydrophobicContact CB-CD1 3.69Å; N296-L334 CarbonylContact O-C 3.58Å; N296-L334 WeakPolarHBondContact O-CA 3.27Å; L298-L334 HydrophobicContact CD1-CD1 3.84Å; L298-L334 HydrophobicContact CG-CD1 3.97Å; V313-L334 HydrophobicContact CB-CB 4.25Å; V313-L334 PolarHBondContact N-O 3.44Å; V313-L334 PolarHBondContact O-N 3.16Å
335	F	95	Very high	85.8	Confident	2 Å²	2	27.6 Å²	27.6	1%	0.009	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	128.2	171	-179.6	-95.7	0	0	0	108.9	L167 N296 V297 L298 I310 A311 F312 L337 I350 M354	L167-F335 HydrophobicContact CD1-CE2 3.94Å; L167-F335 HydrophobicContact CD1-CZ 3.73Å; N296-F335 PolarHBondContact O-N 3.39Å; V297-F335 HydrophobicContact CG1-CB 4.41Å; V297-F335 HydrophobicContact CG1-CD1 3.75Å; V297-F335 HydrophobicContact CG1-CG 4.49Å; L298-F335 PolarHBondContact N-O 3.01Å; I310-F335 HydrophobicContact CG2-CE2 3.94Å; I310-F335 HydrophobicContact CG2-CZ 4.22Å; A311-F335 CarbonylContact O-C 3.53Å; A311-F335 WeakPolarHBondContact O-CA 3.11Å; F312-F335 HydrophobicContact CB-CD2 4.46Å; F312-F335 HydrophobicContact CD2-CD2 4.17Å; F335-L337 HydrophobicContact CE1-CB 3.89Å; F335-L337 HydrophobicContact CZ-CB 4.43Å; F335-I350 HydrophobicContact CZ-CG2 4.43Å; F335-M354 HydrophobicContact CB-CG 4.19Å; F335-M354 HydrophobicContact CD1-CB 4.41Å; F335-M354 HydrophobicContact CD1-CG 4.16Å; F335-M354 HydrophobicContact CD2-CE 4.32Å; F335-M354 HydrophobicContact CD2-CG 3.94Å; F335-M354 HydrophobicContact CD2-SD 4.43Å; F335-M354 HydrophobicContact CE1-CB 4.43Å; F335-M354 HydrophobicContact CE2-CG 4.32Å; F335-M354 HydrophobicContact CG-CG 3.83Å
336	L	93.4	Very high	86.2	Confident	2 Å²	2	29.1 Å²	29.1	1%	0.01	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	128.4	178.9	178.7	70.3	0	0	0	109.6	W131 M214 L298 I310 A311 L338	W131-L336 HydrophobicContact CH2-CD1 4.28Å; M214-L336 HydrophobicContact CE-CD2 3.83Å; M214-L336 HydrophobicContact CG-CD2 3.99Å; M214-L336 HydrophobicContact SD-CD2 3.63Å; L298-L336 HydrophobicContact CB-CD1 3.8Å; L298-L336 HydrophobicContact CD1-CD1 4.31Å; L298-L336 CarbonylContact O-C 3.51Å; L298-L336 WeakPolarHBondContact O-CA 3.3Å; I310-L336 CarbonylContact C-O 3.6Å; I310-L336 VanDerWaalsContact CA-O 3.31Å; I310-L336 WeakPolarHBondContact CA-O 3.15Å; A311-L336 HydrophobicContact CB-CB 4.08Å; A311-L336 PolarHBondContact N-O 2.92Å; A311-L336 PolarHBondContact O-N 3.13Å; L336-L338 HydrophobicContact CD1-CD1 4.25Å; L336-L338 HydrophobicContact CD1-CD2 4.43Å; L336-L338 HydrophobicContact CD1-CG 4Å; L336-L338 HydrophobicContact CD2-CD1 4.42Å; L336-L338 HydrophobicContact CG-CG 4.31Å
337	L	92.9	Very high	87	Confident	1 Å²	1	28.1 Å²	28.1	1%	0.005	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	112.4	172.6	174.9	62.7	0	0	0	109.4	L298 V299 G300 P308 I309 I310 F335 Y347 I350	L298-L337 PolarHBondContact O-N 3.38Å; V299-L337 CarbonylContact C-O 3.57Å; V299-L337 WeakPolarHBondContact CA-O 3.38Å; V299-L337 HydrophobicContact CG1-CD2 4.33Å; V299-L337 HydrophobicContact CG2-CB 4.37Å; G300-L337 PolarHBondContact N-O 3.26Å; P308-L337 HydrophobicContact CB-CD1 4.47Å; I309-L337 WeakPolarHBondContact O-CA 3.16Å; I310-L337 HydrophobicContact CD1-CD1 4.29Å; I310-L337 HydrophobicContact CG1-CD1 3.51Å; F335-L337 HydrophobicContact CE1-CB 3.89Å; F335-L337 HydrophobicContact CZ-CB 4.43Å; L337-Y347 HydrophobicContact CD2-CD1 3.9Å; L337-Y347 HydrophobicContact CD2-CG 4.25Å; L337-Y347 HydrophobicContact CG-CD1 4.3Å; L337-I350 HydrophobicContact CD2-CB 3.95Å; L337-I350 HydrophobicContact CD2-CD1 4.26Å; L337-I350 HydrophobicContact CD2-CG2 3.74Å
338	L	90.5	Very high	87.7	Confident	0 Å²	0	29.7 Å²	29.7	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	125.9	174.3	-66.3	176	0	0	0	109.7	L121 W131 V210 G300 V302 L305 P308 I309 L336	L121-L338 HydrophobicContact CD2-CD2 4.44Å; W131-L338 HydrophobicContact CH2-CD2 3.92Å; W131-L338 HydrophobicContact CZ2-CD2 4.35Å; V210-L338 HydrophobicContact CG1-CD1 4.27Å; G300-L338 CarbonylContact O-C 3.53Å; G300-L338 VanDerWaalsContact O-CA 3.31Å; G300-L338 WeakPolarHBondContact O-CA 3.42Å; V302-L338 HydrophobicContact CG2-CB 4.46Å; L305-L338 HydrophobicContact CD1-CB 3.92Å; P308-L338 CarbonylContact C-O 3.39Å; P308-L338 VanDerWaalsContact CA-O 3.27Å; P308-L338 WeakPolarHBondContact CA-O 3.42Å; I309-L338 PolarHBondContact N-O 3.4Å; I309-L338 PolarHBondContact O-N 3.08Å; L336-L338 HydrophobicContact CD1-CD1 4.25Å; L336-L338 HydrophobicContact CD1-CD2 4.43Å; L336-L338 HydrophobicContact CD1-CG 4Å; L336-L338 HydrophobicContact CD2-CD1 4.42Å; L336-L338 HydrophobicContact CG-CG 4.31Å
339	G	89.1	Confident	88.2	Confident	0 Å²	0	28.9 Å²	28.9	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	168.2	-176.7	0	0	0	0	0	115.1	G300 E301 V302	G300-G339 PolarHBondContact O-N 3.09Å; E301-G339 CarbonylContact C-O 3.59Å; E301-G339 VanDerWaalsContact CA-O 3.3Å; E301-G339 WeakPolarHBondContact CA-O 3.33Å; V302-G339 PolarHBondContact N-O 2.87Å
340	P	87.6	Confident	88.5	Confident	33 Å²	33	28.7 Å²	28.7	21%	0.214	17%	0.172	C	C	.	.			trans	-58.3	157.6	172.2	23.3	-34.3	0	0	0	112.5	L305 Y347	L305-P340 WeakPolarHBondContact O-CB 3.31Å; P340-Y347 WeakPolarHBondContact CD-OH 3.44Å; P340-Y347 WeakPolarHBondContact O-CE2 3.38Å
341	H	81.4	Confident	88.7	Confident	72 Å²	72	26.6 Å²	26.6	33%	0.333	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.6	147.7	173.5	-83.3	-77.6	0	0	0	113.5	F123 E301 V302 D303	F123-H341 AromaticContact CD1-CE1 3.92Å; F123-H341 AromaticContact CD2-CE1 3.81Å; F123-H341 AromaticContact CE1-CE1 3.63Å; F123-H341 AromaticContact CE1-NE2 3.39Å; F123-H341 WeakPolarHBondContact CE1-NE2 3.33Å; F123-H341 AromaticContact CE2-CE1 3.53Å; F123-H341 AromaticContact CE2-NE2 3.89Å; F123-H341 AromaticContact CZ-CE1 3.44Å; F123-H341 VanDerWaalsContact CZ-CE1 3.44Å; F123-H341 WeakPolarHBondContact CZ-CE1 3.21Å; F123-H341 AromaticContact CZ-NE2 3.31Å; F123-H341 VanDerWaalsContact CZ-NE2 3.31Å; F123-H341 WeakPolarHBondContact CZ-NE2 3.42Å; E301-H341 IonicContact OE2-CE1 3.22Å; E301-H341 IonicContact OE2-CG 3.2Å; E301-H341 IonicContact OE2-ND1 3.14Å; E301-H341 PolarHBondContact OE2-ND1 3.42Å; V302-H341 VanDerWaalsContact C-CD2 3.42Å; D303-H341 VanDerWaalsContact CG-NE2 3.34Å; D303-H341 PolarHBondContact N-CD2 3.03Å; D303-H341 VanDerWaalsContact N-CD2 3.29Å; D303-H341 PolarHBondContact N-NE2 3.48Å; D303-H341 IonicContact OD1-CD2 2.86Å; D303-H341 PolarHBondContact OD1-CD2 2.99Å; D303-H341 IonicContact OD1-CG 3.89Å; D303-H341 IonicContact OD1-NE2 3.83Å; D303-H341 PolarHBondContact OD1-NE2 3.48Å; D303-H341 VanDerWaalsContact OD1-NE2 3.11Å; D303-H341 IonicContact OD2-NE2 3.88Å
342	G	79.2	Confident	88.7	Confident	71 Å²	71	27.6 Å²	27.6	73%	0.732	16%	0.162	S	C	*	.	T	Hydrogen-bonded Turn	trans	105.8	6.2	175.1	0	0	0	0	0	114.2	E301	E301-G342 PolarHBondContact OE1-N 2.77Å
343	K	81.6	Confident	88.7	Confident	98 Å²	98	27.2 Å²	27.2	43%	0.426	16%	0.161	S	C	.	.			trans	-133.6	19.9	-178.1	-74.4	-175.3	162	-125.6	0	113.3	E301 Q346 Y347	E301-K343 PolarHBondContact OE1-N 2.73Å; K343-Q346 HydrophobicContact CB-CB 4.48Å; K343-Q346 WeakPolarHBondContact O-CA 3.46Å; K343-Q346 WeakPolarHBondContact O-CB 3.48Å; K343-Q346 PolarHBondContact O-N 3.5Å; K343-Y347 HydrophobicContact CB-CD2 4.26Å; K343-Y347 HydrophobicContact CB-CE1 4.11Å; K343-Y347 HydrophobicContact CB-CE2 3.66Å; K343-Y347 WeakPolarHBondContact O-CD2 3.34Å; K343-Y347 PolarHBondContact O-N 3.04Å
344	G	81.1	Confident	88.7	Confident	20 Å²	20	27.3 Å²	27.3	21%	0.206	16%	0.161	C	C	.	.	H	α-helix	trans	-54	-51.2	-174.5	0	0	0	0	0	113.8	E301 Q346 Y347 H348	E301-G344 WeakPolarHBondContact OE1-CA 3.47Å; E301-G344 PolarHBondContact OE1-N 3.03Å; G344-Q346 VanDerWaalsContact C-N 3.28Å; G344-Q346 PolarHBondContact O-N 3.14Å; G344-Y347 PolarHBondContact O-N 2.86Å; G344-Y347 VanDerWaalsContact O-N 3.11Å; G344-H348 PolarHBondContact O-N 3.42Å
345	P	84.2	Confident	88.6	Confident	104 Å²	104	27.1 Å²	27.1	68%	0.675	16%	0.16	S	C	*	.	H	α-helix	trans	-59.1	-38.7	176.6	-24.3	33.9	0	0	0	112.7	Y347 H348 E349	P345-Y347 PolarHBondContact O-N 3.36Å; P345-H348 WeakPolarHBondContact O-CB 3.35Å; P345-H348 PolarHBondContact O-N 3.05Å; P345-E349 VanDerWaalsContact O-CG 3.27Å; P345-E349 WeakPolarHBondContact O-CG 3.39Å; P345-E349 PolarHBondContact O-N 3.06Å
346	Q	86.7	Confident	88.3	Confident	44 Å²	44	27 Å²	27	21%	0.206	16%	0.16	C	C	.	.	H	α-helix	trans	-64.2	-41.2	176.7	-176.4	171.9	59.5	0	0	111.2	H162 E166 K343 G344 E349 I350	H162-Q346 PolarHBondContact NE2-NE2 3.05Å; E166-Q346 PolarHBondContact OE1-NE2 3.37Å; E166-Q346 WeakPolarHBondContact OE2-CG 3.42Å; E166-Q346 PolarHBondContact OE2-NE2 3.26Å; K343-Q346 HydrophobicContact CB-CB 4.48Å; K343-Q346 WeakPolarHBondContact O-CA 3.46Å; K343-Q346 WeakPolarHBondContact O-CB 3.48Å; K343-Q346 PolarHBondContact O-N 3.5Å; G344-Q346 VanDerWaalsContact C-N 3.28Å; G344-Q346 PolarHBondContact O-N 3.14Å; Q346-E349 PolarHBondContact O-N 2.94Å; Q346-I350 HydrophobicContact CG-CD1 4.28Å; Q346-I350 VanDerWaalsContact O-CG1 3.27Å; Q346-I350 WeakPolarHBondContact O-CG1 3.47Å; Q346-I350 PolarHBondContact O-N 3.39Å
347	Y	89.5	Confident	88.1	Confident	9 Å²	9	27 Å²	27	4%	0.035	16%	0.159	C	C	.	.	H	α-helix	trans	-67.3	-40.5	175.7	-58.1	-36.2	0	0	0	112.4	V299 E301 L337 P340 K343 G344 P345 E349 I350 G351	V299-Y347 VanDerWaalsContact CG1-C 3.46Å; V299-Y347 WeakPolarHBondContact CG1-O 3.38Å; E301-Y347 HydrophobicContact CG-CD2 4.05Å; E301-Y347 HydrophobicContact CG-CE2 4.28Å; L337-Y347 HydrophobicContact CD2-CD1 3.9Å; L337-Y347 HydrophobicContact CD2-CG 4.25Å; L337-Y347 HydrophobicContact CG-CD1 4.3Å; P340-Y347 WeakPolarHBondContact CD-OH 3.44Å; P340-Y347 WeakPolarHBondContact O-CE2 3.38Å; K343-Y347 HydrophobicContact CB-CD2 4.26Å; K343-Y347 HydrophobicContact CB-CE1 4.11Å; K343-Y347 HydrophobicContact CB-CE2 3.66Å; K343-Y347 WeakPolarHBondContact O-CD2 3.34Å; K343-Y347 PolarHBondContact O-N 3.04Å; G344-Y347 PolarHBondContact O-N 2.86Å; G344-Y347 VanDerWaalsContact O-N 3.11Å; P345-Y347 PolarHBondContact O-N 3.36Å; Y347-E349 VanDerWaalsContact C-N 3.35Å; Y347-E349 PolarHBondContact O-N 2.86Å; Y347-I350 HydrophobicContact CD1-CD1 4.35Å; Y347-I350 PolarHBondContact O-N 2.8Å; Y347-G351 PolarHBondContact O-N 3.17Å
348	H	90.1	Very high	87.9	Confident	37 Å²	37	27 Å²	27	17%	0.171	16%	0.16	C	C	.	.	H	α-helix	trans	-55.7	-50.2	172.8	174.1	75.8	0	0	0	110.9	E120 G344 P345 I350 G351 R352	E120-H348 VanDerWaalsContact OE1-CB 3.27Å; E120-H348 WeakPolarHBondContact OE1-CB 3.5Å; E120-H348 IonicContact OE1-CE1 2.71Å; E120-H348 IonicContact OE1-CG 3.78Å; E120-H348 IonicContact OE1-ND1 2.89Å; E120-H348 PolarHBondContact OE1-ND1 2.95Å; G344-H348 PolarHBondContact O-N 3.42Å; P345-H348 WeakPolarHBondContact O-CB 3.35Å; P345-H348 PolarHBondContact O-N 3.05Å; H348-I350 VanDerWaalsContact C-N 3.33Å; H348-I350 PolarHBondContact O-N 3.23Å; H348-G351 PolarHBondContact O-N 3.3Å; H348-G351 VanDerWaalsContact O-N 3.16Å; H348-R352 PolarHBondContact CD2-NH1 3.45Å; H348-R352 PolarHBondContact NE2-NH1 3.36Å; H348-R352 VanDerWaalsContact NE2-NH1 3.16Å; H348-R352 WeakPolarHBondContact O-CB 3.22Å; H348-R352 PolarHBondContact O-N 3.05Å
349	E	88.4	Confident	87.5	Confident	48 Å²	48	28.2 Å²	28.2	22%	0.224	17%	0.167	C	C	.	.	H	α-helix	trans	-59.4	-39.6	178.1	-71.4	-70.3	146.3	0	0	112.7	P345 Q346 Y347 R352 S353	P345-E349 VanDerWaalsContact O-CG 3.27Å; P345-E349 WeakPolarHBondContact O-CG 3.39Å; P345-E349 PolarHBondContact O-N 3.06Å; Q346-E349 PolarHBondContact O-N 2.94Å; Y347-E349 VanDerWaalsContact C-N 3.35Å; Y347-E349 PolarHBondContact O-N 2.86Å; E349-R352 VanDerWaalsContact CD-CZ 3.5Å; E349-R352 PolarHBondContact O-N 3.28Å; E349-R352 IonicContact OE1-CZ 3.58Å; E349-R352 IonicContact OE1-NH1 3.5Å; E349-R352 PolarHBondContact OE1-NH1 3Å; E349-R352 IonicContact OE1-NH2 2.76Å; E349-R352 PolarHBondContact OE1-NH2 3.29Å; E349-R352 IonicContact OE2-CZ 3.19Å; E349-R352 IonicContact OE2-NH1 3.96Å; E349-R352 PolarHBondContact OE2-NH1 3.03Å; E349-R352 IonicContact OE2-NH2 2.64Å; E349-R352 PolarHBondContact OE2-NH2 3.18Å; E349-S353 WeakPolarHBondContact O-CB 3.34Å; E349-S353 PolarHBondContact O-N 3.11Å; E349-S353 PolarHBondContact O-OG 3.06Å
350	I	91.4	Very high	87.3	Confident	4 Å²	4	28.4 Å²	28.4	2%	0.021	17%	0.168	C	C	.	.	H	α-helix	trans	-65.5	-45.2	175.3	-67.3	164.2	0	0	0	110.5	E166 L167 F335 L337 Q346 Y347 H348 S353 M354	E166-I350 HydrophobicContact CB-CD1 3.9Å; E166-I350 HydrophobicContact CB-CG1 4.05Å; L167-I350 HydrophobicContact CB-CG2 4.19Å; L167-I350 HydrophobicContact CD1-CG2 3.94Å; F335-I350 HydrophobicContact CZ-CG2 4.43Å; L337-I350 HydrophobicContact CD2-CB 3.95Å; L337-I350 HydrophobicContact CD2-CD1 4.26Å; L337-I350 HydrophobicContact CD2-CG2 3.74Å; Q346-I350 HydrophobicContact CG-CD1 4.28Å; Q346-I350 VanDerWaalsContact O-CG1 3.27Å; Q346-I350 WeakPolarHBondContact O-CG1 3.47Å; Q346-I350 PolarHBondContact O-N 3.39Å; Y347-I350 HydrophobicContact CD1-CD1 4.35Å; Y347-I350 PolarHBondContact O-N 2.8Å; H348-I350 VanDerWaalsContact C-N 3.33Å; H348-I350 PolarHBondContact O-N 3.23Å; I350-S353 WeakPolarHBondContact O-CB 3.32Å; I350-S353 PolarHBondContact O-N 3.42Å; I350-M354 PolarHBondContact O-N 3.42Å
351	G	91.6	Very high	86.8	Confident	0 Å²	0	28.7 Å²	28.7	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-59.6	-46.4	174.7	0	0	0	0	0	112.3	Y347 H348 S353 M354 A355	Y347-G351 PolarHBondContact O-N 3.17Å; H348-G351 PolarHBondContact O-N 3.3Å; H348-G351 VanDerWaalsContact O-N 3.16Å; G351-S353 VanDerWaalsContact C-N 3.31Å; G351-S353 PolarHBondContact O-N 2.75Å; G351-M354 PolarHBondContact O-N 3.18Å; G351-A355 WeakPolarHBondContact O-CB 3.37Å; G351-A355 PolarHBondContact O-N 2.81Å
352	R	91.7	Very high	86.9	Confident	22 Å²	22	25.6 Å²	25.6	8%	0.083	15%	0.152	C	C	.	.	H	α-helix	trans	-61.2	-39.7	176.7	-154.4	172.7	70.3	-115.5	-0.4	112	W137 E141 H348 E349 A355 T356	W137-R352 HydrophobicContact CH2-CG 3.84Å; W137-R352 HydrophobicContact CZ2-CG 3.44Å; W137-R352 VanDerWaalsContact CZ2-CG 3.44Å; E141-R352 WeakPolarHBondContact OE1-CD 3.28Å; E141-R352 IonicContact OE1-NE 3.88Å; H348-R352 PolarHBondContact CD2-NH1 3.45Å; H348-R352 PolarHBondContact NE2-NH1 3.36Å; H348-R352 VanDerWaalsContact NE2-NH1 3.16Å; H348-R352 WeakPolarHBondContact O-CB 3.22Å; H348-R352 PolarHBondContact O-N 3.05Å; E349-R352 VanDerWaalsContact CD-CZ 3.5Å; E349-R352 PolarHBondContact O-N 3.28Å; E349-R352 IonicContact OE1-CZ 3.58Å; E349-R352 IonicContact OE1-NH1 3.5Å; E349-R352 PolarHBondContact OE1-NH1 3Å; E349-R352 IonicContact OE1-NH2 2.76Å; E349-R352 PolarHBondContact OE1-NH2 3.29Å; E349-R352 IonicContact OE2-CZ 3.19Å; E349-R352 IonicContact OE2-NH1 3.96Å; E349-R352 PolarHBondContact OE2-NH1 3.03Å; E349-R352 IonicContact OE2-NH2 2.64Å; E349-R352 PolarHBondContact OE2-NH2 3.18Å; R352-A355 PolarHBondContact O-N 2.75Å; R352-T356 WeakPolarHBondContact O-CB 3.29Å; R352-T356 PolarHBondContact O-N 3.28Å; R352-T356 PolarHBondContact O-OG1 2.98Å
353	S	91.1	Very high	87.3	Confident	0 Å²	0	22.2 Å²	22.2	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-63.1	-44.1	175	-58.1	0	0	0	0	111.7	S163 E349 I350 G351 T356 L357	S163-S353 WeakPolarHBondContact CB-OG 3.46Å; S163-S353 PolarHBondContact OG-OG 3.14Å; E349-S353 WeakPolarHBondContact O-CB 3.34Å; E349-S353 PolarHBondContact O-N 3.11Å; E349-S353 PolarHBondContact O-OG 3.06Å; I350-S353 WeakPolarHBondContact O-CB 3.32Å; I350-S353 PolarHBondContact O-N 3.42Å; G351-S353 VanDerWaalsContact C-N 3.31Å; G351-S353 PolarHBondContact O-N 2.75Å; S353-T356 PolarHBondContact O-N 2.91Å; S353-L357 WeakPolarHBondContact O-CB 3.25Å; S353-L357 WeakPolarHBondContact O-CG 3.37Å; S353-L357 PolarHBondContact O-N 3.36Å
354	M	92.4	Very high	87.5	Confident	2 Å²	2	18.4 Å²	18.4	1%	0.01	10%	0.101	C	C	.	.	H	α-helix	trans	-65.8	-45.4	176.5	-175.3	59.2	-174.4	0	0	111.8	L167 I171 F312 F335 I350 G351 T356 L357 M358 F363	L167-M354 HydrophobicContact CD1-CB 4.03Å; L167-M354 HydrophobicContact CD1-CG 4.47Å; L167-M354 HydrophobicContact CD1-SD 4.23Å; L167-M354 HydrophobicContact CD2-CB 3.93Å; L167-M354 HydrophobicContact CD2-SD 4.15Å; I171-M354 HydrophobicContact CD1-SD 4.43Å; F312-M354 HydrophobicContact CD2-CE 3.51Å; F312-M354 HydrophobicContact CE2-CE 3.19Å; F312-M354 HydrophobicContact CZ-CE 4.21Å; F335-M354 HydrophobicContact CB-CG 4.19Å; F335-M354 HydrophobicContact CD1-CB 4.41Å; F335-M354 HydrophobicContact CD1-CG 4.16Å; F335-M354 HydrophobicContact CD2-CE 4.32Å; F335-M354 HydrophobicContact CD2-CG 3.94Å; F335-M354 HydrophobicContact CD2-SD 4.43Å; F335-M354 HydrophobicContact CE1-CB 4.43Å; F335-M354 HydrophobicContact CE2-CG 4.32Å; F335-M354 HydrophobicContact CG-CG 3.83Å; I350-M354 PolarHBondContact O-N 3.42Å; G351-M354 PolarHBondContact O-N 3.18Å; M354-T356 VanDerWaalsContact C-N 3.29Å; M354-T356 PolarHBondContact O-N 3.33Å; M354-L357 PolarHBondContact O-N 3.2Å; M354-M358 HydrophobicContact CE-CG 4.05Å; M354-M358 HydrophobicContact CE-SD 3.8Å; M354-M358 WeakPolarHBondContact O-CG 3.4Å; M354-M358 PolarHBondContact O-N 3.13Å; M354-F363 HydrophobicContact CE-CE1 4.35Å
355	A	91.1	Very high	87.7	Confident	0 Å²	0	18.2 Å²	18.2	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-60.8	-40.2	178.1	0	0	0	0	0	111.8	W137 V297 G351 R352 M358	W137-A355 HydrophobicContact CD2-CB 3.96Å; W137-A355 HydrophobicContact CE3-CB 3.49Å; W137-A355 VanDerWaalsContact CE3-CB 3.49Å; W137-A355 HydrophobicContact CH2-CB 3.69Å; W137-A355 HydrophobicContact CZ2-CB 4.09Å; W137-A355 HydrophobicContact CZ3-CB 3.36Å; V297-A355 HydrophobicContact CG2-CB 4.04Å; G351-A355 WeakPolarHBondContact O-CB 3.37Å; G351-A355 PolarHBondContact O-N 2.81Å; R352-A355 PolarHBondContact O-N 2.75Å; A355-M358 PolarHBondContact O-N 3.34Å
356	T	88.9	Confident	87.9	Confident	1 Å²	1	13.3 Å²	13.3	1%	0.006	6%	0.063	C	C	.	.	H	α-helix	trans	-68.9	-41.2	176.7	-57.9	0	0	0	0	111.9	V48 W137 A157 L159 R352 S353 M354 M358 T359	V48-T356 HydrophobicContact CB-CG2 4.39Å; V48-T356 HydrophobicContact CG1-CG2 4.32Å; V48-T356 HydrophobicContact CG2-CG2 3.74Å; W137-T356 PolarHBondContact NE1-OG1 3.46Å; A157-T356 HydrophobicContact CB-CG2 3.73Å; L159-T356 HydrophobicContact CD1-CG2 3.82Å; L159-T356 HydrophobicContact CD2-CG2 4.44Å; L159-T356 HydrophobicContact CG-CG2 4.27Å; R352-T356 WeakPolarHBondContact O-CB 3.29Å; R352-T356 PolarHBondContact O-N 3.28Å; R352-T356 PolarHBondContact O-OG1 2.98Å; S353-T356 PolarHBondContact O-N 2.91Å; M354-T356 VanDerWaalsContact C-N 3.29Å; M354-T356 PolarHBondContact O-N 3.33Å; T356-M358 VanDerWaalsContact C-N 3.3Å; T356-M358 PolarHBondContact O-N 3.11Å; T356-T359 WeakPolarHBondContact O-CB 3.49Å; T356-T359 PolarHBondContact O-N 2.87Å; T356-T359 PolarHBondContact O-OG1 3.14Å
357	L	89.3	Confident	88.1	Confident	0 Å²	0	11.2 Å²	11.2	0%	0	5%	0.054	C	C	.	.	H	α-helix	trans	-58.7	-40.6	174.1	-83.3	170	0	0	0	112.3	L164 L167 S353 M354 T359 D360 F363 I380 F383	L164-L357 HydrophobicContact CD2-CD1 4.06Å; L164-L357 HydrophobicContact CD2-CG 4.32Å; L167-L357 HydrophobicContact CD2-CD1 3.43Å; L167-L357 VanDerWaalsContact CD2-CD1 3.43Å; S353-L357 WeakPolarHBondContact O-CB 3.25Å; S353-L357 WeakPolarHBondContact O-CG 3.37Å; S353-L357 PolarHBondContact O-N 3.36Å; M354-L357 PolarHBondContact O-N 3.2Å; L357-T359 PolarHBondContact O-N 2.81Å; L357-T359 VanDerWaalsContact O-N 3.16Å; L357-D360 PolarHBondContact O-N 2.76Å; L357-F363 HydrophobicContact CB-CD1 3.8Å; L357-F363 HydrophobicContact CB-CE1 3.99Å; L357-F363 HydrophobicContact CB-CG 4.27Å; L357-F363 HydrophobicContact CD2-CD2 4.47Å; L357-F363 HydrophobicContact CD2-CG 4.28Å; L357-F363 WeakPolarHBondContact O-CD1 2.9Å; L357-I380 HydrophobicContact CD1-CG1 4.24Å; L357-F383 HydrophobicContact CD2-CB 3.71Å; L357-F383 HydrophobicContact CD2-CD1 3.34Å; L357-F383 HydrophobicContact CD2-CD2 3.6Å; L357-F383 HydrophobicContact CD2-CE1 3.69Å; L357-F383 HydrophobicContact CD2-CE2 3.94Å; L357-F383 HydrophobicContact CD2-CG 3.26Å; L357-F383 HydrophobicContact CD2-CZ 3.97Å; L357-F383 HydrophobicContact CG-CD1 4.42Å; L357-F383 HydrophobicContact CG-CE1 4.4Å
358	M	88.3	Confident	88	Confident	2 Å²	2	10.9 Å²	10.9	1%	0.01	5%	0.052	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-16.7	177	-66.3	-60.6	-67.3	0	0	113.2	L114 T116 F333 M354 A355 T356 F363 A367	L114-M358 HydrophobicContact CD1-CB 4.45Å; L114-M358 HydrophobicContact CD1-CE 3.53Å; T116-M358 HydrophobicContact CG2-CB 3.64Å; F333-M358 HydrophobicContact CB-CE 3.95Å; F333-M358 HydrophobicContact CD1-CE 3.98Å; F333-M358 HydrophobicContact CD2-CE 3.46Å; F333-M358 VanDerWaalsContact CD2-CE 3.46Å; F333-M358 HydrophobicContact CE1-CE 4.34Å; F333-M358 HydrophobicContact CE2-CE 3.88Å; F333-M358 HydrophobicContact CG-CE 3.52Å; F333-M358 HydrophobicContact CZ-CE 4.29Å; M354-M358 HydrophobicContact CE-CG 4.05Å; M354-M358 HydrophobicContact CE-SD 3.8Å; M354-M358 WeakPolarHBondContact O-CG 3.4Å; M354-M358 PolarHBondContact O-N 3.13Å; A355-M358 PolarHBondContact O-N 3.34Å; T356-M358 VanDerWaalsContact C-N 3.3Å; T356-M358 PolarHBondContact O-N 3.11Å; M358-F363 HydrophobicContact SD-CD1 4.11Å; M358-F363 HydrophobicContact SD-CE1 3.68Å; M358-A367 HydrophobicContact CE-CB 4.48Å; M358-A367 HydrophobicContact SD-CB 4.48Å
359	T	83.1	Confident	87.9	Confident	25 Å²	25	11.9 Å²	11.9	15%	0.153	6%	0.056	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.2	-16.7	172.2	71.6	0	0	0	0	114	P51 W137 T356 L357	P51-T359 WeakPolarHBondContact CG-O 3.47Å; W137-T359 HydrophobicContact CB-CG2 3.45Å; W137-T359 VanDerWaalsContact CB-CG2 3.45Å; W137-T359 HydrophobicContact CG-CG2 3.94Å; T356-T359 WeakPolarHBondContact O-CB 3.49Å; T356-T359 PolarHBondContact O-N 2.87Å; T356-T359 PolarHBondContact O-OG1 3.14Å; L357-T359 PolarHBondContact O-N 2.81Å; L357-T359 VanDerWaalsContact O-N 3.16Å
360	D	84.3	Confident	87.8	Confident	5 Å²	5	9.6 Å²	9.6	3%	0.027	5%	0.046	C	C	.	.	S	Bend	trans	-75	133.2	178.3	179.4	72.2	0	0	0	111.1	L357 I362 F363 H364 F383 Q410 R413	L357-D360 PolarHBondContact O-N 2.76Å; D360-I362 VanDerWaalsContact C-N 3.26Å; D360-I362 PolarHBondContact O-N 3.19Å; D360-I362 WeakPolarHBondContact OD2-CA 3.1Å; D360-I362 VanDerWaalsContact OD2-CB 3.3Å; D360-I362 WeakPolarHBondContact OD2-CB 3.5Å; D360-I362 PolarHBondContact OD2-N 3.38Å; D360-F363 HydrophobicContact CB-CB 4.38Å; D360-F363 PolarHBondContact OD2-N 3.22Å; D360-F363 VanDerWaalsContact OD2-N 3.16Å; D360-H364 WeakPolarHBondContact O-CB 2.99Å; D360-H364 PolarHBondContact O-N 3.16Å; D360-F383 HydrophobicContact CB-CD2 4.21Å; D360-F383 HydrophobicContact CB-CE2 4.19Å; D360-Q410 PolarHBondContact OD1-NE2 2.9Å; D360-R413 IonicContact OD1-NH1 3.05Å
361	E	77.6	Confident	87.5	Confident	39 Å²	39	16.1 Å²	16.1	18%	0.182	7%	0.074	C	C	.	.	H	α-helix	trans	-61.6	-30	-175	-110.4	-178.4	-118.2	0	0	113.9	P51 F52 D365 K414	P51-E361 WeakPolarHBondContact CA-OE1 3.13Å; P51-E361 HydrophobicContact CB-CB 3.9Å; P51-E361 HydrophobicContact CB-CG 3.39Å; P51-E361 WeakPolarHBondContact CB-OE1 3.35Å; P51-E361 HydrophobicContact CG-CG 4.43Å; F52-E361 PolarHBondContact N-OE1 3.43Å; E361-D365 WeakPolarHBondContact O-CB 3.37Å; E361-D365 PolarHBondContact O-N 3.4Å; E361-K414 WeakPolarHBondContact OE2-CE 3.2Å; E361-K414 IonicContact OE2-NZ 2.59Å; E361-K414 PolarHBondContact OE2-NZ 2.89Å
362	I	82.9	Confident	87.3	Confident	6 Å²	6	20.9 Å²	20.9	3%	0.031	10%	0.099	C	C	.	.	H	α-helix	trans	-82.4	-53.7	-177.7	-56.7	165.3	0	0	0	109.2	V96 L100 D360 H364 D365 V366 E382 R413	V96-I362 HydrophobicContact CG1-CG2 3.7Å; L100-I362 HydrophobicContact CD1-CG2 4.27Å; D360-I362 VanDerWaalsContact C-N 3.26Å; D360-I362 PolarHBondContact O-N 3.19Å; D360-I362 WeakPolarHBondContact OD2-CA 3.1Å; D360-I362 VanDerWaalsContact OD2-CB 3.3Å; D360-I362 WeakPolarHBondContact OD2-CB 3.5Å; D360-I362 PolarHBondContact OD2-N 3.38Å; I362-H364 VanDerWaalsContact C-N 3.25Å; I362-H364 PolarHBondContact O-N 3Å; I362-D365 PolarHBondContact O-N 3.32Å; I362-D365 VanDerWaalsContact O-N 3.14Å; I362-V366 HydrophobicContact CG2-CG2 4.47Å; I362-V366 WeakPolarHBondContact O-CG2 3.46Å; I362-V366 PolarHBondContact O-N 3.19Å; I362-E382 HydrophobicContact CG2-CG 4.44Å; I362-R413 HydrophobicContact CD1-CB 3.83Å; I362-R413 HydrophobicContact CD1-CG 4.13Å; I362-R413 HydrophobicContact CG1-CB 4.31Å
363	F	88.1	Confident	87.1	Confident	1 Å²	1	25 Å²	25	0%	0.004	12%	0.115	C	C	.	.	H	α-helix	trans	-61.3	-40.3	-179.4	-175.2	-97.6	0	0	0	111	M354 L357 M358 D360 V366 A367 L376 I380	M354-F363 HydrophobicContact CE-CE1 4.35Å; L357-F363 HydrophobicContact CB-CD1 3.8Å; L357-F363 HydrophobicContact CB-CE1 3.99Å; L357-F363 HydrophobicContact CB-CG 4.27Å; L357-F363 HydrophobicContact CD2-CD2 4.47Å; L357-F363 HydrophobicContact CD2-CG 4.28Å; L357-F363 WeakPolarHBondContact O-CD1 2.9Å; M358-F363 HydrophobicContact SD-CD1 4.11Å; M358-F363 HydrophobicContact SD-CE1 3.68Å; D360-F363 HydrophobicContact CB-CB 4.38Å; D360-F363 PolarHBondContact OD2-N 3.22Å; D360-F363 VanDerWaalsContact OD2-N 3.16Å; F363-V366 PolarHBondContact O-N 2.96Å; F363-A367 WeakPolarHBondContact O-CB 3.45Å; F363-A367 PolarHBondContact O-N 3.04Å; F363-L376 HydrophobicContact CZ-CD2 4.45Å; F363-I380 HydrophobicContact CD2-CG1 4.35Å; F363-I380 HydrophobicContact CE2-CG1 3.62Å; F363-I380 HydrophobicContact CZ-CG1 4.24Å
364	H	86.1	Confident	87	Confident	17 Å²	17	27.6 Å²	27.6	8%	0.079	13%	0.131	C	C	.	.	H	α-helix	trans	-49.7	-58.3	168.9	172.3	-90.9	0	0	0	112.6	P111 H112 L114 D360 I362 V366 A367 Y368	P111-H364 WeakPolarHBondContact CB-CE1 3.38Å; H112-H364 PolarHBondContact O-CE1 2.92Å; H112-H364 PolarHBondContact O-NE2 3.34Å; L114-H364 VanDerWaalsContact CD1-CD2 3.42Å; L114-H364 WeakPolarHBondContact CD1-CD2 3.42Å; D360-H364 WeakPolarHBondContact O-CB 2.99Å; D360-H364 PolarHBondContact O-N 3.16Å; I362-H364 VanDerWaalsContact C-N 3.25Å; I362-H364 PolarHBondContact O-N 3Å; H364-V366 VanDerWaalsContact C-N 3.26Å; H364-V366 PolarHBondContact O-N 3.45Å; H364-A367 PolarHBondContact O-N 3.38Å; H364-A367 VanDerWaalsContact O-N 3.13Å; H364-Y368 AromaticContact CD2-CE2 3.88Å; H364-Y368 AromaticContact CE1-CD2 3.89Å; H364-Y368 AromaticContact CE1-CE2 3.56Å; H364-Y368 AromaticContact NE2-CD2 3.99Å; H364-Y368 AromaticContact NE2-CE2 3.29Å; H364-Y368 VanDerWaalsContact NE2-CE2 3.29Å; H364-Y368 WeakPolarHBondContact NE2-CE2 3.5Å; H364-Y368 WeakPolarHBondContact O-CD2 3.38Å; H364-Y368 PolarHBondContact O-N 2.9Å
365	D	85.6	Confident	86.8	Confident	17 Å²	17	28.2 Å²	28.2	9%	0.091	13%	0.134	C	C	.	.	H	α-helix	trans	-64.6	-33.7	-177.2	-72.6	-8.2	0	0	0	111.3	L100 P111 E361 I362 K369 K414	L100-D365 HydrophobicContact CD2-CB 3.41Å; L100-D365 VanDerWaalsContact CD2-CB 3.41Å; P111-D365 VanDerWaalsContact CB-OD1 3.25Å; P111-D365 WeakPolarHBondContact CB-OD1 3.28Å; P111-D365 WeakPolarHBondContact CG-OD1 3.43Å; E361-D365 WeakPolarHBondContact O-CB 3.37Å; E361-D365 PolarHBondContact O-N 3.4Å; I362-D365 PolarHBondContact O-N 3.32Å; I362-D365 VanDerWaalsContact O-N 3.14Å; D365-K369 PolarHBondContact O-N 3.46Å; D365-K414 IonicContact OD2-NZ 2.8Å; D365-K414 PolarHBondContact OD2-NZ 2.67Å
366	V	88.4	Confident	86.7	Confident	0 Å²	0	28.2 Å²	28.2	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-65.3	-43.9	172.5	172.8	0	0	0	0	111.1	V96 L100 I362 F363 H364 Y368 K369 A370 D375	V96-V366 HydrophobicContact CG1-CG2 3.71Å; V96-V366 HydrophobicContact CG2-CG2 4.36Å; L100-V366 HydrophobicContact CD2-CG2 4.48Å; I362-V366 HydrophobicContact CG2-CG2 4.47Å; I362-V366 WeakPolarHBondContact O-CG2 3.46Å; I362-V366 PolarHBondContact O-N 3.19Å; F363-V366 PolarHBondContact O-N 2.96Å; H364-V366 VanDerWaalsContact C-N 3.26Å; H364-V366 PolarHBondContact O-N 3.45Å; V366-Y368 VanDerWaalsContact C-N 3.29Å; V366-Y368 PolarHBondContact O-N 2.99Å; V366-K369 CarbonylContact O-C 3.58Å; V366-K369 PolarHBondContact O-N 3.38Å; V366-A370 WeakPolarHBondContact O-CA 3.33Å; V366-A370 VanDerWaalsContact O-CB 3.31Å; V366-A370 WeakPolarHBondContact O-CB 3.35Å; V366-A370 PolarHBondContact O-N 3.15Å; V366-D375 WeakPolarHBondContact CG1-O 3.45Å
367	A	89.4	Confident	86.8	Confident	0 Å²	0	28.9 Å²	28.9	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-62.4	-34.6	-179.8	0	0	0	0	0	112.8	R314 F333 M358 F363 H364 L376	R314-A367 PolarHBondContact NH1-O 3.47Å; F333-A367 HydrophobicContact CE1-CB 4.01Å; F333-A367 HydrophobicContact CZ-CB 4.15Å; M358-A367 HydrophobicContact CE-CB 4.48Å; M358-A367 HydrophobicContact SD-CB 4.48Å; F363-A367 WeakPolarHBondContact O-CB 3.45Å; F363-A367 PolarHBondContact O-N 3.04Å; H364-A367 PolarHBondContact O-N 3.38Å; H364-A367 VanDerWaalsContact O-N 3.13Å; A367-L376 HydrophobicContact CB-CD2 4.16Å
368	Y	88.5	Confident	86.7	Confident	2 Å²	2	29.4 Å²	29.4	1%	0.008	14%	0.141	C	C	.	.	H	α-helix	trans	-68.5	-36.5	172	-83.3	-90.9	0	0	0	112.8	H109 P111 E293 R314 R332 F333 H364 V366	H109-Y368 PolarHBondContact CD2-O 3.02Å; P111-Y368 HydrophobicContact CB-CD2 4.16Å; P111-Y368 HydrophobicContact CB-CE2 4.49Å; P111-Y368 HydrophobicContact CB-CG 4.41Å; E293-Y368 PolarHBondContact OE2-OH 3.09Å; R314-Y368 PolarHBondContact NH1-O 3.47Å; R332-Y368 HydrophobicContact CG-CE1 4.19Å; F333-Y368 HydrophobicContact CE2-CD2 4.11Å; F333-Y368 HydrophobicContact CE2-CE1 4.26Å; F333-Y368 AromaticContact CE2-CE2 3.57Å; F333-Y368 HydrophobicContact CE2-CE2 3.57Å; F333-Y368 AromaticContact CE2-CZ 3.68Å; F333-Y368 HydrophobicContact CZ-CD1 4.34Å; F333-Y368 AromaticContact CZ-CD2 3.86Å; F333-Y368 HydrophobicContact CZ-CD2 3.86Å; F333-Y368 HydrophobicContact CZ-CE1 4.33Å; F333-Y368 AromaticContact CZ-CE2 3.81Å; F333-Y368 HydrophobicContact CZ-CE2 3.81Å; F333-Y368 HydrophobicContact CZ-CG 4.13Å; H364-Y368 AromaticContact CD2-CE2 3.88Å; H364-Y368 AromaticContact CE1-CD2 3.89Å; H364-Y368 AromaticContact CE1-CE2 3.56Å; H364-Y368 AromaticContact NE2-CD2 3.99Å; H364-Y368 AromaticContact NE2-CE2 3.29Å; H364-Y368 VanDerWaalsContact NE2-CE2 3.29Å; H364-Y368 WeakPolarHBondContact NE2-CE2 3.5Å; H364-Y368 WeakPolarHBondContact O-CD2 3.38Å; H364-Y368 PolarHBondContact O-N 2.9Å; V366-Y368 VanDerWaalsContact C-N 3.29Å; V366-Y368 PolarHBondContact O-N 2.99Å
369	K	86.8	Confident	86.7	Confident	58 Å²	58	29.4 Å²	29.4	25%	0.252	14%	0.142	S	C	.	.	H	α-helix	trans	-96.5	-10.8	-174.4	-67.7	-170.1	174.4	-162.2	0	115.2	I99 L100 T102 D365 V366 K371	I99-K369 HydrophobicContact CG2-CB 3.59Å; I99-K369 HydrophobicContact CG2-CD 4.25Å; I99-K369 WeakPolarHBondContact O-CD 3.47Å; I99-K369 PolarHBondContact O-NZ 3.05Å; L100-K369 PolarHBondContact O-NZ 3.14Å; T102-K369 PolarHBondContact O-NZ 3.23Å; D365-K369 PolarHBondContact O-N 3.46Å; V366-K369 CarbonylContact O-C 3.58Å; V366-K369 PolarHBondContact O-N 3.38Å; K369-K371 PolarHBondContact O-N 3.33Å
370	A	87.9	Confident	87.1	Confident	0 Å²	0	28.2 Å²	28.2	0%	0	13%	0.134	C	C	.	.			trans	-57.8	135.4	-175.8	0	0	0	0	0	111.1	L178 R314 V366 D375 L376	L178-A370 HydrophobicContact CD1-CB 4.4Å; R314-A370 VanDerWaalsContact CZ-O 3.3Å; R314-A370 PolarHBondContact NH1-O 3.01Å; R314-A370 PolarHBondContact NH2-O 3.19Å; V366-A370 WeakPolarHBondContact O-CA 3.33Å; V366-A370 VanDerWaalsContact O-CB 3.31Å; V366-A370 WeakPolarHBondContact O-CB 3.35Å; V366-A370 PolarHBondContact O-N 3.15Å; A370-D375 HydrophobicContact CB-CB 3.93Å; A370-L376 HydrophobicContact CB-CD2 3.91Å; A370-L376 HydrophobicContact CB-CG 4.02Å
371	K	85.4	Confident	87.2	Confident	142 Å²	142	29.6 Å²	29.6	62%	0.617	14%	0.142	S	C	*	.			trans	-105.8	-31.5	174.4	-66.1	-178.8	-176.5	174.5	0	111.2	D104 L178 K369 D375	D104-K371 IonicContact OD2-NZ 3.52Å; L178-K371 WeakPolarHBondContact CD1-O 3.42Å; K369-K371 PolarHBondContact O-N 3.33Å; K371-D375 PolarHBondContact N-OD2 3.15Å
372	D	86.1	Confident	87.6	Confident	100 Å²	100	28.6 Å²	28.6	54%	0.535	14%	0.137	S	C	.	.	S	Bend	trans	-129.9	162.5	-179	-66.4	-49.9	0	0	0	112.4	T374 D375	D372-T374 PolarHBondContact O-N 2.81Å; D372-T374 VanDerWaalsContact O-N 3.13Å; D372-D375 PolarHBondContact N-OD2 3.07Å; D372-D375 WeakPolarHBondContact O-CB 2.92Å; D372-D375 PolarHBondContact O-N 2.84Å; D372-D375 VanDerWaalsContact O-N 3.09Å
373	R	88.2	Confident	87.7	Confident	108 Å²	108	28.8 Å²	28.8	41%	0.408	14%	0.138	S	C	.	.	H	α-helix	trans	-56.8	-28.2	174.7	71.4	176.6	73.6	-163.2	-0.9	113.4	L172 V176 D375 L376 L377	L172-R373 PolarHBondContact O-NH1 2.93Å; V176-R373 HydrophobicContact CB-CB 4.34Å; V176-R373 HydrophobicContact CG1-CB 4.42Å; V176-R373 HydrophobicContact CG2-CB 4.13Å; R373-D375 VanDerWaalsContact C-N 3.3Å; R373-D375 PolarHBondContact O-N 3Å; R373-L376 PolarHBondContact O-N 3.25Å; R373-L377 WeakPolarHBondContact O-CG 2.96Å; R373-L377 PolarHBondContact O-N 2.97Å; R373-L377 VanDerWaalsContact O-N 3.13Å
374	T	88.4	Confident	87.5	Confident	55 Å²	55	30.4 Å²	30.4	34%	0.337	15%	0.146	S	C	.	.	H	α-helix	trans	-71.4	-25.4	-179.1	48.5	0	0	0	0	112.5	R95 D372 S378	R95-T374 PolarHBondContact NH2-OG1 3.2Å; D372-T374 PolarHBondContact O-N 2.81Å; D372-T374 VanDerWaalsContact O-N 3.13Å; T374-S378 WeakPolarHBondContact O-CB 3.33Å; T374-S378 PolarHBondContact O-N 3.03Å; T374-S378 PolarHBondContact O-OG 3.24Å
375	D	88.8	Confident	87.2	Confident	14 Å²	14	35.3 Å²	35.3	8%	0.075	17%	0.173	C	C	.	.	H	α-helix	trans	-71.7	-41.6	174.6	-63	-23.4	0	0	0	111.2	R95 I99 V366 A370 K371 D372 R373 S378 G379	R95-D375 IonicContact CZ-OD1 2.8Å; R95-D375 IonicContact NE-OD1 2.69Å; R95-D375 PolarHBondContact NE-OD1 2.91Å; R95-D375 VanDerWaalsContact NE-OD1 3.11Å; R95-D375 IonicContact NH2-OD1 3.82Å; R95-D375 PolarHBondContact NH2-OD1 2.76Å; I99-D375 HydrophobicContact CD1-CB 3.75Å; V366-D375 WeakPolarHBondContact CG1-O 3.45Å; A370-D375 HydrophobicContact CB-CB 3.93Å; K371-D375 PolarHBondContact N-OD2 3.15Å; D372-D375 PolarHBondContact N-OD2 3.07Å; D372-D375 WeakPolarHBondContact O-CB 2.92Å; D372-D375 PolarHBondContact O-N 2.84Å; D372-D375 VanDerWaalsContact O-N 3.09Å; R373-D375 VanDerWaalsContact C-N 3.3Å; R373-D375 PolarHBondContact O-N 3Å; D375-S378 PolarHBondContact O-N 3.45Å; D375-G379 PolarHBondContact O-N 3.39Å
376	L	89.1	Confident	86.4	Confident	1 Å²	1	37 Å²	37	1%	0.005	18%	0.181	C	C	.	.	H	α-helix	trans	-62.9	-44.8	174	-66.3	173.3	0	0	0	111.2	I171 V176 L178 F312 F363 A367 A370 R373 S378 G379 I380	I171-L376 HydrophobicContact CG2-CB 4.43Å; V176-L376 HydrophobicContact CG1-CD1 4.13Å; L178-L376 HydrophobicContact CD2-CD1 4.5Å; F312-L376 HydrophobicContact CD1-CD1 3.59Å; F312-L376 HydrophobicContact CE1-CD1 3.5Å; F312-L376 VanDerWaalsContact CE1-CD1 3.5Å; F312-L376 HydrophobicContact CE1-CD2 4.22Å; F312-L376 HydrophobicContact CZ-CD1 4.38Å; F312-L376 HydrophobicContact CZ-CD2 4.5Å; F363-L376 HydrophobicContact CZ-CD2 4.45Å; A367-L376 HydrophobicContact CB-CD2 4.16Å; A370-L376 HydrophobicContact CB-CD2 3.91Å; A370-L376 HydrophobicContact CB-CG 4.02Å; R373-L376 PolarHBondContact O-N 3.25Å; L376-S378 VanDerWaalsContact C-N 3.3Å; L376-S378 PolarHBondContact O-N 3.01Å; L376-G379 WeakPolarHBondContact O-CA 3.47Å; L376-G379 PolarHBondContact O-N 3.45Å; L376-G379 VanDerWaalsContact O-N 3.08Å; L376-I380 WeakPolarHBondContact O-CG1 3.07Å; L376-I380 PolarHBondContact O-N 3.38Å
377	L	90.6	Very high	85.7	Confident	14 Å²	14	38 Å²	38	7%	0.073	19%	0.187	C	C	.	.	H	α-helix	trans	-59.7	-41.2	175.9	-70.8	169.8	0	0	0	111.9	R168 I171 L172 R373 G379 I380 D381	R168-L377 HydrophobicContact CG-CD2 3.86Å; R168-L377 WeakPolarHBondContact O-CD2 3.24Å; I171-L377 HydrophobicContact CB-CD2 4.28Å; I171-L377 HydrophobicContact CG2-CD2 4.04Å; I171-L377 HydrophobicContact CG2-CG 4.25Å; L172-L377 HydrophobicContact CB-CD1 4.32Å; L172-L377 HydrophobicContact CB-CD2 4.37Å; L172-L377 HydrophobicContact CD1-CD1 3.63Å; R373-L377 WeakPolarHBondContact O-CG 2.96Å; R373-L377 PolarHBondContact O-N 2.97Å; R373-L377 VanDerWaalsContact O-N 3.13Å; L377-G379 VanDerWaalsContact C-N 3.27Å; L377-G379 PolarHBondContact O-N 2.71Å; L377-I380 PolarHBondContact O-N 3.2Å; L377-I380 VanDerWaalsContact O-N 3.14Å; L377-D381 PolarHBondContact O-N 3.43Å
378	S	88.1	Confident	84.8	Confident	12 Å²	12	41.4 Å²	41.4	8%	0.084	21%	0.207	C	C	.	.	H	α-helix	trans	-64.6	-33.6	176	-54.7	0	0	0	0	111.8	R95 V96 T374 D375 L376 E382	R95-S378 WeakPolarHBondContact CD-OG 3.37Å; V96-S378 WeakPolarHBondContact CG2-O 3.49Å; T374-S378 WeakPolarHBondContact O-CB 3.33Å; T374-S378 PolarHBondContact O-N 3.03Å; T374-S378 PolarHBondContact O-OG 3.24Å; D375-S378 PolarHBondContact O-N 3.45Å; L376-S378 VanDerWaalsContact C-N 3.3Å; L376-S378 PolarHBondContact O-N 3.01Å; S378-E382 WeakPolarHBondContact O-CB 3.3Å; S378-E382 PolarHBondContact O-N 2.93Å
379	G	87.9	Confident	83.9	Confident	1 Å²	1	45.6 Å²	45.6	1%	0.01	23%	0.233	C	C	.	.	H	α-helix	trans	-65.6	-37.7	171.8	0	0	0	0	0	113.4	D375 L376 L377 F383	D375-G379 PolarHBondContact O-N 3.39Å; L376-G379 WeakPolarHBondContact O-CA 3.47Å; L376-G379 PolarHBondContact O-N 3.45Å; L376-G379 VanDerWaalsContact O-N 3.08Å; L377-G379 VanDerWaalsContact C-N 3.27Å; L377-G379 PolarHBondContact O-N 2.71Å; G379-F383 WeakPolarHBondContact O-CB 3.46Å; G379-F383 PolarHBondContact O-N 3Å
380	I	90.1	Very high	83.1	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-69.8	-43.5	175.9	-60.5	171.7	0	0	0	110.6	R168 I171 L357 F363 L376 L377 E382 F383 L384	R168-I380 HydrophobicContact CB-CG2 4.35Å; I171-I380 HydrophobicContact CD1-CD1 3.52Å; L357-I380 HydrophobicContact CD1-CG1 4.24Å; F363-I380 HydrophobicContact CD2-CG1 4.35Å; F363-I380 HydrophobicContact CE2-CG1 3.62Å; F363-I380 HydrophobicContact CZ-CG1 4.24Å; L376-I380 WeakPolarHBondContact O-CG1 3.07Å; L376-I380 PolarHBondContact O-N 3.38Å; L377-I380 PolarHBondContact O-N 3.2Å; L377-I380 VanDerWaalsContact O-N 3.14Å; I380-E382 VanDerWaalsContact C-N 3.35Å; I380-F383 WeakPolarHBondContact O-CB 3.3Å; I380-F383 PolarHBondContact O-N 3.06Å; I380-F383 VanDerWaalsContact O-N 3.15Å; I380-L384 HydrophobicContact CG2-CD1 4.21Å; I380-L384 HydrophobicContact CG2-CG 4.49Å; I380-L384 WeakPolarHBondContact O-CG 3.39Å; I380-L384 PolarHBondContact O-N 3.32Å
381	D	87.9	Confident	82.1	Confident	35 Å²	35	47.4 Å²	47.4	19%	0.187	25%	0.249	C	C	.	.	H	α-helix	trans	-63	-42.8	178.4	-67.4	-21.8	0	0	0	110.3	P92 R168 L377 F383 L384 D385	P92-D381 HydrophobicContact CB-CB 4.06Å; P92-D381 HydrophobicContact CG-CB 4.21Å; R168-D381 WeakPolarHBondContact CD-OD1 3.48Å; R168-D381 IonicContact CZ-OD1 3.72Å; R168-D381 IonicContact NE-OD1 2.77Å; R168-D381 PolarHBondContact NE-OD1 3.4Å; R168-D381 IonicContact NE-OD2 3.45Å; R168-D381 IonicContact NH2-OD2 3.83Å; L377-D381 PolarHBondContact O-N 3.43Å; D381-F383 VanDerWaalsContact C-N 3.29Å; D381-F383 PolarHBondContact O-N 3.26Å; D381-L384 PolarHBondContact O-N 2.75Å; D381-D385 PolarHBondContact O-N 2.86Å
382	E	85	Confident	80.7	Confident	17 Å²	17	43.2 Å²	43.2	8%	0.079	24%	0.236	C	C	.	.	H	α-helix	trans	-63.7	-33	173.4	179.9	64.9	-170.7	0	0	112.9	S93 V96 I362 S378 I380 Q386	S93-E382 WeakPolarHBondContact CA-OE2 3.4Å; S93-E382 WeakPolarHBondContact CB-OE2 3.39Å; S93-E382 PolarHBondContact OG-OE2 3.26Å; V96-E382 HydrophobicContact CB-CG 4.49Å; V96-E382 HydrophobicContact CG1-CG 4.31Å; V96-E382 HydrophobicContact CG2-CB 4Å; V96-E382 HydrophobicContact CG2-CG 4.41Å; I362-E382 HydrophobicContact CG2-CG 4.44Å; S378-E382 WeakPolarHBondContact O-CB 3.3Å; S378-E382 PolarHBondContact O-N 2.93Å; I380-E382 VanDerWaalsContact C-N 3.35Å; E382-Q386 WeakPolarHBondContact O-CG 3.28Å; E382-Q386 PolarHBondContact OE1-NE2 2.93Å
383	F	85.1	Confident	79.3	Confident	11 Å²	11	42 Å²	42	5%	0.048	25%	0.247	C	C	.	.	H	α-helix	trans	-66	-50.9	172.8	176.3	-96.3	0	0	0	110.4	V48 L159 L164 L357 D360 G379 I380 D381 D385 Q386 V387	V48-F383 HydrophobicContact CG1-CE2 3.99Å; V48-F383 HydrophobicContact CG1-CZ 4.15Å; V48-F383 HydrophobicContact CG2-CZ 3.85Å; L159-F383 HydrophobicContact CD1-CE1 4.5Å; L159-F383 HydrophobicContact CD1-CZ 4.47Å; L164-F383 HydrophobicContact CD1-CE1 4.02Å; L164-F383 HydrophobicContact CD2-CD1 4.38Å; L164-F383 HydrophobicContact CD2-CE1 4.05Å; L357-F383 HydrophobicContact CD2-CB 3.71Å; L357-F383 HydrophobicContact CD2-CD1 3.34Å; L357-F383 HydrophobicContact CD2-CD2 3.6Å; L357-F383 HydrophobicContact CD2-CE1 3.69Å; L357-F383 HydrophobicContact CD2-CE2 3.94Å; L357-F383 HydrophobicContact CD2-CG 3.26Å; L357-F383 HydrophobicContact CD2-CZ 3.97Å; L357-F383 HydrophobicContact CG-CD1 4.42Å; L357-F383 HydrophobicContact CG-CE1 4.4Å; D360-F383 HydrophobicContact CB-CD2 4.21Å; D360-F383 HydrophobicContact CB-CE2 4.19Å; G379-F383 WeakPolarHBondContact O-CB 3.46Å; G379-F383 PolarHBondContact O-N 3Å; I380-F383 WeakPolarHBondContact O-CB 3.3Å; I380-F383 PolarHBondContact O-N 3.06Å; I380-F383 VanDerWaalsContact O-N 3.15Å; D381-F383 VanDerWaalsContact C-N 3.29Å; D381-F383 PolarHBondContact O-N 3.26Å; F383-D385 VanDerWaalsContact C-N 3.31Å; F383-D385 PolarHBondContact O-N 2.92Å; F383-Q386 PolarHBondContact O-N 3.01Å; F383-V387 HydrophobicContact CD1-CG2 3.67Å; F383-V387 HydrophobicContact CD2-CG2 4.47Å; F383-V387 HydrophobicContact CE1-CG2 3.54Å; F383-V387 HydrophobicContact CE2-CG2 4.35Å; F383-V387 HydrophobicContact CG-CG2 4.17Å; F383-V387 HydrophobicContact CZ-CG2 3.91Å; F383-V387 WeakPolarHBondContact O-CG2 3.25Å; F383-V387 PolarHBondContact O-N 3.46Å
384	L	83.8	Confident	77.8	Confident	35 Å²	35	45.4 Å²	45.4	18%	0.183	27%	0.268	C	S	.	.	H	α-helix	trans	-55.6	-42.2	-179.3	-77.8	171.1	0	0	0	112.7	L164 F165 I380 D381 Q386 V387	L164-L384 HydrophobicContact CB-CD2 3.94Å; L164-L384 HydrophobicContact CD1-CD2 3.79Å; L164-L384 HydrophobicContact CG-CD2 4.42Å; F165-L384 HydrophobicContact CD1-CD1 4.33Å; F165-L384 HydrophobicContact CE1-CD1 4.06Å; I380-L384 HydrophobicContact CG2-CD1 4.21Å; I380-L384 HydrophobicContact CG2-CG 4.49Å; I380-L384 WeakPolarHBondContact O-CG 3.39Å; I380-L384 PolarHBondContact O-N 3.32Å; D381-L384 PolarHBondContact O-N 2.75Å; L384-Q386 PolarHBondContact O-N 2.64Å; L384-Q386 VanDerWaalsContact O-N 3.14Å; L384-V387 PolarHBondContact O-N 3.4Å
385	D	79.8	Confident	76.5	Confident	120 Å²	120	45.9 Å²	45.9	64%	0.642	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-19.5	178.3	-77.9	-12.8	0	0	0	113.7	D381 F383	D381-D385 PolarHBondContact O-N 2.86Å; F383-D385 VanDerWaalsContact C-N 3.31Å; F383-D385 PolarHBondContact O-N 2.92Å
386	Q	69.5	Low	75	Confident	53 Å²	53	48.8 Å²	48.8	25%	0.248	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.5	-9.2	-172.7	-66.4	-174.4	14.6	0	0	114.6	E382 F383 L384 R413	E382-Q386 WeakPolarHBondContact O-CG 3.28Å; E382-Q386 PolarHBondContact OE1-NE2 2.93Å; F383-Q386 PolarHBondContact O-N 3.01Å; L384-Q386 PolarHBondContact O-N 2.64Å; L384-Q386 VanDerWaalsContact O-N 3.14Å; Q386-R413 VanDerWaalsContact OE1-NH1 3.09Å
387	V	74	Confident	73.7	Confident	21 Å²	21	51 Å²	51	13%	0.127	29%	0.293	C	S	.	.	P	Polyproline II helix	trans	-84.2	144.6	-173.2	-149.1	0	0	0	0	112	V46 G47 F383 L384	V46-V387 HydrophobicContact CB-CG1 4.28Å; V46-V387 HydrophobicContact CG1-CB 3.2Å; V46-V387 HydrophobicContact CG1-CG1 3Å; V46-V387 HydrophobicContact CG1-CG2 3.7Å; G47-V387 VanDerWaalsContact C-CG1 3.43Å; G47-V387 WeakPolarHBondContact O-CG1 3.35Å; F383-V387 HydrophobicContact CD1-CG2 3.67Å; F383-V387 HydrophobicContact CD2-CG2 4.47Å; F383-V387 HydrophobicContact CE1-CG2 3.54Å; F383-V387 HydrophobicContact CE2-CG2 4.35Å; F383-V387 HydrophobicContact CG-CG2 4.17Å; F383-V387 HydrophobicContact CZ-CG2 3.91Å; F383-V387 WeakPolarHBondContact O-CG2 3.25Å; F383-V387 PolarHBondContact O-N 3.46Å; L384-V387 PolarHBondContact O-N 3.4Å
388	T	69.9	Low	72.4	Confident	70 Å²	70	55.6 Å²	55.6	43%	0.429	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	123	179.5	51.1	0	0	0	0	110.3	G47	G47-T388 PolarHBondContact N-O 3.47Å; G47-T388 PolarHBondContact O-OG1 3Å; G47-T388 VanDerWaalsContact O-OG1 3.09Å
389	V	69.8	Low	71.2	Confident	90 Å²	90	59.5 Å²	59.5	55%	0.545	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	127.7	175.2	177.2	0	0	0	0	110	V44	V44-V389 HydrophobicContact CG1-CB 4.47Å; V44-V389 HydrophobicContact CG1-CG1 3.29Å
390	L	70.7	Confident	70.3	Confident	31 Å²	31	64.8 Å²	64.8	16%	0.162	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	131.8	172	-63.3	172.4	0	0	0	108.9	Y45 T158 W395	Y45-L390 PolarHBondContact O-N 3.41Å; T158-L390 HydrophobicContact CG2-CD1 3.96Å; L390-W395 HydrophobicContact CD1-CD2 4.49Å; L390-W395 HydrophobicContact CD1-CG 4.44Å
391	P	65.3	Low	69.3	Low	66 Å²	66	67.3 Å²	67.3	43%	0.429	37%	0.374	S	S	.	.	P	Polyproline II helix	trans	-66.3	129.2	-179.1	25.5	-32.4	0	0	0	111.1	G393 E394	P391-G393 PolarHBondContact O-N 3.44Å; P391-G393 VanDerWaalsContact O-N 3.17Å; P391-E394 HydrophobicContact CG-CB 4.39Å
392	P	57.6	Low	68	Low	54 Å²	54	73.2 Å²	73.2	35%	0.351	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-9.9	-172.9	27.8	-35.9	0	0	0	114.9	A43	A43-P392 WeakPolarHBondContact O-CB 3.49Å
393	G	55.8	Low	66.9	Low	75 Å²	75	73.5 Å²	73.5	77%	0.773	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.3	-11.3	-176.3	0	0	0	0	0	116	P391	P391-G393 PolarHBondContact O-N 3.44Å; P391-G393 VanDerWaalsContact O-N 3.17Å
394	E	57.4	Low	65.4	Low	178 Å²	178	76.2 Å²	76.2	83%	0.832	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.5	-6.2	-178.4	-68.8	-177.1	170.2	0	0	112.8	P391	P391-E394 HydrophobicContact CG-CB 4.39Å
395	W	60.1	Low	63.5	Low	66 Å²	66	82.3 Å²	82.3	25%	0.25	45%	0.447	C	S	.	.			trans	-118.5	126.8	-172.7	-174.7	-97.1	0	0	0	111.2	L390 I399 I401	L390-W395 HydrophobicContact CD1-CD2 4.49Å; L390-W395 HydrophobicContact CD1-CG 4.44Å; W395-I399 HydrophobicContact CH2-CB 4.47Å; W395-I399 HydrophobicContact CH2-CG2 4.14Å; W395-I399 HydrophobicContact CZ2-CB 4.38Å; W395-I399 HydrophobicContact CZ2-CG2 4.49Å; W395-I399 WeakPolarHBondContact CZ2-O 3.38Å; W395-I401 HydrophobicContact CH2-CD1 3.63Å; W395-I401 HydrophobicContact CH2-CG1 3.26Å; W395-I401 HydrophobicContact CZ2-CD1 3.48Å; W395-I401 VanDerWaalsContact CZ2-CD1 3.48Å; W395-I401 HydrophobicContact CZ2-CG1 3.35Å; W395-I401 HydrophobicContact CZ3-CD1 4.5Å; W395-I401 HydrophobicContact CZ3-CG1 4.38Å
396	D	58.6	Low	61.7	Low	75 Å²	75	82.2 Å²	82.2	40%	0.401	45%	0.447	S	S	.	.			trans	-92.9	119.6	173.4	-179.5	-14.3	0	0	0	109.6	T398 I399	D396-T398 PolarHBondContact O-N 2.93Å; D396-T398 VanDerWaalsContact O-N 3.14Å; D396-T398 WeakPolarHBondContact OD1-CB 3.34Å; D396-T398 PolarHBondContact OD1-N 3.26Å; D396-T398 PolarHBondContact OD1-OG1 3.33Å; D396-T398 PolarHBondContact OD2-OG1 3.19Å; D396-I399 HydrophobicContact CB-CD1 3.69Å; D396-I399 HydrophobicContact CB-CG1 3.82Å; D396-I399 PolarHBondContact O-N 3.1Å; D396-I399 VanDerWaalsContact O-N 3.09Å
397	P	61.3	Low	60.8	Low	46 Å²	46	80.9 Å²	80.9	30%	0.299	44%	0.442	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-20.7	-179.9	-23.4	34.4	0	0	0	114.7	Y45 I399	Y45-P397 HydrophobicContact CD2-CG 4.31Å; Y45-P397 HydrophobicContact CE1-CB 4.11Å; Y45-P397 HydrophobicContact CE1-CG 4.18Å; Y45-P397 HydrophobicContact CE2-CB 4.33Å; Y45-P397 HydrophobicContact CE2-CG 3.52Å; Y45-P397 VanDerWaalsContact CZ-CG 3.43Å; Y45-P397 WeakPolarHBondContact OH-CG 3.33Å; P397-I399 VanDerWaalsContact C-N 3.35Å
398	T	62.8	Low	59.2	Low	112 Å²	112	82.9 Å²	82.9	69%	0.687	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.8	-15.2	179.2	68.1	0	0	0	0	113	D396 R400	D396-T398 PolarHBondContact O-N 2.93Å; D396-T398 VanDerWaalsContact O-N 3.14Å; D396-T398 WeakPolarHBondContact OD1-CB 3.34Å; D396-T398 PolarHBondContact OD1-N 3.26Å; D396-T398 PolarHBondContact OD1-OG1 3.33Å; D396-T398 PolarHBondContact OD2-OG1 3.19Å; T398-R400 PolarHBondContact O-N 3.35Å
399	I	62.6	Low	57.9	Low	93 Å²	93	82.9 Å²	82.9	48%	0.477	46%	0.458	S	S	.	.	S	Bend	trans	-78.5	108.9	179.3	-62.3	178.5	0	0	0	109.7	W395 D396 P397 I401	W395-I399 HydrophobicContact CH2-CB 4.47Å; W395-I399 HydrophobicContact CH2-CG2 4.14Å; W395-I399 HydrophobicContact CZ2-CB 4.38Å; W395-I399 HydrophobicContact CZ2-CG2 4.49Å; W395-I399 WeakPolarHBondContact CZ2-O 3.38Å; D396-I399 HydrophobicContact CB-CD1 3.69Å; D396-I399 HydrophobicContact CB-CG1 3.82Å; D396-I399 PolarHBondContact O-N 3.1Å; D396-I399 VanDerWaalsContact O-N 3.09Å; P397-I399 VanDerWaalsContact C-N 3.35Å; I399-I401 PolarHBondContact O-N 2.92Å
400	R	68.6	Low	56.8	Low	112 Å²	112	79 Å²	79	42%	0.423	43%	0.434	S	S	.	.	P	Polyproline II helix	trans	-72.6	117.6	178	-68.3	174.1	172.9	163.3	-3.9	111.4	Y155 T398 E402	Y155-R400 HydrophobicContact CD1-CB 4.17Å; Y155-R400 HydrophobicContact CD1-CG 3.81Å; Y155-R400 HydrophobicContact CD2-CB 4.42Å; Y155-R400 HydrophobicContact CD2-CG 4.23Å; Y155-R400 HydrophobicContact CE1-CG 4.08Å; Y155-R400 HydrophobicContact CE2-CG 4.49Å; Y155-R400 HydrophobicContact CG-CB 3.93Å; Y155-R400 HydrophobicContact CG-CG 3.92Å; T398-R400 PolarHBondContact O-N 3.35Å; R400-E402 PolarHBondContact O-N 3.08Å
401	I	69.4	Low	55.4	Low	53 Å²	53	83.9 Å²	83.9	27%	0.272	46%	0.458	S	S	.	.	P	Polyproline II helix	trans	-74.8	118.9	176.5	-61.8	167	0	0	0	109.9	Y155 V156 T158 W395 I399	Y155-I401 WeakPolarHBondContact CB-O 3.01Å; V156-I401 HydrophobicContact CB-CB 4.21Å; V156-I401 HydrophobicContact CB-CG2 4.29Å; V156-I401 HydrophobicContact CG2-CG2 4.17Å; V156-I401 PolarHBondContact N-O 3.17Å; T158-I401 HydrophobicContact CG2-CD1 3.93Å; W395-I401 HydrophobicContact CH2-CD1 3.63Å; W395-I401 HydrophobicContact CH2-CG1 3.26Å; W395-I401 HydrophobicContact CZ2-CD1 3.48Å; W395-I401 VanDerWaalsContact CZ2-CD1 3.48Å; W395-I401 HydrophobicContact CZ2-CG1 3.35Å; W395-I401 HydrophobicContact CZ3-CD1 4.5Å; W395-I401 HydrophobicContact CZ3-CG1 4.38Å; I399-I401 PolarHBondContact O-N 2.92Å
402	E	61.4	Low	54.6	Low	160 Å²	160	85.8 Å²	85.8	75%	0.748	46%	0.459	S	S	*	.	P	Polyproline II helix	trans	-64.6	140	173	-68.4	-163.8	163.3	0	0	111.3	R400	R400-E402 PolarHBondContact O-N 3.08Å
403	P	60.7	Low	54.4	Low	23 Å²	23	85.7 Å²	85.7	15%	0.149	45%	0.452	C	S	.	.	P	Polyproline II helix	trans	-52.1	135.6	178.5	-31.3	37.5	0	0	0	114.1	F140	F140-P403 HydrophobicContact CD1-CB 4.18Å; F140-P403 HydrophobicContact CD1-CG 3.86Å; F140-P403 HydrophobicContact CD2-CG 4.18Å; F140-P403 HydrophobicContact CE1-CB 3.59Å; F140-P403 HydrophobicContact CE1-CG 3.81Å; F140-P403 HydrophobicContact CE2-CB 4.03Å; F140-P403 HydrophobicContact CE2-CG 4.16Å; F140-P403 HydrophobicContact CG-CG 4.06Å; F140-P403 HydrophobicContact CZ-CB 3.54Å; F140-P403 HydrophobicContact CZ-CG 4Å
404	P	53.9	Low	54.1	Low	67 Å²	67	85.8 Å²	85.8	44%	0.435	43%	0.431	S	S	.	.	P	Polyproline II helix	trans	-67.3	143.9	177.3	27.1	-33.9	0	0	0	111.7	N406	P404-N406 PolarHBondContact O-N 2.9Å; P404-N406 VanDerWaalsContact O-N 3.14Å
405	K	44.4	Very low	53.3	Low	164 Å²	164	85.9 Å²	85.9	71%	0.713	42%	0.424	S	S	*	.	S	Bend	trans	-58.8	-29.2	-178.6	-66.7	179.2	-178.1	171.9	0	113.9
406	N	42.8	Very low	52.3	Low	118 Å²	118	87.9 Å²	87.9	63%	0.631	45%	0.445	S	S	*	.	S	Bend	trans	-140.8	123.1	177.3	-73.6	-46.1	0	0	0	109.8	P404	P404-N406 PolarHBondContact O-N 2.9Å; P404-N406 VanDerWaalsContact O-N 3.14Å
407	V	48.8	Very low	51.5	Low	24 Å²	24	87.9 Å²	87.9	15%	0.145	45%	0.451	C	S	.	.	P	Polyproline II helix	trans	-86.4	127.2	178.2	-167.6	0	0	0	0	109.2	V50	V50-V407 HydrophobicContact CB-CG1 3.78Å; V50-V407 HydrophobicContact CB-CG2 4.42Å; V50-V407 WeakPolarHBondContact O-CG1 3.34Å
408	P	42	Very low	50.1	Low	64 Å²	64	94.6 Å²	94.6	42%	0.416	48%	0.478	S	S	.	.	P	Polyproline II helix	trans	-60.1	144.4	176.7	-20.7	31.5	0	0	0	112.2	Q410	P408-Q410 PolarHBondContact O-N 3.17Å
409	S	41	Very low	48.8	Very low	70 Å²	70	94.5 Å²	94.5	49%	0.49	48%	0.479	S	S	.	.	P	Polyproline II helix	trans	-75.8	125.3	-179	65	0	0	0	0	112.2	M411	S409-M411 VanDerWaalsContact C-N 3.29Å; S409-M411 PolarHBondContact O-N 2.98Å
410	Q	47.8	Very low	47.2	Very low	8 Å²	8	97.2 Å²	97.2	4%	0.037	50%	0.495	C	S	.	.	G	3₁₀ helix	trans	-81.8	2.6	175.5	-60	-170.2	-1.6	0	0	113.9	H49 D360 P408 K412 R413	H49-Q410 PolarHBondContact O-NE2 3.35Å; D360-Q410 PolarHBondContact OD1-NE2 2.9Å; P408-Q410 PolarHBondContact O-N 3.17Å; Q410-K412 PolarHBondContact O-N 2.93Å; Q410-R413 HydrophobicContact CB-CG 4.35Å; Q410-R413 VanDerWaalsContact CD-CZ 3.49Å; Q410-R413 WeakPolarHBondContact O-CB 3.45Å; Q410-R413 VanDerWaalsContact O-CG 3.23Å; Q410-R413 WeakPolarHBondContact O-CG 3.33Å; Q410-R413 PolarHBondContact O-N 3.4Å; Q410-R413 VanDerWaalsContact OE1-NH1 3.15Å
411	M	40.6	Very low	45.6	Very low	133 Å²	133	95.9 Å²	95.9	66%	0.655	52%	0.516	S	S	*	.	G	3₁₀ helix	trans	-58.6	-21.1	-176.3	-78.4	-178.7	93	0	0	115.5	S409 R413	S409-M411 VanDerWaalsContact C-N 3.29Å; S409-M411 PolarHBondContact O-N 2.98Å; M411-R413 PolarHBondContact O-N 3.23Å
412	K	49.6	Very low	43.4	Very low	107 Å²	107	100.2 Å²	100.2	47%	0.465	54%	0.54	S	S	.	.	G	3₁₀ helix	trans	-65.6	-26	172.3	-69.8	-178.3	-175.1	171.3	0	112	Q410 K414 K1016	Q410-K412 PolarHBondContact O-N 2.93Å; K412-K414 VanDerWaalsContact C-N 3.35Å; K412-K1016 VanDerWaalsContact CE-CE 3.5Å
413	R	53.7	Low	41.8	Very low	51 Å²	51	97 Å²	97	19%	0.192	54%	0.541	C	S	.	.	G	3₁₀ helix	trans	-75.3	-20.8	-177.4	-51.1	-177	-173.5	177.1	-8	113.4	D360 I362 Q386 Q410 M411	D360-R413 IonicContact OD1-NH1 3.05Å; I362-R413 HydrophobicContact CD1-CB 3.83Å; I362-R413 HydrophobicContact CD1-CG 4.13Å; I362-R413 HydrophobicContact CG1-CB 4.31Å; Q386-R413 VanDerWaalsContact OE1-NH1 3.09Å; Q410-R413 HydrophobicContact CB-CG 4.35Å; Q410-R413 VanDerWaalsContact CD-CZ 3.49Å; Q410-R413 WeakPolarHBondContact O-CB 3.45Å; Q410-R413 VanDerWaalsContact O-CG 3.23Å; Q410-R413 WeakPolarHBondContact O-CG 3.33Å; Q410-R413 PolarHBondContact O-N 3.4Å; Q410-R413 VanDerWaalsContact OE1-NH1 3.15Å; M411-R413 PolarHBondContact O-N 3.23Å
414	K	48.8	Very low	40.2	Very low	78 Å²	78	101.3 Å²	101.3	34%	0.339	57%	0.569	S	S	.	*	G	3₁₀ helix	trans	-96.3	5.6	-178.4	-56.5	-167	-175.6	-165.9	0	114.4	E361 D365 K412	E361-K414 WeakPolarHBondContact OE2-CE 3.2Å; E361-K414 IonicContact OE2-NZ 2.59Å; E361-K414 PolarHBondContact OE2-NZ 2.89Å; D365-K414 IonicContact OD2-NZ 2.8Å; D365-K414 PolarHBondContact OD2-NZ 2.67Å; K412-K414 VanDerWaalsContact C-N 3.35Å
415	R	40.2	Very low	39	Very low	180 Å²	180	103.6 Å²	103.6	68%	0.679	58%	0.584	S	S	*	*	S	Bend	trans	-105	133.5	-179.5	-67.7	-173.8	-177.8	-168.1	-1.7	110	S417	R415-S417 PolarHBondContact O-N 2.69Å
416	P	39.3	Very low	38.5	Very low	107 Å²	107	101.2 Å²	101.2	70%	0.695	59%	0.594	S	S	*	*	P	Polyproline II helix	trans	-63.6	129.9	175.8	25.1	-31.5	0	0	0	110.2
417	S	40.8	Very low	38	Very low	76 Å²	76	98.9 Å²	98.9	53%	0.531	60%	0.598	S	S	.	*	P	Polyproline II helix	trans	-70.8	123.4	159.7	48	0	0	0	0	107.9	Q97 R415 P419	Q97-S417 PolarHBondContact OE1-OG 3.46Å; R415-S417 PolarHBondContact O-N 2.69Å; S417-P419 WeakPolarHBondContact O-CD 3.11Å; S417-P419 VanDerWaalsContact O-N 3.16Å
418	H	33.3	Very low	36.9	Very low	186 Å²	186	106.5 Å²	106.5	86%	0.861	63%	0.632	S	S	*	*	P	Polyproline II helix	trans	-51.5	120.8	176.7	-92.3	-78.8	0	0	0	110.6	N420	H418-N420 PolarHBondContact O-N 3.3Å
419	P	35.3	Very low	36.3	Very low	110 Å²	110	111.2 Å²	111.2	71%	0.714	65%	0.653	S	S	*	*			trans	-83.9	96.5	171.3	31.2	-25.9	0	0	0	107.4	S417	S417-P419 WeakPolarHBondContact O-CD 3.11Å; S417-P419 VanDerWaalsContact O-N 3.16Å
420	N	28.8	Very low	35.6	Very low	150 Å²	150	115.9 Å²	115.9	80%	0.802	67%	0.667	S	S	*	*			trans	-166.5	118.4	147.8	-98.8	-12.4	0	0	0	108.6	H418 N422	H418-N420 PolarHBondContact O-N 3.3Å; N420-N422 PolarHBondContact O-N 3.43Å
421	G	34.2	Very low	34.7	Very low	84 Å²	84	124.8 Å²	124.8	87%	0.866	71%	0.706	S	S	*	*			trans	-68.9	66.9	173.1	0	0	0	0	0	112.5
422	N	24.3	Very low	34.1	Very low	144 Å²	144	125.1 Å²	125.1	77%	0.77	71%	0.706	S	S	*	*			trans	-122.9	113.1	153.7	-80.4	-0.9	0	0	0	106.3	N420	N420-N422 PolarHBondContact O-N 3.43Å
423	A	27.3	Very low	32.9	Very low	93 Å²	93	126.9 Å²	126.9	77%	0.769	72%	0.72	S	S	*	*	P	Polyproline II helix	trans	-46.9	124.6	163.6	0	0	0	0	0	108.3
424	P	27	Very low	31.7	Very low	114 Å²	114	131.9 Å²	131.9	74%	0.74	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-62.7	133.6	166	23.3	-22.5	0	0	0	106.2	A426	P424-A426 PolarHBondContact O-N 3.43Å; P424-A426 VanDerWaalsContact O-N 3.16Å
425	P	27.9	Very low	31.1	Very low	115 Å²	115	135.4 Å²	135.4	75%	0.747	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-55.7	127.8	-179.6	21.8	-30.3	0	0	0	108.7	G427	P425-G427 PolarHBondContact O-N 3.22Å
426	A	34.7	Very low	31	Very low	113 Å²	113	134.5 Å²	134.5	93%	0.934	77%	0.771	S	S	*	*	S	Bend	trans	-51.6	106.1	168.9	0	0	0	0	0	108.3	P424	P424-A426 PolarHBondContact O-N 3.43Å; P424-A426 VanDerWaalsContact O-N 3.16Å
427	G	33	Very low	31.2	Very low	69 Å²	69	131.7 Å²	131.7	71%	0.711	76%	0.757	S	S	*	*			trans	136.3	30.4	178	0	0	0	0	0	117.5	P425	P425-G427 PolarHBondContact O-N 3.22Å
428	E	25	Very low	31.7	Very low	185 Å²	185	129.8 Å²	129.8	86%	0.864	75%	0.749	S	S	*	*			trans	-129.2	85.6	149.6	-74.2	-168.8	159.8	0	0	108	E430	E428-E430 PolarHBondContact O-N 3.14Å
429	L	29.7	Very low	32.6	Very low	163 Å²	163	125.7 Å²	125.7	85%	0.853	74%	0.739	S	S	*	*			trans	-49.1	113.6	147.2	-94.8	89.4	0	0	0	105.4	K431	L429-K431 PolarHBondContact O-N 3.35Å
430	E	26	Very low	33.6	Very low	167 Å²	167	123.3 Å²	123.3	78%	0.78	72%	0.718	S	S	*	*			trans	-43.5	116.2	146.2	-72.5	-175.5	150.5	0	0	104.8	E428 E432	E428-E430 PolarHBondContact O-N 3.14Å; E430-E432 PolarHBondContact O-N 2.84Å
431	K	29.7	Very low	35.1	Very low	196 Å²	196	117.5 Å²	117.5	85%	0.852	69%	0.687	S	S	*	*			trans	-60	84.9	163.8	-79.1	178.3	174.4	174.5	0	105.3	L429 D433	L429-K431 PolarHBondContact O-N 3.35Å; K431-D433 VanDerWaalsContact C-N 3.31Å; K431-D433 PolarHBondContact O-N 3.48Å
432	E	26.5	Very low	36.5	Very low	140 Å²	140	119.7 Å²	119.7	65%	0.654	68%	0.675	S	S	*	*			trans	-56.9	106.4	157.4	-80.1	-170.6	150.9	0	0	104.3	E430 D434	E430-E432 PolarHBondContact O-N 2.84Å; E432-D434 PolarHBondContact O-N 3.03Å
433	D	25.7	Very low	38.5	Very low	143 Å²	143	121.8 Å²	121.8	77%	0.765	67%	0.672	S	S	*	*			trans	-39.9	124.1	175	-76.6	-44.4	0	0	0	109.6	K431 H435	K431-D433 VanDerWaalsContact C-N 3.31Å; K431-D433 PolarHBondContact O-N 3.48Å; D433-H435 PolarHBondContact O-N 2.95Å
434	D	27.6	Very low	40.4	Very low	156 Å²	156	119.7 Å²	119.7	83%	0.834	65%	0.65	S	S	*	*			trans	-30	107.5	176.7	-87.6	-45.7	0	0	0	111.9	E432 H436	E432-D434 PolarHBondContact O-N 3.03Å; D434-H436 PolarHBondContact O-N 3.01Å
435	H	37.6	Very low	42.3	Very low	152 Å²	152	117.8 Å²	117.8	70%	0.704	65%	0.651	S	S	*	*			trans	-73	57.4	177.5	-87.6	-52.2	0	0	0	112.3	D433	D433-H435 PolarHBondContact O-N 2.95Å
436	H	38.1	Very low	44.7	Very low	162 Å²	162	121.8 Å²	121.8	75%	0.75	65%	0.651	S	S	*	*	S	Bend	trans	-127	105.8	165.8	-75.3	-79	0	0	0	109.7	D434	D434-H436 PolarHBondContact O-N 3.01Å
437	A	42.8	Very low	46.9	Very low	47 Å²	47	122.9 Å²	122.9	39%	0.388	64%	0.64	S	S	.	*	S	Bend	trans	75	132.2	175.7	0	0	0	0	0	116.6	L441 C583	A437-L441 HydrophobicContact CB-CB 4.2Å; A437-C583 WeakPolarHBondContact CB-SG 3.44Å
438	G	51	Low	49.2	Very low	36 Å²	36	123.1 Å²	123.1	37%	0.371	62%	0.621	S	S	.	*			trans	-60.3	165.2	170.4	0	0	0	0	0	111.4	E440 L441	G438-E440 PolarHBondContact O-N 3.22Å; G438-L441 PolarHBondContact O-N 2.63Å
439	P	52.8	Low	51.8	Low	101 Å²	101	114.9 Å²	114.9	66%	0.656	59%	0.586	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.2	0.7	179.4	26.5	-35.5	0	0	0	114.2
440	E	55.1	Low	54.2	Low	59 Å²	59	107.4 Å²	107.4	28%	0.276	55%	0.548	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.9	-16.3	-178.5	-39.8	-169.6	113.9	0	0	113.1	G438 R457 C816	G438-E440 PolarHBondContact O-N 3.22Å; E440-R457 IonicContact OE1-CZ 2.71Å; E440-R457 IonicContact OE1-NE 2.86Å; E440-R457 IonicContact OE1-NH1 3.79Å; E440-R457 PolarHBondContact OE1-NH1 2.89Å; E440-C816 PolarHBondContact OE1-N 3.47Å; E440-C816 PolarHBondContact OE2-SG 3.06Å
441	L	61.4	Low	57	Low	29 Å²	29	100.5 Å²	100.5	15%	0.152	52%	0.516	C	S	.	.	S	Bend	trans	-123.4	5.4	-175.1	-70.6	153.4	0	0	0	113.5	A437 G438 S579 V582 C583 Y818	A437-L441 HydrophobicContact CB-CB 4.2Å; G438-L441 PolarHBondContact O-N 2.63Å; L441-S579 WeakPolarHBondContact CD2-O 3.24Å; L441-V582 HydrophobicContact CD2-CB 4.14Å; L441-C583 WeakPolarHBondContact CB-SG 2.99Å; L441-Y818 HydrophobicContact CD1-CE2 4.32Å; L441-Y818 HydrophobicContact CD2-CD2 3.95Å; L441-Y818 HydrophobicContact CD2-CE2 4.05Å; L441-Y818 HydrophobicContact CG-CD2 4.44Å; L441-Y818 HydrophobicContact CG-CE2 4.24Å
442	Q	63.5	Low	59.7	Low	129 Å²	129	96.4 Å²	96.4	60%	0.603	50%	0.503	S	S	*	.	S	Bend	trans	-73.2	134.4	175.6	-71.5	-176.8	-6.7	0	0	110.4	T444	Q442-T444 PolarHBondContact O-N 3.17Å
443	R	66.7	Low	62.3	Low	188 Å²	188	93.7 Å²	93.7	71%	0.709	49%	0.492	S	S	*	.			trans	-66.6	117.7	-179.1	-162.6	174.7	-171.3	178.5	2.2	109.5	D577	R443-D577 HydrophobicContact CG-CB 4.49Å
444	T	66.5	Low	65.2	Low	50 Å²	50	87 Å²	87	31%	0.307	46%	0.456	S	S	.	.			trans	-82.6	-16.8	-173.2	66.9	0	0	0	0	113.5	Q442 R446 G449 G450 L453 D577	Q442-T444 PolarHBondContact O-N 3.17Å; T444-R446 PolarHBondContact O-N 3Å; T444-R446 VanDerWaalsContact O-N 3.17Å; T444-G449 WeakPolarHBondContact OG1-CA 3.41Å; T444-G450 PolarHBondContact OG1-N 3.43Å; T444-L453 HydrophobicContact CG2-CD1 3.64Å; T444-D577 PolarHBondContact N-OD2 3.08Å; T444-D577 PolarHBondContact OG1-OD2 3.25Å
445	G	68	Low	68	Low	73 Å²	73	82.8 Å²	82.8	75%	0.753	44%	0.436	S	S	*	.			trans	70.2	4.3	177.3	0	0	0	0	0	114.9
446	R	77.6	Confident	70.4	Confident	199 Å²	199	83.3 Å²	83.3	75%	0.751	44%	0.437	S	S	*	.	S	Bend	trans	-113.3	141.5	175.7	-64.5	-178.5	-177.6	-177.9	0.2	109.6	T444 F448 G449	T444-R446 PolarHBondContact O-N 3Å; T444-R446 VanDerWaalsContact O-N 3.17Å; R446-F448 PolarHBondContact O-N 2.92Å; R446-G449 PolarHBondContact O-N 2.99Å
447	I	81.4	Confident	72.6	Confident	136 Å²	136	78.7 Å²	78.7	70%	0.697	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	128	174.7	-49.1	179.1	0	0	0	108.4	G449 A575	I447-G449 PolarHBondContact O-N 3.23Å; I447-A575 HydrophobicContact CG2-CB 4.02Å
448	F	80.5	Confident	74.6	Confident	75 Å²	75	77.4 Å²	77.4	33%	0.329	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.1	15.2	-173.2	-61.7	-76.8	0	0	0	115.7	R446 G450 L451 I452 I571 V574 A575	R446-F448 PolarHBondContact O-N 2.92Å; F448-G450 PolarHBondContact O-N 3.44Å; F448-L451 HydrophobicContact CD1-CD2 3.82Å; F448-L451 HydrophobicContact CE1-CD2 4.5Å; F448-L451 PolarHBondContact O-N 2.93Å; F448-I452 WeakPolarHBondContact O-CG1 3.3Å; F448-I452 PolarHBondContact O-N 3.37Å; F448-I571 HydrophobicContact CZ-CG2 4.34Å; F448-V574 HydrophobicContact CD1-CG1 4.35Å; F448-V574 HydrophobicContact CE1-CG1 4.37Å; F448-A575 HydrophobicContact CE1-CB 4.16Å; F448-A575 HydrophobicContact CE2-CB 4.19Å; F448-A575 HydrophobicContact CZ-CB 3.94Å
449	G	79.5	Confident	76.2	Confident	11 Å²	11	78.8 Å²	78.8	11%	0.113	41%	0.406	C	S	.	.	H	α-helix	trans	-62.3	-44.1	-179.6	0	0	0	0	0	112.8	T444 R446 I447 L451 I452 L453	T444-G449 WeakPolarHBondContact OG1-CA 3.41Å; R446-G449 PolarHBondContact O-N 2.99Å; I447-G449 PolarHBondContact O-N 3.23Å; G449-L451 PolarHBondContact O-N 3.45Å; G449-I452 PolarHBondContact O-N 2.99Å; G449-L453 WeakPolarHBondContact O-CG 3.47Å; G449-L453 PolarHBondContact O-N 2.87Å
450	G	80.6	Confident	77.7	Confident	6 Å²	6	78.4 Å²	78.4	6%	0.062	40%	0.403	C	S	.	.	H	α-helix	trans	-61.5	-42.8	176.4	0	0	0	0	0	113.1	T444 F448 I452 L453 D454 D577	T444-G450 PolarHBondContact OG1-N 3.43Å; F448-G450 PolarHBondContact O-N 3.44Å; G450-I452 PolarHBondContact O-N 3.33Å; G450-L453 PolarHBondContact O-N 3.14Å; G450-D454 PolarHBondContact O-N 3.01Å; G450-D577 PolarHBondContact N-OD1 3Å
451	L	84.2	Confident	79.1	Confident	22 Å²	22	79.4 Å²	79.4	12%	0.115	41%	0.407	C	S	.	.	H	α-helix	trans	-62.2	-45	179.8	-179.9	69.8	0	0	0	112.6	F448 G449 L453 D454 V455 V574 H819 L820 L823	F448-L451 HydrophobicContact CD1-CD2 3.82Å; F448-L451 HydrophobicContact CE1-CD2 4.5Å; F448-L451 PolarHBondContact O-N 2.93Å; G449-L451 PolarHBondContact O-N 3.45Å; L451-L453 VanDerWaalsContact C-N 3.29Å; L451-L453 PolarHBondContact O-N 3.19Å; L451-D454 PolarHBondContact O-N 3.35Å; L451-V455 WeakPolarHBondContact O-CG2 3.45Å; L451-V455 PolarHBondContact O-N 3.48Å; L451-V574 HydrophobicContact CB-CG1 4.5Å; L451-H819 HydrophobicContact CB-CB 4.28Å; L451-H819 HydrophobicContact CD1-CB 4.27Å; L451-L820 HydrophobicContact CD1-CB 4.16Å; L451-L820 HydrophobicContact CD1-CD1 4.09Å; L451-L823 HydrophobicContact CD1-CB 4.43Å; L451-L823 HydrophobicContact CD1-CD2 3.87Å; L451-L823 HydrophobicContact CD2-CD2 3.66Å; L451-L823 HydrophobicContact CG-CD2 4.42Å
452	I	85.9	Confident	80.3	Confident	111 Å²	111	82.4 Å²	82.4	57%	0.569	42%	0.417	S	S	*	.	H	α-helix	trans	-64.3	-37.8	-179	-66	167.4	0	0	0	110.6	F448 G449 G450 K456	F448-I452 WeakPolarHBondContact O-CG1 3.3Å; F448-I452 PolarHBondContact O-N 3.37Å; G449-I452 PolarHBondContact O-N 2.99Å; G450-I452 PolarHBondContact O-N 3.33Å; I452-K456 VanDerWaalsContact O-CB 3.31Å; I452-K456 WeakPolarHBondContact O-CB 3.49Å; I452-K456 PolarHBondContact O-N 3.22Å
453	L	82.7	Confident	81.3	Confident	82 Å²	82	85.6 Å²	85.6	43%	0.429	42%	0.424	S	S	.	.	H	α-helix	trans	-66.1	-41.8	176.1	-68.3	176.4	0	0	0	112	T444 G449 G450 L451 K456 R457	T444-L453 HydrophobicContact CG2-CD1 3.64Å; G449-L453 WeakPolarHBondContact O-CG 3.47Å; G449-L453 PolarHBondContact O-N 2.87Å; G450-L453 PolarHBondContact O-N 3.14Å; L451-L453 VanDerWaalsContact C-N 3.29Å; L451-L453 PolarHBondContact O-N 3.19Å; L453-K456 PolarHBondContact O-N 2.95Å; L453-R457 WeakPolarHBondContact O-CB 3.45Å; L453-R457 PolarHBondContact O-N 3.39Å
454	D	85.7	Confident	82.2	Confident	2 Å²	2	78.4 Å²	78.4	1%	0.011	40%	0.402	C	S	.	.	H	α-helix	trans	-61.2	-46.2	176.9	-75.5	-5.6	0	0	0	111.2	G450 L451 R457 K458 G817 Y818 H819 L820	G450-D454 PolarHBondContact O-N 3.01Å; L451-D454 PolarHBondContact O-N 3.35Å; D454-R457 PolarHBondContact O-N 3.33Å; D454-K458 PolarHBondContact O-N 3.05Å; D454-G817 WeakPolarHBondContact OD2-CA 3.01Å; D454-Y818 PolarHBondContact OD2-N 3.45Å; D454-H819 WeakPolarHBondContact OD2-CB 3.45Å; D454-H819 IonicContact OD2-CG 3.75Å; D454-H819 PolarHBondContact OD2-N 2.96Å; D454-H819 IonicContact OD2-ND1 3.76Å; D454-H819 PolarHBondContact OD2-ND1 3.31Å; D454-L820 HydrophobicContact CB-CB 4.38Å
455	V	87.1	Confident	83.2	Confident	68 Å²	68	76.3 Å²	76.3	41%	0.412	39%	0.389	S	S	.	.	H	α-helix	trans	-63.7	-46	177.5	173.5	0	0	0	0	111.2	L451 R457 K458 A459 L820	L451-V455 WeakPolarHBondContact O-CG2 3.45Å; L451-V455 PolarHBondContact O-N 3.48Å; V455-R457 VanDerWaalsContact C-N 3.25Å; V455-R457 PolarHBondContact O-N 2.88Å; V455-K458 PolarHBondContact O-N 2.84Å; V455-A459 WeakPolarHBondContact O-CB 3.33Å; V455-A459 PolarHBondContact O-N 3.09Å; V455-L820 HydrophobicContact CG2-CD1 4.05Å; V455-L820 HydrophobicContact CG2-CD2 4.28Å
456	K	87.6	Confident	84	Confident	164 Å²	164	75.9 Å²	75.9	71%	0.713	37%	0.369	S	S	*	.	H	α-helix	trans	-61.2	-34.7	179.8	-172.4	178	-178.9	-179	0	112.2	I452 L453	I452-K456 VanDerWaalsContact O-CB 3.31Å; I452-K456 WeakPolarHBondContact O-CB 3.49Å; I452-K456 PolarHBondContact O-N 3.22Å; L453-K456 PolarHBondContact O-N 2.95Å
457	R	83.8	Confident	84.3	Confident	64 Å²	64	74 Å²	74	24%	0.242	37%	0.366	C	S	.	.	H	α-helix	trans	-71.9	-35.5	177.7	-166.1	-179.1	-62.1	135.9	8.6	112.3	E440 L453 D454 V455 F461	E440-R457 IonicContact OE1-CZ 2.71Å; E440-R457 IonicContact OE1-NE 2.86Å; E440-R457 IonicContact OE1-NH1 3.79Å; E440-R457 PolarHBondContact OE1-NH1 2.89Å; L453-R457 WeakPolarHBondContact O-CB 3.45Å; L453-R457 PolarHBondContact O-N 3.39Å; D454-R457 PolarHBondContact O-N 3.33Å; V455-R457 VanDerWaalsContact C-N 3.25Å; V455-R457 PolarHBondContact O-N 2.88Å; R457-F461 WeakPolarHBondContact O-CD2 3Å; R457-F461 WeakPolarHBondContact O-CE2 3.15Å
458	K	84.8	Confident	84.2	Confident	20 Å²	20	71.2 Å²	71.2	9%	0.087	35%	0.353	C	S	.	.	H	α-helix	trans	-91.5	-29.2	-173.9	-72.8	-167.2	171.6	-162.7	0	115.4	D454 V455 P460 F461 G525 G815 C816	D454-K458 PolarHBondContact O-N 3.05Å; V455-K458 PolarHBondContact O-N 2.84Å; K458-P460 VanDerWaalsContact C-N 3.35Å; K458-F461 PolarHBondContact O-N 2.99Å; K458-G525 VanDerWaalsContact CD-O 3.27Å; K458-G525 WeakPolarHBondContact CD-O 3.35Å; K458-G525 WeakPolarHBondContact CE-O 3.48Å; K458-G525 PolarHBondContact NZ-O 3.06Å; K458-G815 WeakPolarHBondContact CE-O 3.29Å; K458-G815 PolarHBondContact NZ-O 3.14Å; K458-G815 VanDerWaalsContact NZ-O 3.13Å; K458-C816 WeakPolarHBondContact CE-O 3.1Å
459	A	84.7	Confident	84.2	Confident	66 Å²	66	68.3 Å²	68.3	55%	0.545	34%	0.342	S	S	.	.	G	3₁₀ helix	trans	-45.9	-46	179.2	0	0	0	0	0	115.1	V455 F461	V455-A459 WeakPolarHBondContact O-CB 3.33Å; V455-A459 PolarHBondContact O-N 3.09Å; A459-F461 VanDerWaalsContact C-N 3.3Å; A459-F461 PolarHBondContact O-N 3.44Å
460	P	85.4	Confident	84.3	Confident	92 Å²	92	75.4 Å²	75.4	60%	0.597	38%	0.376	S	S	*	.	G	3₁₀ helix	trans	-71	-22.9	-177.3	27.9	-35.6	0	0	0	114	K458	K458-P460 VanDerWaalsContact C-N 3.35Å
461	F	84.4	Confident	84.2	Confident	81 Å²	81	78.5 Å²	78.5	36%	0.355	39%	0.392	S	S	.	.	G	3₁₀ helix	trans	-87	-10.4	-176.1	-63	-70.3	0	0	0	113.5	R457 K458 A459 W463 S464 D465 K814	R457-F461 WeakPolarHBondContact O-CD2 3Å; R457-F461 WeakPolarHBondContact O-CE2 3.15Å; K458-F461 PolarHBondContact O-N 2.99Å; A459-F461 VanDerWaalsContact C-N 3.3Å; A459-F461 PolarHBondContact O-N 3.44Å; F461-W463 PolarHBondContact O-N 3.32Å; F461-S464 WeakPolarHBondContact O-CA 3.27Å; F461-S464 WeakPolarHBondContact O-CB 2.9Å; F461-S464 PolarHBondContact O-N 2.87Å; F461-S464 PolarHBondContact O-OG 3.33Å; F461-D465 PolarHBondContact O-N 2.91Å; F461-K814 HydrophobicContact CB-CD 4.03Å; F461-K814 HydrophobicContact CB-CG 4.21Å; F461-K814 HydrophobicContact CD1-CD 4.36Å; F461-K814 HydrophobicContact CD1-CG 3.92Å; F461-K814 HydrophobicContact CD2-CG 4.41Å; F461-K814 HydrophobicContact CE1-CG 4.4Å; F461-K814 HydrophobicContact CG-CD 4.28Å; F461-K814 HydrophobicContact CG-CG 3.93Å
462	Y	85.5	Confident	84	Confident	91 Å²	91	82.1 Å²	82.1	36%	0.357	41%	0.41	S	S	.	.	H	α-helix	trans	-55.3	-45.8	-174.8	-166.5	-91.2	0	0	0	113.5	S464 D465 I466 L522	Y462-S464 VanDerWaalsContact C-N 3.34Å; Y462-S464 PolarHBondContact O-N 2.87Å; Y462-D465 WeakPolarHBondContact O-CB 3.25Å; Y462-D465 PolarHBondContact O-N 2.9Å; Y462-I466 HydrophobicContact CE1-CD1 4.16Å; Y462-L522 WeakPolarHBondContact CE2-O 3.39Å
463	W	85.8	Confident	83.9	Confident	197 Å²	197	78 Å²	78	75%	0.746	39%	0.388	S	S	*	.	H	α-helix	trans	-71.1	-30.6	178.5	-168.9	-112.1	0	0	0	112.8	F461 D465 I466 K467	F461-W463 PolarHBondContact O-N 3.32Å; W463-D465 VanDerWaalsContact C-N 3.31Å; W463-D465 PolarHBondContact O-N 2.91Å; W463-I466 HydrophobicContact CE3-CD1 4.19Å; W463-I466 HydrophobicContact CZ3-CD1 4.3Å; W463-I466 PolarHBondContact O-N 3.4Å; W463-K467 PolarHBondContact O-N 3.31Å
464	S	85.3	Confident	84	Confident	37 Å²	37	74.2 Å²	74.2	26%	0.259	37%	0.369	S	S	.	.	H	α-helix	trans	-65.7	-36.2	175	76.3	0	0	0	0	111.7	F461 Y462 I466 K467 D468 K814	F461-S464 WeakPolarHBondContact O-CA 3.27Å; F461-S464 WeakPolarHBondContact O-CB 2.9Å; F461-S464 PolarHBondContact O-N 2.87Å; F461-S464 PolarHBondContact O-OG 3.33Å; Y462-S464 VanDerWaalsContact C-N 3.34Å; Y462-S464 PolarHBondContact O-N 2.87Å; S464-I466 VanDerWaalsContact C-N 3.28Å; S464-I466 PolarHBondContact O-N 3.3Å; S464-K467 PolarHBondContact O-N 2.91Å; S464-D468 WeakPolarHBondContact O-CB 3.37Å; S464-D468 VanDerWaalsContact O-CG 3.29Å; S464-D468 PolarHBondContact O-N 2.76Å; S464-K814 PolarHBondContact OG-NZ 3.47Å
465	D	86.3	Confident	84	Confident	5 Å²	5	78.3 Å²	78.3	3%	0.027	39%	0.39	C	S	.	.	H	α-helix	trans	-62.9	-33.3	179.6	-63.5	-12.4	0	0	0	112.6	F461 Y462 W463 K814 Q875 R876	F461-D465 PolarHBondContact O-N 2.91Å; Y462-D465 WeakPolarHBondContact O-CB 3.25Å; Y462-D465 PolarHBondContact O-N 2.9Å; W463-D465 VanDerWaalsContact C-N 3.31Å; W463-D465 PolarHBondContact O-N 2.91Å; D465-K814 VanDerWaalsContact OD1-CD 3.32Å; D465-K814 WeakPolarHBondContact OD1-CD 3.37Å; D465-K814 WeakPolarHBondContact OD1-CE 3.48Å; D465-K814 IonicContact OD1-NZ 3.55Å; D465-K814 PolarHBondContact OD1-NZ 2.94Å; D465-Q875 VanDerWaalsContact O-CB 3.32Å; D465-Q875 WeakPolarHBondContact O-CB 3.37Å; D465-R876 HydrophobicContact CB-CB 4.42Å; D465-R876 HydrophobicContact CB-CG 3.93Å; D465-R876 WeakPolarHBondContact OD2-CD 3.45Å; D465-R876 IonicContact OD2-CZ 3.31Å; D465-R876 IonicContact OD2-NE 3.84Å; D465-R876 PolarHBondContact OD2-NE 3.26Å; D465-R876 IonicContact OD2-NH2 3.27Å
466	I	85.6	Confident	83.8	Confident	65 Å²	65	75.1 Å²	75.1	33%	0.333	37%	0.371	S	S	.	.	H	α-helix	trans	-74.5	-44.1	177.5	-61.6	175.4	0	0	0	109.8	Y462 W463 S464 D468 S469 V877	Y462-I466 HydrophobicContact CE1-CD1 4.16Å; W463-I466 HydrophobicContact CE3-CD1 4.19Å; W463-I466 HydrophobicContact CZ3-CD1 4.3Å; W463-I466 PolarHBondContact O-N 3.4Å; S464-I466 VanDerWaalsContact C-N 3.28Å; S464-I466 PolarHBondContact O-N 3.3Å; I466-D468 PolarHBondContact O-N 2.74Å; I466-S469 WeakPolarHBondContact O-CB 3.39Å; I466-S469 PolarHBondContact O-N 3.49Å; I466-S469 PolarHBondContact O-OG 3.01Å; I466-V877 HydrophobicContact CG2-CG2 4.47Å
467	K	82.8	Confident	83.7	Confident	159 Å²	159	67.5 Å²	67.5	69%	0.691	34%	0.339	S	S	*	.	H	α-helix	trans	-65.7	-36.7	-179.6	-168.9	176.8	-179.4	178.5	0	112.7	W463 S464 S469	W463-K467 PolarHBondContact O-N 3.31Å; S464-K467 PolarHBondContact O-N 2.91Å; K467-S469 PolarHBondContact O-N 2.87Å
468	D	80.4	Confident	84	Confident	77 Å²	77	65.4 Å²	65.4	41%	0.412	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-12.8	-180	-73	-21.1	0	0	0	113.5	S464 I466 K814	S464-D468 WeakPolarHBondContact O-CB 3.37Å; S464-D468 VanDerWaalsContact O-CG 3.29Å; S464-D468 PolarHBondContact O-N 2.76Å; I466-D468 PolarHBondContact O-N 2.74Å; D468-K814 IonicContact OD2-NZ 2.62Å; D468-K814 PolarHBondContact OD2-NZ 2.94Å; D468-K814 VanDerWaalsContact OD2-NZ 3.14Å
469	S	80.9	Confident	84	Confident	14 Å²	14	66.9 Å²	66.9	10%	0.098	34%	0.341	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-14.1	-176	73.6	0	0	0	0	115.6	I466 K467 N471 C474 V877	I466-S469 WeakPolarHBondContact O-CB 3.39Å; I466-S469 PolarHBondContact O-N 3.49Å; I466-S469 PolarHBondContact O-OG 3.01Å; K467-S469 PolarHBondContact O-N 2.87Å; S469-N471 PolarHBondContact O-N 3.46Å; S469-C474 VanDerWaalsContact O-CB 3.32Å; S469-C474 WeakPolarHBondContact O-CB 3.46Å; S469-V877 WeakPolarHBondContact OG-CG2 3.46Å
470	L	79.9	Confident	84	Confident	160 Å²	160	64.7 Å²	64.7	84%	0.838	32%	0.319	S	S	*	.			trans	-80.6	47.9	-171.8	-65.8	175.6	0	0	0	113.7
471	N	79.6	Confident	84	Confident	72 Å²	72	60.3 Å²	60.3	39%	0.385	29%	0.29	S	S	.	.	S	Bend	trans	-121.8	148.4	176.1	-157.1	-38.8	0	0	0	111.7	S469 Q473 C474 R873	S469-N471 PolarHBondContact O-N 3.46Å; N471-Q473 PolarHBondContact O-N 3.19Å; N471-C474 WeakPolarHBondContact O-CB 3.47Å; N471-C474 PolarHBondContact O-N 2.91Å; N471-R873 PolarHBondContact ND2-NH1 3.17Å; N471-R873 PolarHBondContact ND2-NH2 3.42Å
472	L	80.3	Confident	84.1	Confident	98 Å²	98	57.6 Å²	57.6	51%	0.513	28%	0.278	S	S	.	.	H	α-helix	trans	-56.5	-33.9	177.6	-170.3	68.8	0	0	0	112.6	C474 L475 A476 T725	L472-C474 VanDerWaalsContact C-N 3.26Å; L472-C474 PolarHBondContact O-N 3.49Å; L472-L475 HydrophobicContact CD1-CD2 4.41Å; L472-L475 WeakPolarHBondContact O-CB 3.32Å; L472-L475 PolarHBondContact O-N 3.4Å; L472-A476 PolarHBondContact O-N 3.47Å; L472-A476 VanDerWaalsContact O-N 3.16Å; L472-T725 HydrophobicContact CD2-CG2 4.32Å
473	Q	83.4	Confident	83.9	Confident	23 Å²	23	53.9 Å²	53.9	11%	0.107	27%	0.265	C	S	.	.	H	α-helix	trans	-57.8	-38.1	173.7	-175.7	-179.2	2.2	0	0	112	N471 A476 S477 S853 K855	N471-Q473 PolarHBondContact O-N 3.19Å; Q473-A476 PolarHBondContact O-N 2.88Å; Q473-S477 PolarHBondContact O-N 3.5Å; Q473-S477 PolarHBondContact O-OG 2.96Å; Q473-S853 PolarHBondContact NE2-O 2.98Å; Q473-K855 PolarHBondContact NE2-O 3.38Å
474	C	85	Confident	83.6	Confident	3 Å²	3	44.6 Å²	44.6	2%	0.02	23%	0.23	C	C	.	.	H	α-helix	trans	-68.6	-35.7	179.7	-63	0	0	0	0	111.5	S469 N471 L472 S477 I478 T878	S469-C474 VanDerWaalsContact O-CB 3.32Å; S469-C474 WeakPolarHBondContact O-CB 3.46Å; N471-C474 WeakPolarHBondContact O-CB 3.47Å; N471-C474 PolarHBondContact O-N 2.91Å; L472-C474 VanDerWaalsContact C-N 3.26Å; L472-C474 PolarHBondContact O-N 3.49Å; C474-S477 PolarHBondContact O-N 3.47Å; C474-I478 VanDerWaalsContact O-CG1 3.26Å; C474-I478 WeakPolarHBondContact O-CG1 3.5Å; C474-I478 PolarHBondContact O-N 3.48Å; C474-T878 HydrophobicContact CB-CG2 4.06Å
475	L	85.9	Confident	83.5	Confident	88 Å²	88	43 Å²	43	46%	0.461	22%	0.219	S	C	.	.	H	α-helix	trans	-64.1	-43	174	-177.4	65	0	0	0	111.6	L472 S477 I478 L479	L472-L475 HydrophobicContact CD1-CD2 4.41Å; L472-L475 WeakPolarHBondContact O-CB 3.32Å; L472-L475 PolarHBondContact O-N 3.4Å; L475-S477 VanDerWaalsContact C-N 3.34Å; L475-S477 PolarHBondContact O-N 3.37Å; L475-I478 PolarHBondContact O-N 3.03Å; L475-L479 PolarHBondContact O-N 3.47Å; L475-L479 VanDerWaalsContact O-N 3.17Å
476	A	82.4	Confident	83.3	Confident	1 Å²	1	43.1 Å²	43.1	1%	0.008	22%	0.22	C	C	.	.	H	α-helix	trans	-59.2	-45.8	174.9	0	0	0	0	0	111.6	L472 Q473 I478 L479 F480 D728 F729	L472-A476 PolarHBondContact O-N 3.47Å; L472-A476 VanDerWaalsContact O-N 3.16Å; Q473-A476 PolarHBondContact O-N 2.88Å; A476-I478 PolarHBondContact O-N 3.31Å; A476-L479 PolarHBondContact O-N 2.83Å; A476-F480 WeakPolarHBondContact O-CB 3.41Å; A476-F480 PolarHBondContact O-N 3.03Å; A476-D728 HydrophobicContact CB-CB 4.29Å; A476-F729 VanDerWaalsContact CA-CE1 3.43Å; A476-F729 HydrophobicContact CB-CD1 3.73Å; A476-F729 HydrophobicContact CB-CD2 4.05Å; A476-F729 HydrophobicContact CB-CE1 3.47Å; A476-F729 VanDerWaalsContact CB-CE1 3.47Å; A476-F729 HydrophobicContact CB-CE2 3.79Å; A476-F729 HydrophobicContact CB-CG 4.01Å; A476-F729 HydrophobicContact CB-CZ 3.5Å; A476-F729 VanDerWaalsContact CB-CZ 3.5Å
477	S	84.8	Confident	83	Confident	4 Å²	4	40.1 Å²	40.1	3%	0.028	20%	0.204	C	C	.	.	H	α-helix	trans	-60	-42	175.5	-67	0	0	0	0	112.7	Q473 C474 L475 L481 S853	Q473-S477 PolarHBondContact O-N 3.5Å; Q473-S477 PolarHBondContact O-OG 2.96Å; C474-S477 PolarHBondContact O-N 3.47Å; L475-S477 VanDerWaalsContact C-N 3.34Å; L475-S477 PolarHBondContact O-N 3.37Å; S477-L481 VanDerWaalsContact O-CB 3.28Å; S477-L481 WeakPolarHBondContact O-CB 3.44Å; S477-L481 WeakPolarHBondContact O-CD1 3.46Å; S477-L481 WeakPolarHBondContact O-CG 3.49Å; S477-L481 PolarHBondContact O-N 2.93Å; S477-S853 WeakPolarHBondContact CB-OG 3.35Å; S477-S853 VanDerWaalsContact OG-CB 3.31Å; S477-S853 WeakPolarHBondContact OG-CB 3.41Å; S477-S853 PolarHBondContact OG-OG 3.46Å
478	I	89.8	Confident	82.8	Confident	20 Å²	20	33 Å²	33	10%	0.103	18%	0.175	C	C	.	.	H	α-helix	trans	-59.5	-50.2	178.5	-71.3	161.7	0	0	0	110.7	C474 L475 A476 Y482 T878 M881 I882 L885	C474-I478 VanDerWaalsContact O-CG1 3.26Å; C474-I478 WeakPolarHBondContact O-CG1 3.5Å; C474-I478 PolarHBondContact O-N 3.48Å; L475-I478 PolarHBondContact O-N 3.03Å; A476-I478 PolarHBondContact O-N 3.31Å; I478-Y482 VanDerWaalsContact O-CB 3.23Å; I478-Y482 WeakPolarHBondContact O-CB 3.25Å; I478-Y482 PolarHBondContact O-N 3.14Å; I478-T878 HydrophobicContact CD1-CG2 4.31Å; I478-T878 HydrophobicContact CG1-CG2 3.88Å; I478-M881 HydrophobicContact CD1-CB 3.88Å; I478-M881 HydrophobicContact CD1-CG 4.12Å; I478-M881 HydrophobicContact CG1-CB 4.14Å; I478-M881 HydrophobicContact CG2-CB 4.09Å; I478-I882 HydrophobicContact CG2-CG1 4.42Å; I478-L885 HydrophobicContact CG2-CD1 3.56Å
479	L	85.3	Confident	82.9	Confident	51 Å²	51	29.7 Å²	29.7	27%	0.267	16%	0.157	S	C	.	.	H	α-helix	trans	-67.8	-42.3	-177	-66.5	175.8	0	0	0	112.3	L475 A476 C483 F729 F732	L475-L479 PolarHBondContact O-N 3.47Å; L475-L479 VanDerWaalsContact O-N 3.17Å; A476-L479 PolarHBondContact O-N 2.83Å; L479-C483 PolarHBondContact O-N 3.47Å; L479-F729 HydrophobicContact CD1-CE1 4.39Å; L479-F732 HydrophobicContact CB-CD2 3.89Å; L479-F732 HydrophobicContact CB-CE2 4.14Å; L479-F732 HydrophobicContact CB-CG 4.24Å; L479-F732 HydrophobicContact CD1-CE1 4.35Å; L479-F732 HydrophobicContact CD1-CZ 4.3Å
480	F	84.4	Confident	82.9	Confident	21 Å²	21	29.8 Å²	29.8	9%	0.092	16%	0.156	C	C	.	.	H	α-helix	trans	-60.8	-52.1	175.5	159.7	-122.7	0	0	0	111.5	A476 Y482 C483 A484 V731 M911	A476-F480 WeakPolarHBondContact O-CB 3.41Å; A476-F480 PolarHBondContact O-N 3.03Å; F480-Y482 VanDerWaalsContact C-N 3.32Å; F480-Y482 PolarHBondContact O-N 3.01Å; F480-C483 PolarHBondContact O-N 2.84Å; F480-A484 HydrophobicContact CE2-CB 4.21Å; F480-A484 PolarHBondContact O-N 3.01Å; F480-A484 VanDerWaalsContact O-N 3.07Å; F480-V731 HydrophobicContact CD2-CB 3.49Å; F480-V731 VanDerWaalsContact CD2-CB 3.49Å; F480-V731 HydrophobicContact CD2-CG1 3.56Å; F480-V731 HydrophobicContact CD2-CG2 4Å; F480-V731 HydrophobicContact CE2-CB 3.74Å; F480-V731 HydrophobicContact CE2-CG1 3.59Å; F480-V731 HydrophobicContact CE2-CG2 3.81Å; F480-V731 HydrophobicContact CG-CB 4.41Å; F480-V731 HydrophobicContact CZ-CG2 4.5Å; F480-M911 HydrophobicContact CE2-SD 4.42Å; F480-M911 HydrophobicContact CZ-CG 4.48Å; F480-M911 HydrophobicContact CZ-SD 4.22Å
481	L	85.9	Confident	82.8	Confident	0 Å²	0	23 Å²	23	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-70.3	-30	-176	-73.3	162	0	0	0	112.3	S477 A484 C485 I530 H850 I882	S477-L481 VanDerWaalsContact O-CB 3.28Å; S477-L481 WeakPolarHBondContact O-CB 3.44Å; S477-L481 WeakPolarHBondContact O-CD1 3.46Å; S477-L481 WeakPolarHBondContact O-CG 3.49Å; S477-L481 PolarHBondContact O-N 2.93Å; L481-A484 PolarHBondContact O-N 3.46Å; L481-C485 WeakPolarHBondContact O-CB 3.42Å; L481-C485 PolarHBondContact O-N 3.37Å; L481-C485 PolarHBondContact O-SG 3.28Å; L481-I530 HydrophobicContact CD1-CD1 4.28Å; L481-I530 HydrophobicContact CD2-CD1 3.94Å; L481-H850 HydrophobicContact CD1-CB 3.73Å; L481-H850 WeakPolarHBondContact CD1-CD2 3.48Å; L481-H850 HydrophobicContact CD2-CB 4.08Å; L481-I882 HydrophobicContact CB-CD1 3.44Å; L481-I882 VanDerWaalsContact CB-CD1 3.44Å; L481-I882 HydrophobicContact CB-CG1 4.01Å; L481-I882 HydrophobicContact CD1-CD1 3.67Å; L481-I882 HydrophobicContact CG-CD1 4.2Å
482	Y	87.4	Confident	82.7	Confident	24 Å²	24	20.2 Å²	20.2	9%	0.094	11%	0.106	C	C	.	.	H	α-helix	trans	-54.8	-53.2	171.2	167	-104.8	0	0	0	111.5	I478 F480 A484 C485 M486 L885 M886 S889	I478-Y482 VanDerWaalsContact O-CB 3.23Å; I478-Y482 WeakPolarHBondContact O-CB 3.25Å; I478-Y482 PolarHBondContact O-N 3.14Å; F480-Y482 VanDerWaalsContact C-N 3.32Å; F480-Y482 PolarHBondContact O-N 3.01Å; Y482-A484 VanDerWaalsContact C-N 3.33Å; Y482-A484 PolarHBondContact O-N 2.64Å; Y482-C485 PolarHBondContact O-N 2.91Å; Y482-M486 HydrophobicContact CE2-SD 4.4Å; Y482-M486 VanDerWaalsContact O-CB 3.3Å; Y482-M486 WeakPolarHBondContact O-CB 3.44Å; Y482-M486 PolarHBondContact O-N 3.15Å; Y482-L885 HydrophobicContact CD2-CB 3.77Å; Y482-L885 HydrophobicContact CE2-CB 4.04Å; Y482-M886 HydrophobicContact CE2-SD 4.42Å; Y482-S889 VanDerWaalsContact OH-CB 3.29Å; Y482-S889 WeakPolarHBondContact OH-CB 3.27Å
483	C	80.1	Confident	82.8	Confident	13 Å²	13	15.5 Å²	15.5	9%	0.088	8%	0.082	C	C	.	.	H	α-helix	trans	-63.3	-39.4	177.5	-63.3	0	0	0	0	112.2	L479 F480 I735	L479-C483 PolarHBondContact O-N 3.47Å; F480-C483 PolarHBondContact O-N 2.84Å; C483-I735 HydrophobicContact CB-CD1 3.64Å
484	A	80.2	Confident	82.4	Confident	2 Å²	2	15.9 Å²	15.9	2%	0.017	9%	0.091	C	C	.	.	H	α-helix	trans	-68.3	-37.7	179.8	0	0	0	0	0	113.4	F480 L481 Y482 P488 M911	F480-A484 HydrophobicContact CE2-CB 4.21Å; F480-A484 PolarHBondContact O-N 3.01Å; F480-A484 VanDerWaalsContact O-N 3.07Å; L481-A484 PolarHBondContact O-N 3.46Å; Y482-A484 VanDerWaalsContact C-N 3.33Å; Y482-A484 PolarHBondContact O-N 2.64Å; A484-P488 WeakPolarHBondContact O-CD 3.41Å; A484-P488 WeakPolarHBondContact O-CG 3.45Å; A484-M911 HydrophobicContact CB-CE 4.02Å; A484-M911 HydrophobicContact CB-SD 3.67Å
485	C	83.1	Confident	82	Confident	4 Å²	4	19.1 Å²	19.1	3%	0.027	11%	0.108	C	C	.	.	H	α-helix	trans	-78.5	-29.5	179.5	-67.3	0	0	0	0	112.4	L481 Y482 P488 V489 L846 I882 M886	L481-C485 WeakPolarHBondContact O-CB 3.42Å; L481-C485 PolarHBondContact O-N 3.37Å; L481-C485 PolarHBondContact O-SG 3.28Å; Y482-C485 PolarHBondContact O-N 2.91Å; C485-P488 WeakPolarHBondContact O-CD 3.48Å; C485-V489 WeakPolarHBondContact O-CG2 3.17Å; C485-L846 HydrophobicContact CB-CD2 4.31Å; C485-I882 HydrophobicContact CB-CG2 4.32Å; C485-M886 VanDerWaalsContact C-CE 3.47Å; C485-M886 HydrophobicContact CB-CE 3.53Å
486	M	83	Confident	81.7	Confident	6 Å²	6	15.1 Å²	15.1	3%	0.03	9%	0.087	C	C	.	.	H	α-helix	trans	-70.5	-42.8	-174.8	-175.8	172.5	-167.8	0	0	112.2	Y482 V489 I490 L510 L752 V754 M886 L896	Y482-M486 HydrophobicContact CE2-SD 4.4Å; Y482-M486 VanDerWaalsContact O-CB 3.3Å; Y482-M486 WeakPolarHBondContact O-CB 3.44Å; Y482-M486 PolarHBondContact O-N 3.15Å; M486-V489 PolarHBondContact O-N 2.92Å; M486-I490 HydrophobicContact CE-CD1 3.54Å; M486-I490 HydrophobicContact CG-CD1 3.62Å; M486-I490 HydrophobicContact CG-CG1 4.39Å; M486-I490 WeakPolarHBondContact O-CG1 3.42Å; M486-I490 PolarHBondContact O-N 3.07Å; M486-I490 HydrophobicContact SD-CD1 4.35Å; M486-L510 HydrophobicContact CE-CD1 4.45Å; M486-L752 HydrophobicContact CE-CD2 4.14Å; M486-L752 HydrophobicContact SD-CD2 4.41Å; M486-V754 HydrophobicContact CE-CG2 4.08Å; M486-M886 VanDerWaalsContact CA-CE 3.42Å; M486-M886 HydrophobicContact CB-CE 3.77Å; M486-M886 HydrophobicContact CB-SD 3.64Å; M486-M886 HydrophobicContact CG-SD 3.77Å; M486-M886 VanDerWaalsContact N-CE 3.29Å; M486-L896 HydrophobicContact CE-CD1 3.58Å; M486-L896 HydrophobicContact CE-CD2 3.69Å; M486-L896 HydrophobicContact CE-CG 4.12Å; M486-L896 HydrophobicContact SD-CD1 4.24Å; M486-L896 HydrophobicContact SD-CD2 3.39Å; M486-L896 WeakPolarHBondContact SD-CD2 3.31Å; M486-L896 HydrophobicContact SD-CG 4.4Å
487	S	78	Confident	81.7	Confident	2 Å²	2	15.6 Å²	15.6	1%	0.014	9%	0.092	C	C	.	.	H	α-helix	trans	-61.8	-49.3	-176	-178.1	0	0	0	0	113.1	V489 I490 T491 F908	S487-V489 VanDerWaalsContact C-N 3.34Å; S487-V489 PolarHBondContact O-N 3.44Å; S487-I490 PolarHBondContact O-N 3.07Å; S487-T491 VanDerWaalsContact O-CG2 3.3Å; S487-T491 WeakPolarHBondContact O-CG2 3.37Å; S487-T491 PolarHBondContact O-N 2.98Å; S487-T491 PolarHBondContact O-OG1 3.05Å; S487-T491 VanDerWaalsContact O-OG1 3.08Å; S487-F908 WeakPolarHBondContact OG-CE2 3.41Å; S487-F908 WeakPolarHBondContact OG-CZ 3.48Å
488	P	78.1	Confident	81.4	Confident	10 Å²	10	22.8 Å²	22.8	7%	0.065	13%	0.125	C	C	.	.	H	α-helix	trans	-63.5	-40.9	179.2	-21	32.1	0	0	0	111.7	A484 C485 I490 T491 F492 F908	A484-P488 WeakPolarHBondContact O-CD 3.41Å; A484-P488 WeakPolarHBondContact O-CG 3.45Å; C485-P488 WeakPolarHBondContact O-CD 3.48Å; P488-I490 VanDerWaalsContact C-N 3.33Å; P488-I490 PolarHBondContact O-N 3.03Å; P488-T491 WeakPolarHBondContact CA-OG1 3.5Å; P488-T491 PolarHBondContact O-N 3.47Å; P488-T491 PolarHBondContact O-OG1 3.48Å; P488-T491 VanDerWaalsContact O-OG1 3.14Å; P488-F492 HydrophobicContact CB-CD2 4.07Å; P488-F492 HydrophobicContact CB-CE2 4.03Å; P488-F492 VanDerWaalsContact O-CB 3.32Å; P488-F492 WeakPolarHBondContact O-CB 3.2Å; P488-F492 WeakPolarHBondContact O-CD2 3.43Å; P488-F492 WeakPolarHBondContact O-CG 3.25Å; P488-F492 PolarHBondContact O-N 2.98Å; P488-F908 HydrophobicContact CB-CZ 4.31Å; P488-F908 VanDerWaalsContact CD-CZ 3.43Å; P488-F908 HydrophobicContact CG-CE1 3.67Å; P488-F908 HydrophobicContact CG-CZ 3.48Å; P488-F908 VanDerWaalsContact CG-CZ 3.48Å
489	V	84	Confident	80.9	Confident	8 Å²	8	23.2 Å²	23.2	5%	0.048	13%	0.131	C	C	.	.	H	α-helix	trans	-60.7	-42.7	179.5	172.7	0	0	0	0	111.5	C485 M486 S487 G493 L510 A513	C485-V489 WeakPolarHBondContact O-CG2 3.17Å; M486-V489 PolarHBondContact O-N 2.92Å; S487-V489 VanDerWaalsContact C-N 3.34Å; S487-V489 PolarHBondContact O-N 3.44Å; V489-G493 PolarHBondContact O-N 3.11Å; V489-L510 HydrophobicContact CG1-CB 4.48Å; V489-A513 HydrophobicContact CG1-CB 3.89Å; V489-A513 HydrophobicContact CG2-CB 4.01Å
490	I	80.8	Confident	80.8	Confident	15 Å²	15	20.8 Å²	20.8	8%	0.077	12%	0.119	C	C	.	.	H	α-helix	trans	-71.9	-46	177.5	-67	170.9	0	0	0	111.1	M486 S487 P488 G493 G494 L752 V754	M486-I490 HydrophobicContact CE-CD1 3.54Å; M486-I490 HydrophobicContact CG-CD1 3.62Å; M486-I490 HydrophobicContact CG-CG1 4.39Å; M486-I490 WeakPolarHBondContact O-CG1 3.42Å; M486-I490 PolarHBondContact O-N 3.07Å; M486-I490 HydrophobicContact SD-CD1 4.35Å; S487-I490 PolarHBondContact O-N 3.07Å; P488-I490 VanDerWaalsContact C-N 3.33Å; P488-I490 PolarHBondContact O-N 3.03Å; I490-G493 PolarHBondContact O-N 3.29Å; I490-G494 PolarHBondContact O-N 3.48Å; I490-L752 HydrophobicContact CB-CD1 4.33Å; I490-L752 HydrophobicContact CD1-CD1 3.87Å; I490-L752 HydrophobicContact CD1-CD2 3.73Å; I490-L752 HydrophobicContact CD1-CG 3.99Å; I490-L752 HydrophobicContact CG2-CD1 3.86Å; I490-V754 HydrophobicContact CD1-CG2 4.19Å
491	T	76.9	Confident	80.6	Confident	19 Å²	19	27 Å²	27	12%	0.117	15%	0.146	C	C	.	.	H	α-helix	trans	-64	-45.5	-178.8	58.7	0	0	0	0	112.1	S487 P488 G494 L495 K608	S487-T491 VanDerWaalsContact O-CG2 3.3Å; S487-T491 WeakPolarHBondContact O-CG2 3.37Å; S487-T491 PolarHBondContact O-N 2.98Å; S487-T491 PolarHBondContact O-OG1 3.05Å; S487-T491 VanDerWaalsContact O-OG1 3.08Å; P488-T491 WeakPolarHBondContact CA-OG1 3.5Å; P488-T491 PolarHBondContact O-N 3.47Å; P488-T491 PolarHBondContact O-OG1 3.48Å; P488-T491 VanDerWaalsContact O-OG1 3.14Å; T491-G494 PolarHBondContact O-N 2.92Å; T491-L495 WeakPolarHBondContact O-CG 3.23Å; T491-L495 PolarHBondContact O-N 3.48Å; T491-K608 PolarHBondContact OG1-NZ 3.12Å
492	F	78.4	Confident	80.2	Confident	12 Å²	12	28 Å²	28	5%	0.053	16%	0.157	C	C	.	.	H	α-helix	trans	-68.2	-35.5	175.2	-69.7	-50.3	0	0	0	112.3	P488 G494 L495 L496 L538	P488-F492 HydrophobicContact CB-CD2 4.07Å; P488-F492 HydrophobicContact CB-CE2 4.03Å; P488-F492 VanDerWaalsContact O-CB 3.32Å; P488-F492 WeakPolarHBondContact O-CB 3.2Å; P488-F492 WeakPolarHBondContact O-CD2 3.43Å; P488-F492 WeakPolarHBondContact O-CG 3.25Å; P488-F492 PolarHBondContact O-N 2.98Å; F492-G494 VanDerWaalsContact C-N 3.34Å; F492-L495 HydrophobicContact CD1-CD1 4.33Å; F492-L496 WeakPolarHBondContact O-CB 3.31Å; F492-L496 PolarHBondContact O-N 3.42Å; F492-L538 HydrophobicContact CD1-CD2 3.9Å; F492-L538 HydrophobicContact CE1-CD2 4.42Å
493	G	80.9	Confident	79.8	Confident	0 Å²	0	29.5 Å²	29.5	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-64.6	-35.7	172	0	0	0	0	0	113.6	V489 I490 G497 S505 A506 S509	V489-G493 PolarHBondContact O-N 3.11Å; I490-G493 PolarHBondContact O-N 3.29Å; G493-G497 PolarHBondContact O-N 3.08Å; G493-S505 CarbonylContact O-C 3.44Å; G493-A506 PolarHBondContact O-N 3.18Å; G493-S509 WeakPolarHBondContact CA-OG 3.25Å
494	G	75.6	Confident	79.9	Confident	30 Å²	30	28.9 Å²	28.9	31%	0.309	16%	0.162	S	C	.	.	H	α-helix	trans	-67.3	-49.7	173.2	0	0	0	0	0	112.3	I490 T491 F492 L496 G497 E498	I490-G494 PolarHBondContact O-N 3.48Å; T491-G494 PolarHBondContact O-N 2.92Å; F492-G494 VanDerWaalsContact C-N 3.34Å; G494-L496 VanDerWaalsContact C-N 3.28Å; G494-L496 PolarHBondContact O-N 3.21Å; G494-G497 WeakPolarHBondContact O-CA 3.36Å; G494-G497 PolarHBondContact O-N 2.88Å; G494-E498 PolarHBondContact O-N 2.84Å
495	L	77.3	Confident	79.9	Confident	72 Å²	72	29.9 Å²	29.9	38%	0.377	17%	0.168	S	C	.	.	H	α-helix	trans	-60.4	-37.7	175.9	-70.5	173.2	0	0	0	112.2	T491 F492 A499 L538	T491-L495 WeakPolarHBondContact O-CG 3.23Å; T491-L495 PolarHBondContact O-N 3.48Å; F492-L495 HydrophobicContact CD1-CD1 4.33Å; L495-A499 VanDerWaalsContact O-CB 3.28Å; L495-A499 WeakPolarHBondContact O-CB 3.16Å; L495-A499 PolarHBondContact O-N 3.2Å; L495-L538 HydrophobicContact CB-CD2 4.32Å; L495-L538 HydrophobicContact CD1-CD2 4.43Å
496	L	80.2	Confident	79.9	Confident	4 Å²	4	30.6 Å²	30.6	2%	0.021	18%	0.175	C	C	.	.	H	α-helix	trans	-67.8	-37	174.2	-173.4	62.8	0	0	0	111.5	F492 G494 A499 T500 I504 L538 E541 P838	F492-L496 WeakPolarHBondContact O-CB 3.31Å; F492-L496 PolarHBondContact O-N 3.42Å; G494-L496 VanDerWaalsContact C-N 3.28Å; G494-L496 PolarHBondContact O-N 3.21Å; L496-A499 PolarHBondContact O-N 3.37Å; L496-T500 HydrophobicContact CD1-CG2 3.76Å; L496-T500 HydrophobicContact CG-CG2 4.26Å; L496-T500 WeakPolarHBondContact O-CB 3.16Å; L496-T500 VanDerWaalsContact O-CG2 3.3Å; L496-T500 WeakPolarHBondContact O-CG2 3.26Å; L496-T500 PolarHBondContact O-N 3.03Å; L496-T500 PolarHBondContact O-OG1 3.34Å; L496-I504 CarbonylContact C-O 3.59Å; L496-I504 HydrophobicContact CD2-CB 4.12Å; L496-I504 HydrophobicContact CD2-CG2 3.53Å; L496-I504 HydrophobicContact CG-CB 4.28Å; L496-I504 HydrophobicContact CG-CG2 4.17Å; L496-L538 HydrophobicContact CB-CD1 3.77Å; L496-L538 HydrophobicContact CD1-CD1 3.84Å; L496-L538 HydrophobicContact CG-CD1 4.34Å; L496-E541 HydrophobicContact CD1-CB 3.87Å; L496-E541 HydrophobicContact CD1-CG 4.48Å; L496-P838 HydrophobicContact CD2-CB 4.06Å
497	G	81.1	Confident	79.9	Confident	10 Å²	10	30.9 Å²	30.9	10%	0.103	18%	0.176	C	C	.	.	H	α-helix	trans	-58.5	-49.6	172.3	0	0	0	0	0	112.7	G493 G494 T500 K501 G502 I504	G493-G497 PolarHBondContact O-N 3.08Å; G494-G497 WeakPolarHBondContact O-CA 3.36Å; G494-G497 PolarHBondContact O-N 2.88Å; G497-T500 PolarHBondContact O-N 3.16Å; G497-K501 PolarHBondContact O-N 3.17Å; G497-K501 VanDerWaalsContact O-N 3.13Å; G497-G502 PolarHBondContact O-N 3.26Å; G497-I504 WeakPolarHBondContact CA-O 2.86Å; G497-I504 PolarHBondContact N-O 2.87Å; G497-I504 VanDerWaalsContact N-O 3.13Å
498	E	78.8	Confident	80.3	Confident	156 Å²	156	30.9 Å²	30.9	73%	0.729	18%	0.176	S	C	*	.	H	α-helix	trans	-63.4	-45.4	176.6	-70.1	177.1	-175.3	0	0	111.7	G494 T500 K501	G494-E498 PolarHBondContact O-N 2.84Å; E498-T500 VanDerWaalsContact C-N 3.34Å; E498-T500 PolarHBondContact O-N 3.26Å; E498-K501 PolarHBondContact O-N 3.34Å
499	A	79.3	Confident	80.7	Confident	28 Å²	28	30.4 Å²	30.4	23%	0.231	17%	0.173	C	C	.	.	H	α-helix	trans	-65.4	-35.1	-179	0	0	0	0	0	113.1	L495 L496 K542 F545	L495-A499 VanDerWaalsContact O-CB 3.28Å; L495-A499 WeakPolarHBondContact O-CB 3.16Å; L495-A499 PolarHBondContact O-N 3.2Å; L496-A499 PolarHBondContact O-N 3.37Å; A499-K542 HydrophobicContact CB-CG 4.33Å; A499-F545 WeakPolarHBondContact O-CD1 3.43Å; A499-F545 VanDerWaalsContact O-CE1 3.26Å; A499-F545 WeakPolarHBondContact O-CE1 3.31Å
500	T	82.4	Confident	80.9	Confident	0 Å²	0	30.3 Å²	30.3	0%	0	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.2	8.9	-176.6	65.9	0	0	0	0	113.8	L496 G497 E498 G502 N503 I504 F545 Y555	L496-T500 HydrophobicContact CD1-CG2 3.76Å; L496-T500 HydrophobicContact CG-CG2 4.26Å; L496-T500 WeakPolarHBondContact O-CB 3.16Å; L496-T500 VanDerWaalsContact O-CG2 3.3Å; L496-T500 WeakPolarHBondContact O-CG2 3.26Å; L496-T500 PolarHBondContact O-N 3.03Å; L496-T500 PolarHBondContact O-OG1 3.34Å; G497-T500 PolarHBondContact O-N 3.16Å; E498-T500 VanDerWaalsContact C-N 3.34Å; E498-T500 PolarHBondContact O-N 3.26Å; T500-G502 VanDerWaalsContact C-N 3.27Å; T500-G502 PolarHBondContact O-N 3.43Å; T500-N503 WeakPolarHBondContact O-CB 3.08Å; T500-N503 PolarHBondContact O-N 3.24Å; T500-I504 PolarHBondContact OG1-N 3.03Å; T500-I504 PolarHBondContact OG1-O 3.18Å; T500-F545 HydrophobicContact CG2-CB 4.47Å; T500-F545 HydrophobicContact CG2-CD2 4.32Å; T500-F545 HydrophobicContact CG2-CG 4.33Å; T500-F545 WeakPolarHBondContact O-CE2 3.48Å; T500-F545 WeakPolarHBondContact O-CZ 3.47Å; T500-Y555 HydrophobicContact CG2-CE1 4.27Å
501	K	82.1	Confident	81.2	Confident	152 Å²	152	32.5 Å²	32.5	66%	0.661	18%	0.181	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.3	39.6	-175.6	-60.1	-175.3	170.2	-164.2	0	113.5	G497 E498 F545	G497-K501 PolarHBondContact O-N 3.17Å; G497-K501 VanDerWaalsContact O-N 3.13Å; E498-K501 PolarHBondContact O-N 3.34Å; K501-F545 HydrophobicContact CB-CZ 4.41Å; K501-F545 HydrophobicContact CD-CZ 4.48Å; K501-F545 HydrophobicContact CG-CE1 4.35Å; K501-F545 HydrophobicContact CG-CZ 4.26Å
502	G	76.7	Confident	81.8	Confident	22 Å²	22	31.6 Å²	31.6	23%	0.227	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	80.4	13	177.4	0	0	0	0	0	115.4	G497 T500 T761	G497-G502 PolarHBondContact O-N 3.26Å; T500-G502 VanDerWaalsContact C-N 3.27Å; T500-G502 PolarHBondContact O-N 3.43Å; G502-T761 WeakPolarHBondContact O-CB 3.39Å; G502-T761 VanDerWaalsContact O-CG2 3.27Å; G502-T761 WeakPolarHBondContact O-CG2 3.45Å
503	N	78.5	Confident	82.4	Confident	54 Å²	54	31.1 Å²	31.1	29%	0.289	17%	0.174	S	C	.	.	S	Bend	trans	-73.4	-29.8	173	-78.1	-19.2	0	0	0	113	T500 R765	T500-N503 WeakPolarHBondContact O-CB 3.08Å; T500-N503 PolarHBondContact O-N 3.24Å; N503-R765 PolarHBondContact O-NH1 3Å
504	I	81.6	Confident	82.9	Confident	0 Å²	0	31.9 Å²	31.9	0%	0	18%	0.179	C	C	.	.	S	Bend	trans	-140.5	122.3	171.5	-58.6	177.9	0	0	0	107.6	L496 G497 T500 E508 Y555 P838	L496-I504 CarbonylContact C-O 3.59Å; L496-I504 HydrophobicContact CD2-CB 4.12Å; L496-I504 HydrophobicContact CD2-CG2 3.53Å; L496-I504 HydrophobicContact CG-CB 4.28Å; L496-I504 HydrophobicContact CG-CG2 4.17Å; G497-I504 WeakPolarHBondContact CA-O 2.86Å; G497-I504 PolarHBondContact N-O 2.87Å; G497-I504 VanDerWaalsContact N-O 3.13Å; T500-I504 PolarHBondContact OG1-N 3.03Å; T500-I504 PolarHBondContact OG1-O 3.18Å; I504-E508 HydrophobicContact CG2-CB 4.14Å; I504-Y555 HydrophobicContact CD1-CE1 3.86Å; I504-Y555 HydrophobicContact CG1-CE1 4.35Å; I504-P838 HydrophobicContact CG2-CG 4.44Å
505	S	81.9	Confident	83.7	Confident	23 Å²	23	33.3 Å²	33.3	16%	0.161	18%	0.179	C	C	.	.			trans	-122.2	-168	-176.4	-53.8	0	0	0	0	112.5	G493 I507 E508 S509 T761	G493-S505 CarbonylContact O-C 3.44Å; S505-I507 PolarHBondContact O-N 2.93Å; S505-E508 WeakPolarHBondContact CA-OE2 3.49Å; S505-E508 PolarHBondContact N-OE2 3.03Å; S505-E508 PolarHBondContact O-N 2.99Å; S505-S509 PolarHBondContact O-N 3.37Å; S505-T761 WeakPolarHBondContact CB-OG1 3.34Å; S505-T761 WeakPolarHBondContact OG-CG2 3.36Å; S505-T761 PolarHBondContact OG-OG1 3.45Å
506	A	81.5	Confident	84.4	Confident	19 Å²	19	30 Å²	30	16%	0.157	16%	0.162	C	C	.	.	H	α-helix	trans	-59.5	-29.5	-179.4	0	0	0	0	0	114.2	G493 L510	G493-A506 PolarHBondContact O-N 3.18Å; A506-L510 WeakPolarHBondContact O-CB 3.17Å; A506-L510 PolarHBondContact O-N 3.4Å
507	I	83	Confident	84.9	Confident	12 Å²	12	29.8 Å²	29.8	6%	0.062	16%	0.161	C	C	.	.	H	α-helix	trans	-77.1	-39.9	-176.6	-152.8	164.2	0	0	0	112.8	S505 S509 L510 F511 P755 R757 F758	S505-I507 PolarHBondContact O-N 2.93Å; I507-S509 VanDerWaalsContact C-N 3.28Å; I507-S509 PolarHBondContact O-N 3.1Å; I507-L510 PolarHBondContact O-N 2.77Å; I507-F511 WeakPolarHBondContact O-CB 3.35Å; I507-F511 PolarHBondContact O-N 2.87Å; I507-P755 HydrophobicContact CB-CG 3.88Å; I507-P755 HydrophobicContact CD1-CB 4.09Å; I507-P755 HydrophobicContact CD1-CG 3.75Å; I507-P755 HydrophobicContact CG1-CG 3.95Å; I507-R757 WeakPolarHBondContact CD1-O 3.37Å; I507-F758 HydrophobicContact CD1-CD1 4.31Å; I507-F758 HydrophobicContact CG1-CD1 4.42Å
508	E	86.4	Confident	85.5	Confident	3 Å²	3	30.9 Å²	30.9	1%	0.014	17%	0.166	C	C	.	.	H	α-helix	trans	-65.2	-36.5	173.3	-63.3	88.1	170.6	0	0	110.6	I504 S505 G512 T761 L837	I504-E508 HydrophobicContact CG2-CB 4.14Å; S505-E508 WeakPolarHBondContact CA-OE2 3.49Å; S505-E508 PolarHBondContact N-OE2 3.03Å; S505-E508 PolarHBondContact O-N 2.99Å; E508-G512 PolarHBondContact O-N 3.38Å; E508-T761 VanDerWaalsContact CD-OG1 3.24Å; E508-T761 WeakPolarHBondContact OE1-CB 3.38Å; E508-T761 PolarHBondContact OE1-N 3.11Å; E508-T761 PolarHBondContact OE1-OG1 2.84Å; E508-T761 PolarHBondContact OE2-OG1 3.33Å; E508-L837 HydrophobicContact CB-CD2 3.97Å; E508-L837 HydrophobicContact CG-CD2 4.48Å
509	S	87.2	Confident	86.2	Confident	0 Å²	0	24.4 Å²	24.4	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-61	-46.7	170.5	-86.1	0	0	0	0	112.7	G493 S505 I507 G512 A513 P838 F840	G493-S509 WeakPolarHBondContact CA-OG 3.25Å; S505-S509 PolarHBondContact O-N 3.37Å; I507-S509 VanDerWaalsContact C-N 3.28Å; I507-S509 PolarHBondContact O-N 3.1Å; S509-G512 PolarHBondContact O-N 2.63Å; S509-A513 VanDerWaalsContact O-CB 3.31Å; S509-A513 WeakPolarHBondContact O-CB 3.33Å; S509-A513 PolarHBondContact O-N 2.89Å; S509-P838 WeakPolarHBondContact OG-CG 3.29Å; S509-F840 WeakPolarHBondContact O-CZ 3.09Å
510	L	87.6	Confident	86.9	Confident	5 Å²	5	23.1 Å²	23.1	3%	0.026	13%	0.128	C	C	.	.	H	α-helix	trans	-66.7	-43.6	-178.4	-172.4	141.6	0	0	0	112	M486 V489 A506 I507 A513 S514 M886 V890	M486-L510 HydrophobicContact CE-CD1 4.45Å; V489-L510 HydrophobicContact CG1-CB 4.48Å; A506-L510 WeakPolarHBondContact O-CB 3.17Å; A506-L510 PolarHBondContact O-N 3.4Å; I507-L510 PolarHBondContact O-N 2.77Å; L510-A513 PolarHBondContact O-N 2.91Å; L510-S514 PolarHBondContact O-N 3.41Å; L510-M886 WeakPolarHBondContact CD2-O 3.35Å; L510-M886 HydrophobicContact CG-CG 4.32Å; L510-V890 HydrophobicContact CD2-CG2 3.66Å
511	F	87.8	Confident	87.3	Confident	62 Å²	62	23.2 Å²	23.2	27%	0.272	13%	0.129	S	C	.	.	H	α-helix	trans	-65.2	-44.4	176.1	-179	-103.3	0	0	0	111.9	I507 A513 S514 L515 W767 M835 L837	I507-F511 WeakPolarHBondContact O-CB 3.35Å; I507-F511 PolarHBondContact O-N 2.87Å; F511-A513 PolarHBondContact O-N 3.36Å; F511-S514 PolarHBondContact O-N 3.5Å; F511-L515 HydrophobicContact CE1-CD2 4.36Å; F511-L515 WeakPolarHBondContact O-CB 3.5Å; F511-L515 PolarHBondContact O-N 2.92Å; F511-W767 HydrophobicContact CD1-CE3 4.41Å; F511-W767 AromaticContact CD1-CH2 3.95Å; F511-W767 HydrophobicContact CD1-CH2 3.95Å; F511-W767 AromaticContact CD1-CZ3 3.47Å; F511-W767 HydrophobicContact CD1-CZ3 3.47Å; F511-W767 VanDerWaalsContact CD1-CZ3 3.47Å; F511-W767 HydrophobicContact CE1-CE3 4.27Å; F511-W767 HydrophobicContact CE1-CH2 4.34Å; F511-W767 AromaticContact CE1-CZ3 3.72Å; F511-W767 HydrophobicContact CE1-CZ3 3.72Å; F511-W767 HydrophobicContact CG-CH2 4.16Å; F511-W767 HydrophobicContact CG-CZ3 4.14Å; F511-M835 HydrophobicContact CE1-CE 3.62Å; F511-M835 HydrophobicContact CZ-CE 4.23Å; F511-L837 HydrophobicContact CD1-CD1 3.77Å; F511-L837 HydrophobicContact CD1-CD2 3.93Å; F511-L837 HydrophobicContact CE1-CD1 3.97Å
512	G	89.6	Confident	87.7	Confident	0 Å²	0	18.5 Å²	18.5	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-61.3	-41.6	175.6	0	0	0	0	0	112.9	E508 S509 L515 T516	E508-G512 PolarHBondContact O-N 3.38Å; S509-G512 PolarHBondContact O-N 2.63Å; G512-L515 PolarHBondContact O-N 3.45Å; G512-T516 WeakPolarHBondContact O-CB 3.37Å; G512-T516 VanDerWaalsContact O-CG2 3.26Å; G512-T516 WeakPolarHBondContact O-CG2 3.43Å; G512-T516 PolarHBondContact O-N 2.8Å; G512-T516 PolarHBondContact O-OG1 2.66Å
513	A	90.5	Very high	88.3	Confident	1 Å²	1	23.6 Å²	23.6	1%	0.008	13%	0.127	C	C	.	.	H	α-helix	trans	-62.8	-44.2	176.2	0	0	0	0	0	111.7	V489 S509 L510 F511 T516 G517 F840 F883	V489-A513 HydrophobicContact CG1-CB 3.89Å; V489-A513 HydrophobicContact CG2-CB 4.01Å; S509-A513 VanDerWaalsContact O-CB 3.31Å; S509-A513 WeakPolarHBondContact O-CB 3.33Å; S509-A513 PolarHBondContact O-N 2.89Å; L510-A513 PolarHBondContact O-N 2.91Å; F511-A513 PolarHBondContact O-N 3.36Å; A513-T516 PolarHBondContact O-OG1 2.98Å; A513-G517 PolarHBondContact O-N 3.42Å; A513-F840 HydrophobicContact CB-CD1 4.23Å; A513-F840 HydrophobicContact CB-CE1 3.6Å; A513-F840 HydrophobicContact CB-CE2 4.49Å; A513-F840 HydrophobicContact CB-CZ 3.77Å; A513-F840 VanDerWaalsContact N-CE2 3.31Å; A513-F840 VanDerWaalsContact N-CZ 3.33Å; A513-F883 VanDerWaalsContact O-CD1 3.26Å; A513-F883 WeakPolarHBondContact O-CD1 3.44Å
514	S	91.9	Very high	88.8	Confident	17 Å²	17	21 Å²	21	12%	0.119	11%	0.113	C	C	.	.	H	α-helix	trans	-61.7	-49.1	177	-178.7	0	0	0	0	111.8	L510 F511 V518 F883 G887	L510-S514 PolarHBondContact O-N 3.41Å; F511-S514 PolarHBondContact O-N 3.5Å; S514-V518 WeakPolarHBondContact O-CB 3.38Å; S514-V518 VanDerWaalsContact O-CG2 3.26Å; S514-V518 WeakPolarHBondContact O-CG2 3.49Å; S514-V518 PolarHBondContact O-N 3.33Å; S514-F883 PolarHBondContact OG-O 3.44Å; S514-F883 VanDerWaalsContact OG-O 3.04Å; S514-G887 WeakPolarHBondContact OG-CA 3.39Å; S514-G887 PolarHBondContact OG-N 3.49Å
515	L	91.9	Very high	88.9	Confident	59 Å²	59	21 Å²	21	31%	0.309	11%	0.113	S	C	.	.	H	α-helix	trans	-66.2	-50	-176.2	-179.1	64.9	0	0	0	111.7	F511 G512 A519 M828 V831 M835 L837	F511-L515 HydrophobicContact CE1-CD2 4.36Å; F511-L515 WeakPolarHBondContact O-CB 3.5Å; F511-L515 PolarHBondContact O-N 2.92Å; G512-L515 PolarHBondContact O-N 3.45Å; L515-A519 WeakPolarHBondContact O-CB 3.41Å; L515-A519 PolarHBondContact O-N 3.42Å; L515-M828 HydrophobicContact CD2-CE 4.42Å; L515-M828 HydrophobicContact CG-CE 3.97Å; L515-V831 HydrophobicContact CD2-CG1 4.07Å; L515-M835 HydrophobicContact CD2-SD 3.87Å; L515-L837 HydrophobicContact CD2-CD1 4.43Å
516	T	91.7	Very high	89.2	Confident	2 Å²	2	20.2 Å²	20.2	1%	0.012	11%	0.107	C	C	.	.	H	α-helix	trans	-64.5	-43	179.6	56.2	0	0	0	0	112	G512 A513 Y520 M828 C832 F840	G512-T516 WeakPolarHBondContact O-CB 3.37Å; G512-T516 VanDerWaalsContact O-CG2 3.26Å; G512-T516 WeakPolarHBondContact O-CG2 3.43Å; G512-T516 PolarHBondContact O-N 2.8Å; G512-T516 PolarHBondContact O-OG1 2.66Å; A513-T516 PolarHBondContact O-OG1 2.98Å; T516-Y520 WeakPolarHBondContact O-CB 3.33Å; T516-Y520 PolarHBondContact O-N 3.16Å; T516-M828 HydrophobicContact CG2-CB 4.13Å; T516-M828 HydrophobicContact CG2-CE 4.01Å; T516-C832 WeakPolarHBondContact CG2-SG 3.25Å; T516-F840 HydrophobicContact CG2-CB 4.36Å; T516-F840 HydrophobicContact CG2-CD2 4.04Å
517	G	92	Very high	89.5	Confident	0 Å²	0	19.8 Å²	19.8	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-68.6	-39.6	-179.3	0	0	0	0	0	113.9	A513 S521 F883	A513-G517 PolarHBondContact O-N 3.42Å; G517-S521 VanDerWaalsContact O-CB 3.32Å; G517-S521 WeakPolarHBondContact O-CB 3.37Å; G517-S521 PolarHBondContact O-N 2.93Å; G517-S521 PolarHBondContact O-OG 3.35Å; G517-F883 VanDerWaalsContact CA-CG 3.42Å; G517-F883 WeakPolarHBondContact O-CD2 3.38Å
518	V	93.8	Very high	89.7	Confident	34 Å²	34	19.2 Å²	19.2	21%	0.206	10%	0.099	C	C	.	.	H	α-helix	trans	-62.6	-50.7	174	168.1	0	0	0	0	110.3	S514 Y520 S521 L522 F880 F883	S514-V518 WeakPolarHBondContact O-CB 3.38Å; S514-V518 VanDerWaalsContact O-CG2 3.26Å; S514-V518 WeakPolarHBondContact O-CG2 3.49Å; S514-V518 PolarHBondContact O-N 3.33Å; V518-Y520 VanDerWaalsContact C-N 3.34Å; V518-Y520 PolarHBondContact O-N 2.9Å; V518-S521 PolarHBondContact O-N 3.31Å; V518-S521 PolarHBondContact O-OG 2.94Å; V518-L522 HydrophobicContact CG1-CD1 4.23Å; V518-L522 WeakPolarHBondContact O-CG 3.4Å; V518-L522 PolarHBondContact O-N 3.48Å; V518-F880 HydrophobicContact CG1-CD2 4Å; V518-F880 HydrophobicContact CG1-CE2 3.78Å; V518-F883 HydrophobicContact CG2-CB 3.82Å
519	A	93.2	Very high	90	Very high	19 Å²	19	19.2 Å²	19.2	16%	0.157	10%	0.099	C	C	.	.	H	α-helix	trans	-60.3	-43.6	179.1	0	0	0	0	0	112	L515 L522 F523 M828	L515-A519 WeakPolarHBondContact O-CB 3.41Å; L515-A519 PolarHBondContact O-N 3.42Å; A519-L522 PolarHBondContact O-N 3.04Å; A519-F523 WeakPolarHBondContact O-CD2 3.49Å; A519-F523 PolarHBondContact O-N 2.97Å; A519-F523 VanDerWaalsContact O-N 3.12Å; A519-M828 HydrophobicContact CB-CE 4.02Å; A519-M828 HydrophobicContact CB-CG 4Å; A519-M828 HydrophobicContact CB-SD 3.4Å; A519-M828 WeakPolarHBondContact CB-SD 3.34Å
520	Y	92.8	Very high	90.1	Very high	1 Å²	1	19.3 Å²	19.3	0%	0.004	10%	0.1	C	C	.	.	H	α-helix	trans	-64.5	-47.1	177.6	-172.5	-92.7	0	0	0	111.9	T516 V518 L522 F523 A524 T529 L531 Q798 I824 V825	T516-Y520 WeakPolarHBondContact O-CB 3.33Å; T516-Y520 PolarHBondContact O-N 3.16Å; V518-Y520 VanDerWaalsContact C-N 3.34Å; V518-Y520 PolarHBondContact O-N 2.9Å; Y520-L522 PolarHBondContact O-N 3.24Å; Y520-L522 VanDerWaalsContact O-N 3.17Å; Y520-F523 PolarHBondContact O-N 3.49Å; Y520-A524 HydrophobicContact CD1-CB 3.79Å; Y520-A524 HydrophobicContact CD2-CB 4.03Å; Y520-A524 HydrophobicContact CE1-CB 3.57Å; Y520-A524 HydrophobicContact CE2-CB 3.84Å; Y520-A524 HydrophobicContact CG-CB 4.01Å; Y520-A524 WeakPolarHBondContact O-CA 3.42Å; Y520-A524 WeakPolarHBondContact O-CB 3.21Å; Y520-A524 PolarHBondContact O-N 2.72Å; Y520-T529 HydrophobicContact CE1-CG2 4.38Å; Y520-T529 WeakPolarHBondContact CE1-O 3.44Å; Y520-T529 WeakPolarHBondContact OH-CB 3.3Å; Y520-L531 VanDerWaalsContact CB-CD1 3.45Å; Y520-L531 HydrophobicContact CD1-CD1 4.27Å; Y520-L531 HydrophobicContact CD1-CD2 4.41Å; Y520-L531 HydrophobicContact CD1-CG 3.99Å; Y520-L531 HydrophobicContact CD2-CD1 3.77Å; Y520-L531 HydrophobicContact CD2-CD2 4.14Å; Y520-L531 HydrophobicContact CD2-CG 4.13Å; Y520-L531 HydrophobicContact CE1-CD2 4.47Å; Y520-L531 HydrophobicContact CE1-CG 4.49Å; Y520-L531 HydrophobicContact CE2-CD2 4.2Å; Y520-L531 HydrophobicContact CG-CD1 3.56Å; Y520-L531 HydrophobicContact CG-CD2 4.25Å; Y520-L531 HydrophobicContact CG-CG 3.79Å; Y520-Q798 PolarHBondContact OH-NE2 3.44Å; Y520-I824 HydrophobicContact CD2-CB 4.43Å; Y520-I824 HydrophobicContact CD2-CG2 3.94Å; Y520-V825 HydrophobicContact CD2-CG2 3.95Å; Y520-V825 HydrophobicContact CE2-CG2 3.7Å
521	S	91.3	Very high	90.3	Very high	3 Å²	3	19.3 Å²	19.3	2%	0.021	10%	0.1	C	C	.	.	H	α-helix	trans	-59.1	-32.1	179.8	68.2	0	0	0	0	113.7	G517 V518 F880	G517-S521 VanDerWaalsContact O-CB 3.32Å; G517-S521 WeakPolarHBondContact O-CB 3.37Å; G517-S521 PolarHBondContact O-N 2.93Å; G517-S521 PolarHBondContact O-OG 3.35Å; V518-S521 PolarHBondContact O-N 3.31Å; V518-S521 PolarHBondContact O-OG 2.94Å; S521-F880 VanDerWaalsContact OG-CA 3.29Å; S521-F880 WeakPolarHBondContact OG-CA 3.4Å; S521-F880 WeakPolarHBondContact OG-CB 3.2Å; S521-F880 PolarHBondContact OG-N 3.27Å
522	L	90.3	Very high	90.3	Very high	53 Å²	53	16.6 Å²	16.6	28%	0.277	9%	0.089	S	C	.	.	H	α-helix	trans	-77	-47.9	177.9	-69.2	173.5	0	0	0	112.3	Y462 V518 A519 Y520 R876 F880	Y462-L522 WeakPolarHBondContact CE2-O 3.39Å; V518-L522 HydrophobicContact CG1-CD1 4.23Å; V518-L522 WeakPolarHBondContact O-CG 3.4Å; V518-L522 PolarHBondContact O-N 3.48Å; A519-L522 PolarHBondContact O-N 3.04Å; Y520-L522 PolarHBondContact O-N 3.24Å; Y520-L522 VanDerWaalsContact O-N 3.17Å; L522-R876 PolarHBondContact O-NH1 3.06Å; L522-R876 VanDerWaalsContact O-NH1 3.11Å; L522-F880 HydrophobicContact CD1-CD2 4.35Å; L522-F880 HydrophobicContact CD1-CE2 4.23Å; L522-F880 HydrophobicContact CD2-CD2 3.94Å; L522-F880 HydrophobicContact CD2-CE2 4.27Å; L522-F880 HydrophobicContact CG-CD2 4.03Å; L522-F880 HydrophobicContact CG-CE2 4.38Å
523	F	90.1	Very high	89.9	Confident	129 Å²	129	17.3 Å²	17.3	57%	0.566	9%	0.094	S	C	*	.	H	α-helix	trans	-105.1	-9	-168.6	-60.9	-68.6	0	0	0	115.2	A519 Y520 I824	A519-F523 WeakPolarHBondContact O-CD2 3.49Å; A519-F523 PolarHBondContact O-N 2.97Å; A519-F523 VanDerWaalsContact O-N 3.12Å; Y520-F523 PolarHBondContact O-N 3.49Å; F523-I824 HydrophobicContact CB-CD1 3.6Å; F523-I824 HydrophobicContact CB-CG1 4Å
524	A	88.6	Confident	89.6	Confident	0 Å²	0	18.1 Å²	18.1	0%	0	10%	0.099	C	C	.	.			trans	-60.5	148.9	-178.4	0	0	0	0	0	111.8	Y520 R876	Y520-A524 HydrophobicContact CD1-CB 3.79Å; Y520-A524 HydrophobicContact CD2-CB 4.03Å; Y520-A524 HydrophobicContact CE1-CB 3.57Å; Y520-A524 HydrophobicContact CE2-CB 3.84Å; Y520-A524 HydrophobicContact CG-CB 4.01Å; Y520-A524 WeakPolarHBondContact O-CA 3.42Å; Y520-A524 WeakPolarHBondContact O-CB 3.21Å; Y520-A524 PolarHBondContact O-N 2.72Å; A524-R876 PolarHBondContact O-NH1 3.41Å; A524-R876 PolarHBondContact O-NH2 3.33Å; A524-R876 VanDerWaalsContact O-NH2 3.08Å
525	G	83.9	Confident	89	Confident	0 Å²	0	18.8 Å²	18.8	0%	0	11%	0.109	C	C	.	.	S	Bend	trans	-55.6	-68.1	158.2	0	0	0	0	0	108.8	K458 P527 D821	K458-G525 VanDerWaalsContact CD-O 3.27Å; K458-G525 WeakPolarHBondContact CD-O 3.35Å; K458-G525 WeakPolarHBondContact CE-O 3.48Å; K458-G525 PolarHBondContact NZ-O 3.06Å; G525-P527 WeakPolarHBondContact O-CD 3.28Å; G525-D821 WeakPolarHBondContact CA-OD1 3.27Å; G525-D821 PolarHBondContact N-OD1 2.98Å
526	Q	88.7	Confident	88.4	Confident	6 Å²	6	17.5 Å²	17.5	3%	0.028	10%	0.104	C	C	.	.			trans	-100.1	95.6	-175.9	-169.2	64.3	-9.7	0	0	112.4	L528 T529 I805 N806 D821	Q526-L528 HydrophobicContact CG-CB 4.48Å; Q526-L528 PolarHBondContact O-N 2.89Å; Q526-L528 VanDerWaalsContact O-N 3.17Å; Q526-T529 PolarHBondContact O-N 3.5Å; Q526-T529 PolarHBondContact O-OG1 3.18Å; Q526-I805 HydrophobicContact CG-CG2 3.86Å; Q526-N806 PolarHBondContact NE2-OD1 2.84Å; Q526-N806 VanDerWaalsContact NE2-OD1 3.11Å; Q526-D821 WeakPolarHBondContact CB-OD2 3.37Å; Q526-D821 PolarHBondContact N-OD1 2.89Å; Q526-D821 PolarHBondContact N-OD2 2.7Å
527	P	86.7	Confident	87.9	Confident	9 Å²	9	17.7 Å²	17.7	6%	0.058	11%	0.105	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74	-7	-175	32.8	-39.2	0	0	0	114.3	G525 R876	G525-P527 WeakPolarHBondContact O-CD 3.28Å; P527-R876 HydrophobicContact CB-CB 4.32Å; P527-R876 HydrophobicContact CB-CG 3.64Å; P527-R876 HydrophobicContact CG-CG 3.69Å
528	L	88.8	Confident	87.5	Confident	1 Å²	1	19 Å²	19	1%	0.005	11%	0.112	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-18.6	174.1	-64.4	178.3	0	0	0	112.3	Q526 I805 L812 H850 V851 L854 I872 E874	Q526-L528 HydrophobicContact CG-CB 4.48Å; Q526-L528 PolarHBondContact O-N 2.89Å; Q526-L528 VanDerWaalsContact O-N 3.17Å; L528-I805 HydrophobicContact CB-CG2 4.15Å; L528-L812 HydrophobicContact CD1-CD2 4.19Å; L528-H850 PolarHBondContact O-ND1 2.98Å; L528-V851 HydrophobicContact CB-CG2 4.13Å; L528-V851 HydrophobicContact CD1-CG2 4.2Å; L528-L854 HydrophobicContact CD2-CD1 3.53Å; L528-I872 HydrophobicContact CD1-CG2 4.11Å; L528-E874 HydrophobicContact CD1-CG 4.45Å
529	T	90.7	Very high	86.9	Confident	3 Å²	3	19.9 Å²	19.9	2%	0.018	12%	0.117	C	C	.	.	P	Polyproline II helix	trans	-74.5	130.1	176.8	-46.5	0	0	0	0	110.4	Y520 Q526 I805 A842	Y520-T529 HydrophobicContact CE1-CG2 4.38Å; Y520-T529 WeakPolarHBondContact CE1-O 3.44Å; Y520-T529 WeakPolarHBondContact OH-CB 3.3Å; Q526-T529 PolarHBondContact O-N 3.5Å; Q526-T529 PolarHBondContact O-OG1 3.18Å; T529-I805 HydrophobicContact CG2-CD1 3.98Å; T529-I805 WeakPolarHBondContact OG1-CD1 3.43Å; T529-A842 HydrophobicContact CG2-CB 3.38Å
530	I	91.3	Very high	86.5	Confident	2 Å²	2	19.7 Å²	19.7	1%	0.01	11%	0.113	C	C	.	.	P	Polyproline II helix	trans	-103.7	126.1	177.1	-62.4	-177.6	0	0	0	108.5	L481 A843 L846 S847 H850 F883	L481-I530 HydrophobicContact CD1-CD1 4.28Å; L481-I530 HydrophobicContact CD2-CD1 3.94Å; I530-A843 PolarHBondContact O-N 3.1Å; I530-L846 HydrophobicContact CB-CB 4.39Å; I530-L846 HydrophobicContact CG2-CB 4.4Å; I530-L846 HydrophobicContact CG2-CD2 4.33Å; I530-S847 PolarHBondContact N-OG 2.73Å; I530-H850 HydrophobicContact CD1-CB 3.76Å; I530-H850 HydrophobicContact CG1-CB 4.37Å; I530-F883 HydrophobicContact CG2-CE1 4.46Å; I530-F883 HydrophobicContact CG2-CE2 4.31Å; I530-F883 HydrophobicContact CG2-CZ 3.65Å
531	L	90.4	Very high	86.2	Confident	4 Å²	4	19.8 Å²	19.8	2%	0.021	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	137.8	172.1	-60	-175.8	0	0	0	110.7	Y520 V825 F840 V841 A842 F883	Y520-L531 VanDerWaalsContact CB-CD1 3.45Å; Y520-L531 HydrophobicContact CD1-CD1 4.27Å; Y520-L531 HydrophobicContact CD1-CD2 4.41Å; Y520-L531 HydrophobicContact CD1-CG 3.99Å; Y520-L531 HydrophobicContact CD2-CD1 3.77Å; Y520-L531 HydrophobicContact CD2-CD2 4.14Å; Y520-L531 HydrophobicContact CD2-CG 4.13Å; Y520-L531 HydrophobicContact CE1-CD2 4.47Å; Y520-L531 HydrophobicContact CE1-CG 4.49Å; Y520-L531 HydrophobicContact CE2-CD2 4.2Å; Y520-L531 HydrophobicContact CG-CD1 3.56Å; Y520-L531 HydrophobicContact CG-CD2 4.25Å; Y520-L531 HydrophobicContact CG-CG 3.79Å; L531-V825 HydrophobicContact CD2-CG2 4.08Å; L531-F840 HydrophobicContact CB-CB 4.35Å; L531-V841 CarbonylContact C-O 3.58Å; L531-V841 WeakPolarHBondContact CA-O 3.4Å; L531-A842 HydrophobicContact CD2-CB 4.35Å; L531-F883 HydrophobicContact CB-CZ 4.49Å; L531-F883 WeakPolarHBondContact O-CZ 3.17Å
532	G	87.6	Confident	85.9	Confident	5 Å²	5	26 Å²	26	5%	0.052	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	165.9	-180	0	0	0	0	0	111.6	F840 V841	G532-F840 VanDerWaalsContact C-CD1 3.49Å; G532-V841 PolarHBondContact N-O 2.96Å; G532-V841 PolarHBondContact O-N 3.44Å
533	S	82.5	Confident	85.7	Confident	15 Å²	15	27 Å²	27	11%	0.105	15%	0.145	C	C	.	.			trans	-76.2	131.5	169.1	-172	0	0	0	0	108.5
534	T	82.9	Confident	85.5	Confident	19 Å²	19	21.3 Å²	21.3	12%	0.117	12%	0.12	C	C	.	.			trans	-109.6	149.9	-179.5	67.4	0	0	0	0	110.7	V537 L538	T534-V537 PolarHBondContact O-N 2.99Å; T534-V537 WeakPolarHBondContact OG1-CG2 3.34Å; T534-L538 PolarHBondContact O-N 3.15Å; T534-L538 VanDerWaalsContact O-N 3.12Å
535	G	79.3	Confident	85.5	Confident	31 Å²	31	22.5 Å²	22.5	32%	0.32	13%	0.125	S	C	.	.	H	α-helix	trans	-53.1	-43.9	177.9	0	0	0	0	0	114.3	V537 L538 V539	G535-V537 VanDerWaalsContact C-N 3.34Å; G535-V537 PolarHBondContact O-N 3.11Å; G535-L538 WeakPolarHBondContact O-CB 3.13Å; G535-L538 PolarHBondContact O-N 3.38Å; G535-V539 WeakPolarHBondContact O-CG2 3.43Å; G535-V539 PolarHBondContact O-N 3.43Å
536	P	78.9	Confident	85.6	Confident	32 Å²	32	28.9 Å²	28.9	21%	0.208	15%	0.153	C	C	.	.	H	α-helix	trans	-60.4	-39.7	177.7	-26.9	36.5	0	0	0	113.8	V539 F540 L793 F975	P536-V539 PolarHBondContact O-N 3.25Å; P536-F540 PolarHBondContact O-N 2.76Å; P536-L793 HydrophobicContact CB-CD1 3.75Å; P536-L793 HydrophobicContact CB-CD2 4.31Å; P536-L793 HydrophobicContact CB-CG 4.29Å; P536-F975 HydrophobicContact CG-CD1 4.21Å; P536-F975 HydrophobicContact CG-CE1 4.37Å
537	V	82.8	Confident	85.5	Confident	5 Å²	5	32.8 Å²	32.8	3%	0.03	17%	0.17	C	C	.	.	H	α-helix	trans	-63.8	-44.6	174.6	175	0	0	0	0	110.2	T534 G535 V539 F540 E541 L793 W839 V841	T534-V537 PolarHBondContact O-N 2.99Å; T534-V537 WeakPolarHBondContact OG1-CG2 3.34Å; G535-V537 VanDerWaalsContact C-N 3.34Å; G535-V537 PolarHBondContact O-N 3.11Å; V537-V539 VanDerWaalsContact C-N 3.33Å; V537-V539 PolarHBondContact O-N 3.39Å; V537-F540 WeakPolarHBondContact O-CB 3.31Å; V537-F540 PolarHBondContact O-N 2.79Å; V537-E541 HydrophobicContact CG1-CG 4.45Å; V537-E541 VanDerWaalsContact O-CG 3.24Å; V537-E541 WeakPolarHBondContact O-CG 3.2Å; V537-E541 PolarHBondContact O-N 3.48Å; V537-L793 HydrophobicContact CG2-CD2 3.73Å; V537-W839 HydrophobicContact CG1-CB 4.18Å; V537-W839 HydrophobicContact CG1-CE3 4.31Å; V537-V841 HydrophobicContact CG2-CG2 4.12Å
538	L	82.4	Confident	85.5	Confident	28 Å²	28	32.5 Å²	32.5	15%	0.147	17%	0.169	C	C	.	.	H	α-helix	trans	-58.1	-43.2	176.2	-179.6	71.4	0	0	0	112.6	F492 L495 L496 T534 G535 E541 K542	F492-L538 HydrophobicContact CD1-CD2 3.9Å; F492-L538 HydrophobicContact CE1-CD2 4.42Å; L495-L538 HydrophobicContact CB-CD2 4.32Å; L495-L538 HydrophobicContact CD1-CD2 4.43Å; L496-L538 HydrophobicContact CB-CD1 3.77Å; L496-L538 HydrophobicContact CD1-CD1 3.84Å; L496-L538 HydrophobicContact CG-CD1 4.34Å; T534-L538 PolarHBondContact O-N 3.15Å; T534-L538 VanDerWaalsContact O-N 3.12Å; G535-L538 WeakPolarHBondContact O-CB 3.13Å; G535-L538 PolarHBondContact O-N 3.38Å; L538-E541 PolarHBondContact O-N 2.86Å; L538-K542 PolarHBondContact O-N 2.84Å
539	V	82.3	Confident	85.5	Confident	52 Å²	52	38.8 Å²	38.8	32%	0.315	20%	0.196	S	C	.	.	H	α-helix	trans	-64.9	-42.9	178.5	173.5	0	0	0	0	111	G535 P536 V537 E541 K542 I543 A972	G535-V539 WeakPolarHBondContact O-CG2 3.43Å; G535-V539 PolarHBondContact O-N 3.43Å; P536-V539 PolarHBondContact O-N 3.25Å; V537-V539 VanDerWaalsContact C-N 3.33Å; V537-V539 PolarHBondContact O-N 3.39Å; V539-E541 VanDerWaalsContact C-N 3.3Å; V539-E541 PolarHBondContact O-N 3.24Å; V539-K542 PolarHBondContact O-N 2.91Å; V539-I543 HydrophobicContact CG1-CD1 3.85Å; V539-I543 WeakPolarHBondContact O-CG1 3.49Å; V539-I543 PolarHBondContact O-N 3.45Å; V539-I543 VanDerWaalsContact O-N 3.07Å; V539-A972 HydrophobicContact CG1-CB 4.15Å
540	F	84.8	Confident	85.3	Confident	15 Å²	15	43.9 Å²	43.9	7%	0.066	22%	0.223	C	C	.	.	H	α-helix	trans	-57.3	-45	174.6	177.9	-89.7	0	0	0	111.3	P536 V537 I543 L544 I562 P786 C790 W839 V973	P536-F540 PolarHBondContact O-N 2.76Å; V537-F540 WeakPolarHBondContact O-CB 3.31Å; V537-F540 PolarHBondContact O-N 2.79Å; F540-I543 PolarHBondContact O-N 2.99Å; F540-L544 HydrophobicContact CE1-CD2 4.22Å; F540-L544 WeakPolarHBondContact O-CB 3.37Å; F540-L544 PolarHBondContact O-N 3.23Å; F540-I562 HydrophobicContact CE1-CG2 4.49Å; F540-I562 HydrophobicContact CZ-CG2 4.25Å; F540-P786 HydrophobicContact CE2-CB 4.25Å; F540-P786 HydrophobicContact CZ-CB 4.02Å; F540-C790 HydrophobicContact CE2-CB 4.31Å; F540-C790 HydrophobicContact CZ-CB 4.14Å; F540-W839 HydrophobicContact CD1-CH2 4.38Å; F540-W839 AromaticContact CD1-CZ3 3.65Å; F540-W839 HydrophobicContact CD1-CZ3 3.65Å; F540-W839 AromaticContact CE1-CH2 3.77Å; F540-W839 HydrophobicContact CE1-CH2 3.77Å; F540-W839 AromaticContact CE1-CZ3 3.45Å; F540-W839 HydrophobicContact CE1-CZ3 3.45Å; F540-W839 VanDerWaalsContact CE1-CZ3 3.45Å; F540-V973 HydrophobicContact CD2-CG1 4.44Å
541	E	86	Confident	85.1	Confident	3 Å²	3	51.5 Å²	51.5	1%	0.014	25%	0.253	C	S	.	.	H	α-helix	trans	-63.6	-41.8	178.6	-66.5	-69.6	-172.5	0	0	113	L496 V537 L538 V539 I543 L544 F545 Y555 R559	L496-E541 HydrophobicContact CD1-CB 3.87Å; L496-E541 HydrophobicContact CD1-CG 4.48Å; V537-E541 HydrophobicContact CG1-CG 4.45Å; V537-E541 VanDerWaalsContact O-CG 3.24Å; V537-E541 WeakPolarHBondContact O-CG 3.2Å; V537-E541 PolarHBondContact O-N 3.48Å; L538-E541 PolarHBondContact O-N 2.86Å; V539-E541 VanDerWaalsContact C-N 3.3Å; V539-E541 PolarHBondContact O-N 3.24Å; E541-I543 VanDerWaalsContact C-N 3.31Å; E541-I543 PolarHBondContact O-N 2.97Å; E541-L544 PolarHBondContact O-N 3.46Å; E541-F545 WeakPolarHBondContact O-CB 3.39Å; E541-F545 PolarHBondContact O-N 3.47Å; E541-Y555 PolarHBondContact OE2-OH 3.3Å; E541-R559 IonicContact OE1-CZ 3.05Å; E541-R559 IonicContact OE1-NH1 3.93Å; E541-R559 PolarHBondContact OE1-NH1 3.32Å; E541-R559 IonicContact OE1-NH2 3.28Å; E541-R559 PolarHBondContact OE1-NH2 2.99Å; E541-R559 IonicContact OE2-CZ 2.75Å; E541-R559 IonicContact OE2-NH1 2.83Å; E541-R559 PolarHBondContact OE2-NH1 3.22Å
542	K	84.3	Confident	84.8	Confident	133 Å²	133	54.6 Å²	54.6	58%	0.578	29%	0.286	S	S	*	.	H	α-helix	trans	-61.6	-41.2	176.4	-175.4	174.7	-177.3	175	0	111.6	A499 L538 V539 K546	A499-K542 HydrophobicContact CB-CG 4.33Å; L538-K542 PolarHBondContact O-N 2.84Å; V539-K542 PolarHBondContact O-N 2.91Å; K542-K546 WeakPolarHBondContact O-CB 3.35Å; K542-K546 PolarHBondContact O-N 2.78Å
543	I	86	Confident	84.7	Confident	74 Å²	74	55.6 Å²	55.6	38%	0.379	29%	0.289	S	S	.	.	H	α-helix	trans	-70.2	-43.1	178.1	-69.4	166.1	0	0	0	110.6	V539 F540 E541 F545 K546 F547 V973	V539-I543 HydrophobicContact CG1-CD1 3.85Å; V539-I543 WeakPolarHBondContact O-CG1 3.49Å; V539-I543 PolarHBondContact O-N 3.45Å; V539-I543 VanDerWaalsContact O-N 3.07Å; F540-I543 PolarHBondContact O-N 2.99Å; E541-I543 VanDerWaalsContact C-N 3.31Å; E541-I543 PolarHBondContact O-N 2.97Å; I543-F545 VanDerWaalsContact C-N 3.31Å; I543-F545 PolarHBondContact O-N 2.88Å; I543-K546 PolarHBondContact O-N 2.93Å; I543-F547 WeakPolarHBondContact O-CB 3.41Å; I543-F547 PolarHBondContact O-N 3.41Å; I543-V973 HydrophobicContact CD1-CG2 3.2Å
544	L	86.9	Confident	84.9	Confident	10 Å²	10	56.4 Å²	56.4	5%	0.052	30%	0.295	C	S	.	.	H	α-helix	trans	-59.1	-44.1	175.3	-177.7	63.5	0	0	0	111.1	F540 E541 F547 C548 Y555 L558 R559 I562	F540-L544 HydrophobicContact CE1-CD2 4.22Å; F540-L544 WeakPolarHBondContact O-CB 3.37Å; F540-L544 PolarHBondContact O-N 3.23Å; E541-L544 PolarHBondContact O-N 3.46Å; L544-F547 PolarHBondContact O-N 2.89Å; L544-C548 WeakPolarHBondContact O-CB 3.49Å; L544-C548 PolarHBondContact O-N 3.48Å; L544-C548 PolarHBondContact O-SG 3.42Å; L544-Y555 HydrophobicContact CB-CE2 4.34Å; L544-Y555 HydrophobicContact CD2-CD2 4.37Å; L544-Y555 HydrophobicContact CD2-CE2 3.93Å; L544-Y555 HydrophobicContact CG-CD2 4.16Å; L544-Y555 HydrophobicContact CG-CE2 4.02Å; L544-L558 HydrophobicContact CD1-CD2 3.79Å; L544-L558 HydrophobicContact CD1-CG 4.33Å; L544-R559 HydrophobicContact CD2-CB 4.28Å; L544-I562 HydrophobicContact CD1-CD1 3.43Å; L544-I562 VanDerWaalsContact CD1-CD1 3.43Å; L544-I562 HydrophobicContact CD2-CD1 3.8Å; L544-I562 HydrophobicContact CG-CD1 4.28Å
545	F	88.4	Confident	85.1	Confident	25 Å²	25	56 Å²	56	11%	0.11	29%	0.292	C	S	.	.	H	α-helix	trans	-63.9	-43.8	176.7	-176.9	-102.6	0	0	0	112.3	A499 T500 K501 E541 I543 C548 K549 Y555	A499-F545 WeakPolarHBondContact O-CD1 3.43Å; A499-F545 VanDerWaalsContact O-CE1 3.26Å; A499-F545 WeakPolarHBondContact O-CE1 3.31Å; T500-F545 HydrophobicContact CG2-CB 4.47Å; T500-F545 HydrophobicContact CG2-CD2 4.32Å; T500-F545 HydrophobicContact CG2-CG 4.33Å; T500-F545 WeakPolarHBondContact O-CE2 3.48Å; T500-F545 WeakPolarHBondContact O-CZ 3.47Å; K501-F545 HydrophobicContact CB-CZ 4.41Å; K501-F545 HydrophobicContact CD-CZ 4.48Å; K501-F545 HydrophobicContact CG-CE1 4.35Å; K501-F545 HydrophobicContact CG-CZ 4.26Å; E541-F545 WeakPolarHBondContact O-CB 3.39Å; E541-F545 PolarHBondContact O-N 3.47Å; I543-F545 VanDerWaalsContact C-N 3.31Å; I543-F545 PolarHBondContact O-N 2.88Å; F545-C548 PolarHBondContact O-N 3.33Å; F545-K549 WeakPolarHBondContact O-CB 3.4Å; F545-K549 PolarHBondContact O-N 2.93Å; F545-Y555 HydrophobicContact CB-CD2 4.04Å; F545-Y555 HydrophobicContact CB-CE2 4.04Å; F545-Y555 HydrophobicContact CD2-CD1 4Å; F545-Y555 AromaticContact CD2-CD2 3.97Å; F545-Y555 HydrophobicContact CD2-CD2 3.97Å; F545-Y555 HydrophobicContact CD2-CE1 4.47Å; F545-Y555 HydrophobicContact CD2-CE2 4.45Å; F545-Y555 AromaticContact CD2-CG 3.74Å; F545-Y555 HydrophobicContact CD2-CG 3.74Å
546	K	86.4	Confident	85.4	Confident	135 Å²	135	56 Å²	56	59%	0.587	28%	0.284	S	S	*	.	H	α-helix	trans	-61.1	-45.7	175.6	-173.2	177.1	178.1	179.2	0	111.4	K542 I543 C548 K549 D550	K542-K546 WeakPolarHBondContact O-CB 3.35Å; K542-K546 PolarHBondContact O-N 2.78Å; I543-K546 PolarHBondContact O-N 2.93Å; K546-C548 PolarHBondContact O-N 2.96Å; K546-K549 WeakPolarHBondContact O-CB 3.47Å; K546-K549 PolarHBondContact O-N 3.48Å; K546-K549 VanDerWaalsContact O-N 3.17Å; K546-D550 VanDerWaalsContact O-CG 3.22Å; K546-D550 PolarHBondContact O-N 3.35Å
547	F	86.6	Confident	85.8	Confident	88 Å²	88	54.8 Å²	54.8	39%	0.386	28%	0.276	S	S	.	.	H	α-helix	trans	-57.9	-48.6	175.2	179.3	-93.2	0	0	0	111.5	I543 L544 K549 D550 Y551 L553 L558	I543-F547 WeakPolarHBondContact O-CB 3.41Å; I543-F547 PolarHBondContact O-N 3.41Å; L544-F547 PolarHBondContact O-N 2.89Å; F547-K549 VanDerWaalsContact C-N 3.27Å; F547-K549 PolarHBondContact O-N 2.94Å; F547-D550 PolarHBondContact O-N 2.9Å; F547-Y551 HydrophobicContact CD1-CD2 4.25Å; F547-Y551 AromaticContact CD2-CD2 3.6Å; F547-Y551 HydrophobicContact CD2-CD2 3.6Å; F547-Y551 AromaticContact CD2-CE2 3.44Å; F547-Y551 HydrophobicContact CD2-CE2 3.44Å; F547-Y551 VanDerWaalsContact CD2-CE2 3.44Å; F547-Y551 HydrophobicContact CE1-CD2 4.1Å; F547-Y551 AromaticContact CE2-CD2 3.43Å; F547-Y551 HydrophobicContact CE2-CD2 3.43Å; F547-Y551 VanDerWaalsContact CE2-CD2 3.43Å; F547-Y551 AromaticContact CE2-CE2 3.13Å; F547-Y551 HydrophobicContact CE2-CE2 3.13Å; F547-Y551 HydrophobicContact CE2-CG 4.48Å; F547-Y551 AromaticContact CE2-CZ 3.98Å; F547-Y551 HydrophobicContact CG-CD2 4.02Å; F547-Y551 HydrophobicContact CG-CE2 4.31Å; F547-Y551 AromaticContact CZ-CD2 3.68Å; F547-Y551 HydrophobicContact CZ-CD2 3.68Å; F547-Y551 AromaticContact CZ-CE2 3.78Å; F547-Y551 HydrophobicContact CZ-CE2 3.78Å; F547-Y551 HydrophobicContact CZ-CG 4.38Å; F547-Y551 VanDerWaalsContact O-CD2 3.3Å; F547-Y551 WeakPolarHBondContact O-CD2 3.45Å; F547-Y551 PolarHBondContact O-N 3.42Å; F547-L553 HydrophobicContact CE1-CD1 4.16Å; F547-L558 HydrophobicContact CD1-CD2 4.32Å; F547-L558 HydrophobicContact CE1-CD2 4.39Å
548	C	87.1	Confident	86.1	Confident	3 Å²	3	55 Å²	55	2%	0.02	28%	0.277	C	S	.	.	H	α-helix	trans	-59.1	-39.3	176.4	-70.4	0	0	0	0	112.5	L544 F545 K546 G552 L553 L558	L544-C548 WeakPolarHBondContact O-CB 3.49Å; L544-C548 PolarHBondContact O-N 3.48Å; L544-C548 PolarHBondContact O-SG 3.42Å; F545-C548 PolarHBondContact O-N 3.33Å; K546-C548 PolarHBondContact O-N 2.96Å; C548-G552 CarbonylContact O-C 3.53Å; C548-G552 WeakPolarHBondContact O-CA 3.35Å; C548-G552 PolarHBondContact O-N 3.46Å; C548-L553 HydrophobicContact CB-CB 4.45Å; C548-L553 WeakPolarHBondContact CB-O 3.35Å; C548-L553 PolarHBondContact O-N 3.39Å; C548-L558 WeakPolarHBondContact SG-CD2 3.36Å
549	K	87.1	Confident	86.4	Confident	133 Å²	133	53.6 Å²	53.6	58%	0.578	27%	0.27	S	S	*	.	H	α-helix	trans	-67.7	-41.5	178.1	-169.6	-173.9	175.3	-158.9	0	112.4	F545 K546 F547	F545-K549 WeakPolarHBondContact O-CB 3.4Å; F545-K549 PolarHBondContact O-N 2.93Å; K546-K549 WeakPolarHBondContact O-CB 3.47Å; K546-K549 PolarHBondContact O-N 3.48Å; K546-K549 VanDerWaalsContact O-N 3.17Å; F547-K549 VanDerWaalsContact C-N 3.27Å; F547-K549 PolarHBondContact O-N 2.94Å
550	D	88.4	Confident	86.8	Confident	109 Å²	109	51.2 Å²	51.2	58%	0.583	26%	0.255	S	S	*	.	H	α-helix	trans	-70	-33.7	-178.2	-65.2	-17.2	0	0	0	111.7	K546 F547	K546-D550 VanDerWaalsContact O-CG 3.22Å; K546-D550 PolarHBondContact O-N 3.35Å; F547-D550 PolarHBondContact O-N 2.9Å
551	Y	85.6	Confident	87.1	Confident	163 Å²	163	50.6 Å²	50.6	64%	0.639	25%	0.253	S	S	*	.	H	α-helix	trans	-97.6	0.2	178.5	-70.6	-81.7	0	0	0	114.7	F547 L553	F547-Y551 HydrophobicContact CD1-CD2 4.25Å; F547-Y551 AromaticContact CD2-CD2 3.6Å; F547-Y551 HydrophobicContact CD2-CD2 3.6Å; F547-Y551 AromaticContact CD2-CE2 3.44Å; F547-Y551 HydrophobicContact CD2-CE2 3.44Å; F547-Y551 VanDerWaalsContact CD2-CE2 3.44Å; F547-Y551 HydrophobicContact CE1-CD2 4.1Å; F547-Y551 AromaticContact CE2-CD2 3.43Å; F547-Y551 HydrophobicContact CE2-CD2 3.43Å; F547-Y551 VanDerWaalsContact CE2-CD2 3.43Å; F547-Y551 AromaticContact CE2-CE2 3.13Å; F547-Y551 HydrophobicContact CE2-CE2 3.13Å; F547-Y551 HydrophobicContact CE2-CG 4.48Å; F547-Y551 AromaticContact CE2-CZ 3.98Å; F547-Y551 HydrophobicContact CG-CD2 4.02Å; F547-Y551 HydrophobicContact CG-CE2 4.31Å; F547-Y551 AromaticContact CZ-CD2 3.68Å; F547-Y551 HydrophobicContact CZ-CD2 3.68Å; F547-Y551 AromaticContact CZ-CE2 3.78Å; F547-Y551 HydrophobicContact CZ-CE2 3.78Å; F547-Y551 HydrophobicContact CZ-CG 4.38Å; F547-Y551 VanDerWaalsContact O-CD2 3.3Å; F547-Y551 WeakPolarHBondContact O-CD2 3.45Å; F547-Y551 PolarHBondContact O-N 3.42Å; Y551-L553 VanDerWaalsContact C-N 3.31Å; Y551-L553 PolarHBondContact O-N 2.84Å
552	G	84.8	Confident	87.4	Confident	69 Å²	69	50.5 Å²	50.5	71%	0.711	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	66	26.9	-179.2	0	0	0	0	0	114.9	C548	C548-G552 CarbonylContact O-C 3.53Å; C548-G552 WeakPolarHBondContact O-CA 3.35Å; C548-G552 PolarHBondContact O-N 3.46Å
553	L	85.4	Confident	87.7	Confident	25 Å²	25	44.1 Å²	44.1	13%	0.131	23%	0.225	C	C	.	.			trans	-89.5	149.4	179	-63.5	173.8	0	0	0	111.6	F547 C548 Y551 Y555 L558 T779	F547-L553 HydrophobicContact CE1-CD1 4.16Å; C548-L553 HydrophobicContact CB-CB 4.45Å; C548-L553 WeakPolarHBondContact CB-O 3.35Å; C548-L553 PolarHBondContact O-N 3.39Å; Y551-L553 VanDerWaalsContact C-N 3.31Å; Y551-L553 PolarHBondContact O-N 2.84Å; L553-Y555 PolarHBondContact O-N 3.35Å; L553-L558 HydrophobicContact CD1-CD2 4.37Å; L553-T779 HydrophobicContact CD1-CG2 4.28Å; L553-T779 HydrophobicContact CD2-CG2 4.08Å
554	S	86.8	Confident	88	Confident	33 Å²	33	43.9 Å²	43.9	23%	0.231	22%	0.224	C	C	.	.			trans	-72.9	114.5	173.8	65.7	0	0	0	0	110.5	L556 L558 N775	S554-L556 PolarHBondContact O-N 3.48Å; S554-L558 PolarHBondContact O-N 3.16Å; S554-N775 PolarHBondContact N-OD1 3.27Å; S554-N775 PolarHBondContact O-ND2 3.49Å; S554-N775 VanDerWaalsContact O-ND2 3.13Å; S554-N775 PolarHBondContact OG-ND2 3.43Å; S554-N775 PolarHBondContact OG-OD1 2.87Å
555	Y	86.7	Confident	88.4	Confident	11 Å²	11	47.1 Å²	47.1	4%	0.043	24%	0.235	C	C	.	.	H	α-helix	trans	-59.9	-43.8	-174.1	164	-107.8	0	0	0	113.6	T500 I504 E541 L544 F545 L553 L558 R559	T500-Y555 HydrophobicContact CG2-CE1 4.27Å; I504-Y555 HydrophobicContact CD1-CE1 3.86Å; I504-Y555 HydrophobicContact CG1-CE1 4.35Å; E541-Y555 PolarHBondContact OE2-OH 3.3Å; L544-Y555 HydrophobicContact CB-CE2 4.34Å; L544-Y555 HydrophobicContact CD2-CD2 4.37Å; L544-Y555 HydrophobicContact CD2-CE2 3.93Å; L544-Y555 HydrophobicContact CG-CD2 4.16Å; L544-Y555 HydrophobicContact CG-CE2 4.02Å; F545-Y555 HydrophobicContact CB-CD2 4.04Å; F545-Y555 HydrophobicContact CB-CE2 4.04Å; F545-Y555 HydrophobicContact CD2-CD1 4Å; F545-Y555 AromaticContact CD2-CD2 3.97Å; F545-Y555 HydrophobicContact CD2-CD2 3.97Å; F545-Y555 HydrophobicContact CD2-CE1 4.47Å; F545-Y555 HydrophobicContact CD2-CE2 4.45Å; F545-Y555 AromaticContact CD2-CG 3.74Å; F545-Y555 HydrophobicContact CD2-CG 3.74Å; L553-Y555 PolarHBondContact O-N 3.35Å; Y555-L558 PolarHBondContact O-N 3.25Å; Y555-R559 VanDerWaalsContact O-CB 3.24Å; Y555-R559 WeakPolarHBondContact O-CB 3.4Å; Y555-R559 PolarHBondContact O-N 2.66Å; Y555-R559 PolarHBondContact OH-NH1 3.29Å
556	L	86.1	Confident	88.6	Confident	30 Å²	30	45.9 Å²	45.9	16%	0.157	23%	0.23	C	C	.	.	H	α-helix	trans	-68.6	-39.4	-175	-74.5	154.6	0	0	0	113	S554 T560 R765 M769	S554-L556 PolarHBondContact O-N 3.48Å; L556-T560 PolarHBondContact O-N 3.32Å; L556-T560 PolarHBondContact O-OG1 3.33Å; L556-R765 VanDerWaalsContact CD2-NH1 3.31Å; L556-M769 HydrophobicContact CB-CE 4.35Å; L556-M769 HydrophobicContact CB-SD 4.04Å; L556-M769 HydrophobicContact CD1-CE 3.88Å; L556-M769 HydrophobicContact CD2-CE 4.18Å; L556-M769 HydrophobicContact CG-CE 4.35Å
557	S	87.7	Confident	88.9	Confident	6 Å²	6	40.5 Å²	40.5	4%	0.042	21%	0.209	C	C	.	.	H	α-helix	trans	-69.7	-42.9	175.8	153.3	0	0	0	0	111.2	R559 T560 S561 P771 L772 N775	S557-R559 VanDerWaalsContact C-N 3.34Å; S557-R559 PolarHBondContact O-N 2.91Å; S557-T560 PolarHBondContact O-N 2.87Å; S557-S561 PolarHBondContact O-N 2.98Å; S557-S561 PolarHBondContact O-OG 3.19Å; S557-P771 PolarHBondContact OG-O 3.46Å; S557-L772 VanDerWaalsContact OG-C 3.31Å; S557-L772 PolarHBondContact OG-O 3.33Å; S557-N775 WeakPolarHBondContact CB-ND2 3.29Å; S557-N775 PolarHBondContact OG-ND2 2.69Å
558	L	88.3	Confident	89.3	Confident	9 Å²	9	41.7 Å²	41.7	5%	0.047	21%	0.214	C	C	.	.	H	α-helix	trans	-63.5	-41.3	176.9	-172	65.6	0	0	0	111.4	L544 F547 C548 L553 S554 Y555 T560 S561 I562 N775 A783	L544-L558 HydrophobicContact CD1-CD2 3.79Å; L544-L558 HydrophobicContact CD1-CG 4.33Å; F547-L558 HydrophobicContact CD1-CD2 4.32Å; F547-L558 HydrophobicContact CE1-CD2 4.39Å; C548-L558 WeakPolarHBondContact SG-CD2 3.36Å; L553-L558 HydrophobicContact CD1-CD2 4.37Å; S554-L558 PolarHBondContact O-N 3.16Å; Y555-L558 PolarHBondContact O-N 3.25Å; L558-T560 VanDerWaalsContact C-N 3.33Å; L558-T560 PolarHBondContact O-N 3.14Å; L558-S561 PolarHBondContact O-N 3.28Å; L558-I562 HydrophobicContact CG-CD1 4.06Å; L558-I562 VanDerWaalsContact O-CG1 3.31Å; L558-I562 WeakPolarHBondContact O-CG1 3.32Å; L558-I562 PolarHBondContact O-N 3.07Å; L558-N775 PolarHBondContact N-ND2 3.02Å; L558-A783 HydrophobicContact CD1-CB 4.32Å
559	R	89.8	Confident	89.6	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-56	-46.5	172.4	179.5	-162	177.9	82.2	32	111.5	E541 L544 Y555 S557 I562 G563 L837 W839	E541-R559 IonicContact OE1-CZ 3.05Å; E541-R559 IonicContact OE1-NH1 3.93Å; E541-R559 PolarHBondContact OE1-NH1 3.32Å; E541-R559 IonicContact OE1-NH2 3.28Å; E541-R559 PolarHBondContact OE1-NH2 2.99Å; E541-R559 IonicContact OE2-CZ 2.75Å; E541-R559 IonicContact OE2-NH1 2.83Å; E541-R559 PolarHBondContact OE2-NH1 3.22Å; L544-R559 HydrophobicContact CD2-CB 4.28Å; Y555-R559 VanDerWaalsContact O-CB 3.24Å; Y555-R559 WeakPolarHBondContact O-CB 3.4Å; Y555-R559 PolarHBondContact O-N 2.66Å; Y555-R559 PolarHBondContact OH-NH1 3.29Å; S557-R559 VanDerWaalsContact C-N 3.34Å; S557-R559 PolarHBondContact O-N 2.91Å; R559-I562 PolarHBondContact O-N 3.29Å; R559-G563 PolarHBondContact O-N 2.99Å; R559-L837 PolarHBondContact NE-O 3.45Å; R559-L837 PolarHBondContact NH2-O 3.32Å; R559-L837 VanDerWaalsContact NH2-O 3.14Å; R559-W839 HydrophobicContact CG-CZ2 3.93Å
560	T	89.4	Confident	89.8	Confident	1 Å²	1	36.9 Å²	36.9	1%	0.006	19%	0.194	C	C	.	.	H	α-helix	trans	-63	-43.9	179.6	-54.8	0	0	0	0	111	L556 S557 L558 G563 L564 P771 S833	L556-T560 PolarHBondContact O-N 3.32Å; L556-T560 PolarHBondContact O-OG1 3.33Å; S557-T560 PolarHBondContact O-N 2.87Å; L558-T560 VanDerWaalsContact C-N 3.33Å; L558-T560 PolarHBondContact O-N 3.14Å; T560-G563 PolarHBondContact O-N 3.3Å; T560-L564 WeakPolarHBondContact O-CG 3.48Å; T560-L564 PolarHBondContact O-N 2.96Å; T560-P771 HydrophobicContact CG2-CB 4.12Å; T560-S833 PolarHBondContact OG1-O 3.29Å
561	S	91.1	Very high	89.9	Confident	2 Å²	2	34.7 Å²	34.7	1%	0.014	18%	0.181	C	C	.	.	H	α-helix	trans	-62.2	-44.7	176.1	-71.1	0	0	0	0	112.9	S557 L558 G563 L564 W565 P771	S557-S561 PolarHBondContact O-N 2.98Å; S557-S561 PolarHBondContact O-OG 3.19Å; L558-S561 PolarHBondContact O-N 3.28Å; S561-G563 VanDerWaalsContact C-N 3.33Å; S561-L564 PolarHBondContact O-N 3.42Å; S561-W565 PolarHBondContact O-N 2.96Å; S561-P771 PolarHBondContact OG-O 2.9Å
562	I	92.1	Very high	90.2	Very high	1 Å²	1	30.7 Å²	30.7	1%	0.005	17%	0.171	C	C	.	.	H	α-helix	trans	-60.6	-45.7	173.7	-68.2	167.1	0	0	0	109.9	F540 L544 L558 R559 L564 W565 T566 A783 P786 A787 W839	F540-I562 HydrophobicContact CE1-CG2 4.49Å; F540-I562 HydrophobicContact CZ-CG2 4.25Å; L544-I562 HydrophobicContact CD1-CD1 3.43Å; L544-I562 VanDerWaalsContact CD1-CD1 3.43Å; L544-I562 HydrophobicContact CD2-CD1 3.8Å; L544-I562 HydrophobicContact CG-CD1 4.28Å; L558-I562 HydrophobicContact CG-CD1 4.06Å; L558-I562 VanDerWaalsContact O-CG1 3.31Å; L558-I562 WeakPolarHBondContact O-CG1 3.32Å; L558-I562 PolarHBondContact O-N 3.07Å; R559-I562 PolarHBondContact O-N 3.29Å; I562-L564 PolarHBondContact O-N 2.91Å; I562-W565 PolarHBondContact O-N 3.47Å; I562-T566 HydrophobicContact CG2-CG2 4.25Å; I562-T566 VanDerWaalsContact O-CG2 3.31Å; I562-T566 WeakPolarHBondContact O-CG2 3.46Å; I562-T566 PolarHBondContact O-N 2.79Å; I562-T566 PolarHBondContact O-OG1 3.47Å; I562-A783 HydrophobicContact CG1-CB 3.8Å; I562-P786 HydrophobicContact CD1-CB 4.03Å; I562-P786 HydrophobicContact CD1-CG 4.48Å; I562-P786 HydrophobicContact CG1-CB 4.36Å; I562-A787 HydrophobicContact CG2-CB 4.13Å; I562-W839 HydrophobicContact CB-CH2 4.49Å; I562-W839 HydrophobicContact CG2-CH2 3.86Å; I562-W839 HydrophobicContact CG2-CZ2 4.49Å
563	G	92.2	Very high	90.4	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-55.3	-50.6	176.7	0	0	0	0	0	112.7	R559 T560 S561 W565 T566 V567 S833	R559-G563 PolarHBondContact O-N 2.99Å; T560-G563 PolarHBondContact O-N 3.3Å; S561-G563 VanDerWaalsContact C-N 3.33Å; G563-W565 VanDerWaalsContact C-N 3.35Å; G563-W565 PolarHBondContact O-N 3.19Å; G563-T566 WeakPolarHBondContact CA-OG1 3.44Å; G563-T566 PolarHBondContact O-N 3.2Å; G563-T566 VanDerWaalsContact O-N 3.11Å; G563-T566 PolarHBondContact O-OG1 3.14Å; G563-V567 WeakPolarHBondContact O-CG2 3.45Å; G563-V567 PolarHBondContact O-N 3.42Å; G563-S833 WeakPolarHBondContact CA-OG 3.46Å
564	L	91.5	Very high	90.6	Very high	69 Å²	69	28.4 Å²	28.4	36%	0.361	14%	0.142	S	C	.	.	H	α-helix	trans	-61	-41.2	178.9	-69.3	175.2	0	0	0	112.7	T560 S561 I562 V567 F568 P771 I834	T560-L564 WeakPolarHBondContact O-CG 3.48Å; T560-L564 PolarHBondContact O-N 2.96Å; S561-L564 PolarHBondContact O-N 3.42Å; I562-L564 PolarHBondContact O-N 2.91Å; L564-V567 PolarHBondContact O-N 3.03Å; L564-F568 PolarHBondContact O-N 3.29Å; L564-F568 VanDerWaalsContact O-N 3.07Å; L564-P771 HydrophobicContact CD1-CB 3.92Å; L564-I834 HydrophobicContact CD2-CD1 4.36Å; L564-I834 HydrophobicContact CD2-CG1 4.36Å
565	W	94.2	Very high	90.6	Very high	77 Å²	77	27.7 Å²	27.7	29%	0.292	14%	0.138	S	C	.	.	H	α-helix	trans	-64	-40.8	173	-83.7	113.7	0	0	0	112.5	S561 I562 G563 V567 F568 L569 L780 A784 A787	S561-W565 PolarHBondContact O-N 2.96Å; I562-W565 PolarHBondContact O-N 3.47Å; G563-W565 VanDerWaalsContact C-N 3.35Å; G563-W565 PolarHBondContact O-N 3.19Å; W565-V567 VanDerWaalsContact C-N 3.33Å; W565-V567 PolarHBondContact O-N 3.07Å; W565-F568 AromaticContact CE3-CD1 3.97Å; W565-F568 HydrophobicContact CE3-CD1 3.97Å; W565-F568 AromaticContact CZ3-CD1 3.94Å; W565-F568 HydrophobicContact CZ3-CD1 3.94Å; W565-F568 HydrophobicContact CZ3-CE1 4.18Å; W565-F568 PolarHBondContact O-N 3.33Å; W565-L569 WeakPolarHBondContact O-CG 3.45Å; W565-L569 PolarHBondContact O-N 3.43Å; W565-L780 PolarHBondContact NE1-O 2.97Å; W565-A784 HydrophobicContact CD2-CB 4.31Å; W565-A787 HydrophobicContact CB-CB 3.43Å; W565-A787 VanDerWaalsContact CB-CB 3.43Å; W565-A787 HydrophobicContact CG-CB 4.47Å
566	T	92.7	Very high	90.6	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-63.3	-38.7	176.6	57.4	0	0	0	0	112.2	I562 G563 L569 C570 A787 C790 L829	I562-T566 HydrophobicContact CG2-CG2 4.25Å; I562-T566 VanDerWaalsContact O-CG2 3.31Å; I562-T566 WeakPolarHBondContact O-CG2 3.46Å; I562-T566 PolarHBondContact O-N 2.79Å; I562-T566 PolarHBondContact O-OG1 3.47Å; G563-T566 WeakPolarHBondContact CA-OG1 3.44Å; G563-T566 PolarHBondContact O-N 3.2Å; G563-T566 VanDerWaalsContact O-N 3.11Å; G563-T566 PolarHBondContact O-OG1 3.14Å; T566-L569 PolarHBondContact O-N 3.45Å; T566-C570 WeakPolarHBondContact O-CB 3.27Å; T566-C570 PolarHBondContact O-N 2.69Å; T566-C570 PolarHBondContact O-SG 2.67Å; T566-A787 HydrophobicContact CG2-CB 3.77Å; T566-A787 WeakPolarHBondContact CG2-O 3.38Å; T566-C790 HydrophobicContact CG2-CB 3.7Å; T566-L829 WeakPolarHBondContact OG1-CD2 3.42Å
567	V	94.3	Very high	90.3	Very high	22 Å²	22	29.1 Å²	29.1	13%	0.133	15%	0.149	C	C	.	.	H	α-helix	trans	-62.2	-47	174.5	175.8	0	0	0	0	110.7	G563 L564 W565 L569 C570 I571 A826 L829 G830	G563-V567 WeakPolarHBondContact O-CG2 3.45Å; G563-V567 PolarHBondContact O-N 3.42Å; L564-V567 PolarHBondContact O-N 3.03Å; W565-V567 VanDerWaalsContact C-N 3.33Å; W565-V567 PolarHBondContact O-N 3.07Å; V567-L569 PolarHBondContact O-N 2.94Å; V567-C570 PolarHBondContact O-N 2.82Å; V567-I571 HydrophobicContact CG1-CD1 3.81Å; V567-I571 HydrophobicContact CG1-CG1 4.43Å; V567-I571 WeakPolarHBondContact O-CG1 3.47Å; V567-I571 PolarHBondContact O-N 3.42Å; V567-A826 WeakPolarHBondContact CG2-O 3.35Å; V567-L829 HydrophobicContact CG2-CD2 3.73Å; V567-G830 VanDerWaalsContact CG2-CA 3.41Å
568	F	93.9	Very high	89.8	Confident	113 Å²	113	29.4 Å²	29.4	50%	0.496	15%	0.152	S	C	.	.	H	α-helix	trans	-58.4	-47.8	178	173.9	-100.9	0	0	0	111.8	L564 W565 I571 L572	L564-F568 PolarHBondContact O-N 3.29Å; L564-F568 VanDerWaalsContact O-N 3.07Å; W565-F568 AromaticContact CE3-CD1 3.97Å; W565-F568 HydrophobicContact CE3-CD1 3.97Å; W565-F568 AromaticContact CZ3-CD1 3.94Å; W565-F568 HydrophobicContact CZ3-CD1 3.94Å; W565-F568 HydrophobicContact CZ3-CE1 4.18Å; W565-F568 PolarHBondContact O-N 3.33Å; F568-I571 PolarHBondContact O-N 3.34Å; F568-L572 PolarHBondContact O-N 3.14Å
569	L	92.9	Very high	89.1	Confident	34 Å²	34	29 Å²	29	18%	0.178	15%	0.15	C	C	.	.	H	α-helix	trans	-66.3	-38.5	178.2	-65.3	175.5	0	0	0	112.2	W565 T566 V567 L572 L573 L788 T791	W565-L569 WeakPolarHBondContact O-CG 3.45Å; W565-L569 PolarHBondContact O-N 3.43Å; T566-L569 PolarHBondContact O-N 3.45Å; V567-L569 PolarHBondContact O-N 2.94Å; L569-L572 WeakPolarHBondContact O-CB 3.22Å; L569-L572 PolarHBondContact O-N 2.82Å; L569-L573 WeakPolarHBondContact O-CG 3.45Å; L569-L573 PolarHBondContact O-N 3.01Å; L569-L788 HydrophobicContact CD1-CB 4.41Å; L569-L788 HydrophobicContact CD1-CD1 4.18Å; L569-T791 HydrophobicContact CB-CG2 3.85Å
570	C	91.6	Very high	88	Confident	1 Å²	1	30.3 Å²	30.3	1%	0.007	16%	0.159	C	C	.	.	H	α-helix	trans	-63.4	-43	175	-71.9	0	0	0	0	112.1	T566 V567 L572 L573 V574 A826	T566-C570 WeakPolarHBondContact O-CB 3.27Å; T566-C570 PolarHBondContact O-N 2.69Å; T566-C570 PolarHBondContact O-SG 2.67Å; V567-C570 PolarHBondContact O-N 2.82Å; C570-L572 VanDerWaalsContact C-N 3.27Å; C570-L572 PolarHBondContact O-N 3.31Å; C570-L573 PolarHBondContact O-N 3.2Å; C570-V574 WeakPolarHBondContact O-CG2 3.38Å; C570-V574 PolarHBondContact O-N 3.44Å; C570-A826 HydrophobicContact CB-CB 3.55Å
571	I	91.3	Very high	87.2	Confident	62 Å²	62	34.8 Å²	34.8	32%	0.318	18%	0.182	S	C	.	.	H	α-helix	trans	-62.6	-38.8	175.5	-69	169.9	0	0	0	110.3	F448 V567 F568 V574 A575 L823	F448-I571 HydrophobicContact CZ-CG2 4.34Å; V567-I571 HydrophobicContact CG1-CD1 3.81Å; V567-I571 HydrophobicContact CG1-CG1 4.43Å; V567-I571 WeakPolarHBondContact O-CG1 3.47Å; V567-I571 PolarHBondContact O-N 3.42Å; F568-I571 PolarHBondContact O-N 3.34Å; I571-V574 PolarHBondContact O-N 3.11Å; I571-A575 WeakPolarHBondContact O-CB 3.4Å; I571-A575 PolarHBondContact O-N 3.46Å; I571-L823 HydrophobicContact CG1-CD1 4.44Å
572	L	91.8	Very high	86.4	Confident	80 Å²	80	35 Å²	35	42%	0.419	18%	0.184	S	C	.	.	H	α-helix	trans	-63.4	-40.1	174.7	-173.4	146.9	0	0	0	112.1	F568 L569 C570 A575 T576	F568-L572 PolarHBondContact O-N 3.14Å; L569-L572 WeakPolarHBondContact O-CB 3.22Å; L569-L572 PolarHBondContact O-N 2.82Å; C570-L572 VanDerWaalsContact C-N 3.27Å; C570-L572 PolarHBondContact O-N 3.31Å; L572-A575 PolarHBondContact O-N 3.43Å; L572-T576 HydrophobicContact CD2-CG2 4.2Å; L572-T576 WeakPolarHBondContact O-CB 3.47Å; L572-T576 WeakPolarHBondContact O-CG2 3.42Å; L572-T576 PolarHBondContact O-N 3.42Å; L572-T576 PolarHBondContact O-OG1 3.04Å
573	L	89.1	Confident	85.2	Confident	46 Å²	46	37.6 Å²	37.6	24%	0.241	20%	0.201	C	C	.	.	H	α-helix	trans	-63.9	-40.2	173.9	-70	177.7	0	0	0	112.4	L569 C570 T576 D577 A578 T791 F795 L822	L569-L573 WeakPolarHBondContact O-CG 3.45Å; L569-L573 PolarHBondContact O-N 3.01Å; C570-L573 PolarHBondContact O-N 3.2Å; L573-T576 WeakPolarHBondContact CA-OG1 3.32Å; L573-T576 PolarHBondContact O-OG1 2.87Å; L573-D577 PolarHBondContact O-N 3.36Å; L573-A578 HydrophobicContact CB-CB 4.02Å; L573-A578 HydrophobicContact CD2-CB 3.79Å; L573-A578 HydrophobicContact CG-CB 4.49Å; L573-A578 VanDerWaalsContact O-CB 3.3Å; L573-A578 WeakPolarHBondContact O-CB 3.45Å; L573-A578 PolarHBondContact O-N 3.24Å; L573-T791 HydrophobicContact CD1-CG2 3.73Å; L573-F795 HydrophobicContact CD1-CB 4.38Å; L573-F795 HydrophobicContact CD1-CD2 3.95Å; L573-F795 HydrophobicContact CD1-CG 4.24Å; L573-L822 HydrophobicContact CB-CD2 4.45Å
574	V	88.9	Confident	84.3	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-64.6	-42.4	173.7	174.4	0	0	0	0	110.9	F448 L451 C570 I571 T576 D577 H819 L822 L823	F448-V574 HydrophobicContact CD1-CG1 4.35Å; F448-V574 HydrophobicContact CE1-CG1 4.37Å; L451-V574 HydrophobicContact CB-CG1 4.5Å; C570-V574 WeakPolarHBondContact O-CG2 3.38Å; C570-V574 PolarHBondContact O-N 3.44Å; I571-V574 PolarHBondContact O-N 3.11Å; V574-T576 VanDerWaalsContact C-N 3.33Å; V574-T576 PolarHBondContact O-N 3.46Å; V574-D577 PolarHBondContact O-N 3.3Å; V574-H819 HydrophobicContact CG1-CB 4.47Å; V574-L822 HydrophobicContact CG2-CB 4.05Å; V574-L822 HydrophobicContact CG2-CD2 3.68Å; V574-L822 HydrophobicContact CG2-CG 3.79Å; V574-L823 HydrophobicContact CG1-CB 4.5Å; V574-L823 HydrophobicContact CG2-CB 4.35Å
575	A	87.9	Confident	83.6	Confident	18 Å²	18	42.6 Å²	42.6	15%	0.149	22%	0.218	C	C	.	.	H	α-helix	trans	-68.6	-30.3	-178.8	0	0	0	0	0	113.2	I447 F448 I571 L572 D577	I447-A575 HydrophobicContact CG2-CB 4.02Å; F448-A575 HydrophobicContact CE1-CB 4.16Å; F448-A575 HydrophobicContact CE2-CB 4.19Å; F448-A575 HydrophobicContact CZ-CB 3.94Å; I571-A575 WeakPolarHBondContact O-CB 3.4Å; I571-A575 PolarHBondContact O-N 3.46Å; L572-A575 PolarHBondContact O-N 3.43Å; A575-D577 VanDerWaalsContact C-N 3.32Å
576	T	86.4	Confident	82.8	Confident	65 Å²	65	40.8 Å²	40.8	40%	0.399	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.9	6.1	-179.8	51.3	0	0	0	0	113.9	L572 L573 V574 A578	L572-T576 HydrophobicContact CD2-CG2 4.2Å; L572-T576 WeakPolarHBondContact O-CB 3.47Å; L572-T576 WeakPolarHBondContact O-CG2 3.42Å; L572-T576 PolarHBondContact O-N 3.42Å; L572-T576 PolarHBondContact O-OG1 3.04Å; L573-T576 WeakPolarHBondContact CA-OG1 3.32Å; L573-T576 PolarHBondContact O-OG1 2.87Å; V574-T576 VanDerWaalsContact C-N 3.33Å; V574-T576 PolarHBondContact O-N 3.46Å; T576-A578 VanDerWaalsContact C-N 3.26Å; T576-A578 PolarHBondContact O-N 2.97Å
577	D	80.3	Confident	82.2	Confident	6 Å²	6	41.7 Å²	41.7	3%	0.032	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	53.2	39.5	-173.7	-72.6	-13.7	0	0	0	112.2	R443 T444 G450 L573 V574 A575 S579 S580 H819	R443-D577 HydrophobicContact CG-CB 4.49Å; T444-D577 PolarHBondContact N-OD2 3.08Å; T444-D577 PolarHBondContact OG1-OD2 3.25Å; G450-D577 PolarHBondContact N-OD1 3Å; L573-D577 PolarHBondContact O-N 3.36Å; V574-D577 PolarHBondContact O-N 3.3Å; A575-D577 VanDerWaalsContact C-N 3.32Å; D577-S579 PolarHBondContact O-N 3.02Å; D577-S579 VanDerWaalsContact O-N 3.07Å; D577-S580 PolarHBondContact O-N 3.01Å; D577-S580 VanDerWaalsContact O-N 3.13Å; D577-S580 PolarHBondContact O-OG 3.35Å; D577-H819 IonicContact OD1-NE2 3.01Å
578	A	77.2	Confident	81.7	Confident	11 Å²	11	40.7 Å²	40.7	9%	0.091	21%	0.213	C	C	.	.	G	3₁₀ helix	trans	-62.6	-16.7	-177.8	0	0	0	0	0	113.6	L573 T576 S580 L581 F795	L573-A578 HydrophobicContact CB-CB 4.02Å; L573-A578 HydrophobicContact CD2-CB 3.79Å; L573-A578 HydrophobicContact CG-CB 4.49Å; L573-A578 VanDerWaalsContact O-CB 3.3Å; L573-A578 WeakPolarHBondContact O-CB 3.45Å; L573-A578 PolarHBondContact O-N 3.24Å; T576-A578 VanDerWaalsContact C-N 3.26Å; T576-A578 PolarHBondContact O-N 2.97Å; A578-S580 PolarHBondContact O-N 3.48Å; A578-S580 VanDerWaalsContact O-N 3.12Å; A578-L581 VanDerWaalsContact O-CB 3.29Å; A578-L581 WeakPolarHBondContact O-CB 3.23Å; A578-L581 WeakPolarHBondContact O-CG 3.3Å; A578-L581 PolarHBondContact O-N 3.38Å; A578-F795 HydrophobicContact CB-CE2 4.39Å; A578-F795 HydrophobicContact CB-CZ 4.47Å
579	S	71.9	Confident	81.1	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	19%	0.19	C	C	.	.	G	3₁₀ helix	trans	-63.8	-12.7	174.7	-33.7	0	0	0	0	113	L441 D577 L581 V582 H819	L441-S579 WeakPolarHBondContact CD2-O 3.24Å; D577-S579 PolarHBondContact O-N 3.02Å; D577-S579 VanDerWaalsContact O-N 3.07Å; S579-L581 PolarHBondContact O-N 3.01Å; S579-V582 WeakPolarHBondContact O-CB 3.45Å; S579-V582 WeakPolarHBondContact O-CG2 3.39Å; S579-V582 PolarHBondContact O-N 3.3Å; S579-V582 VanDerWaalsContact O-N 3.13Å; S579-H819 VanDerWaalsContact CB-CE1 3.49Å; S579-H819 WeakPolarHBondContact CB-CE1 3.33Å; S579-H819 VanDerWaalsContact CB-NE2 3.29Å; S579-H819 WeakPolarHBondContact CB-NE2 3.4Å; S579-H819 PolarHBondContact OG-CD2 3.03Å; S579-H819 PolarHBondContact OG-CE1 2.95Å; S579-H819 PolarHBondContact OG-NE2 3.36Å
580	S	68.2	Low	80.5	Confident	29 Å²	29	34.2 Å²	34.2	20%	0.203	18%	0.183	C	C	.	.	G	3₁₀ helix	trans	-63	-22.5	169.3	72.1	0	0	0	0	112.7	D577 A578 V582 C583	D577-S580 PolarHBondContact O-N 3.01Å; D577-S580 VanDerWaalsContact O-N 3.13Å; D577-S580 PolarHBondContact O-OG 3.35Å; A578-S580 PolarHBondContact O-N 3.48Å; A578-S580 VanDerWaalsContact O-N 3.12Å; S580-V582 PolarHBondContact O-N 2.93Å; S580-C583 WeakPolarHBondContact O-CB 3.45Å; S580-C583 PolarHBondContact O-N 2.9Å
581	L	72.1	Confident	80.2	Confident	94 Å²	94	34.3 Å²	34.3	49%	0.492	18%	0.184	S	C	.	.	G	3₁₀ helix	trans	-64.8	-20.7	175.2	-67.7	171.4	0	0	0	112.6	A578 S579 C583 Y584	A578-L581 VanDerWaalsContact O-CB 3.29Å; A578-L581 WeakPolarHBondContact O-CB 3.23Å; A578-L581 WeakPolarHBondContact O-CG 3.3Å; A578-L581 PolarHBondContact O-N 3.38Å; S579-L581 PolarHBondContact O-N 3.01Å; L581-C583 PolarHBondContact O-N 3.14Å; L581-Y584 HydrophobicContact CD2-CD2 4.1Å; L581-Y584 HydrophobicContact CD2-CE2 4.13Å; L581-Y584 WeakPolarHBondContact O-CB 3.26Å; L581-Y584 PolarHBondContact O-N 3.41Å
582	V	72.9	Confident	79.9	Confident	7 Å²	7	31.4 Å²	31.4	4%	0.042	17%	0.169	C	C	.	.	G	3₁₀ helix	trans	-63	-26.5	177.8	-178.6	0	0	0	0	111.6	L441 S579 S580 Y584 I585 Q799 V803	L441-V582 HydrophobicContact CD2-CB 4.14Å; S579-V582 WeakPolarHBondContact O-CB 3.45Å; S579-V582 WeakPolarHBondContact O-CG2 3.39Å; S579-V582 PolarHBondContact O-N 3.3Å; S579-V582 VanDerWaalsContact O-N 3.13Å; S580-V582 PolarHBondContact O-N 2.93Å; V582-Y584 PolarHBondContact O-N 3.18Å; V582-Y584 VanDerWaalsContact O-N 3.17Å; V582-I585 HydrophobicContact CG1-CD1 4.46Å; V582-I585 WeakPolarHBondContact O-CB 3.32Å; V582-I585 PolarHBondContact O-N 3.27Å; V582-Q799 HydrophobicContact CG2-CB 3.8Å; V582-Q799 HydrophobicContact CG2-CG 3.86Å; V582-V803 HydrophobicContact CG1-CG2 3.09Å
583	C	68.3	Low	79.5	Confident	56 Å²	56	27.7 Å²	27.7	38%	0.378	15%	0.149	S	C	.	.	G	3₁₀ helix	trans	-60.4	-22.8	172.8	-68	0	0	0	0	114	A437 L441 S580 L581 I585	A437-C583 WeakPolarHBondContact CB-SG 3.44Å; L441-C583 WeakPolarHBondContact CB-SG 2.99Å; S580-C583 WeakPolarHBondContact O-CB 3.45Å; S580-C583 PolarHBondContact O-N 2.9Å; L581-C583 PolarHBondContact O-N 3.14Å; C583-I585 VanDerWaalsContact C-N 3.35Å
584	Y	73.1	Confident	79.2	Confident	150 Å²	150	25.9 Å²	25.9	59%	0.588	14%	0.141	S	C	*	.	G	3₁₀ helix	trans	-83.9	-12.5	177.7	-63.3	-64.2	0	0	0	113	L581 V582 T586 V983	L581-Y584 HydrophobicContact CD2-CD2 4.1Å; L581-Y584 HydrophobicContact CD2-CE2 4.13Å; L581-Y584 WeakPolarHBondContact O-CB 3.26Å; L581-Y584 PolarHBondContact O-N 3.41Å; V582-Y584 PolarHBondContact O-N 3.18Å; V582-Y584 VanDerWaalsContact O-N 3.17Å; Y584-T586 PolarHBondContact O-N 3.05Å; Y584-V983 WeakPolarHBondContact O-CG1 3.19Å
585	I	76.3	Confident	79	Confident	24 Å²	24	26 Å²	26	12%	0.123	14%	0.142	C	C	.	.			trans	-75.8	107.3	174	-58.1	177.6	0	0	0	107.2	V582 C583 T589 I800	V582-I585 HydrophobicContact CG1-CD1 4.46Å; V582-I585 WeakPolarHBondContact O-CB 3.32Å; V582-I585 PolarHBondContact O-N 3.27Å; C583-I585 VanDerWaalsContact C-N 3.35Å; I585-T589 WeakPolarHBondContact CG2-OG1 3.38Å; I585-I800 HydrophobicContact CD1-CG1 3.99Å
586	T	78.3	Confident	79	Confident	38 Å²	38	25.1 Å²	25.1	23%	0.233	14%	0.135	C	C	.	.			trans	-91.2	166.1	175.9	69.1	0	0	0	0	110.8	Y584 F588 T589 E590 R986	Y584-T586 PolarHBondContact O-N 3.05Å; T586-F588 PolarHBondContact O-N 2.74Å; T586-T589 PolarHBondContact N-OG1 3.44Å; T586-T589 PolarHBondContact O-N 3.09Å; T586-T589 PolarHBondContact O-OG1 3.28Å; T586-E590 PolarHBondContact O-N 3.21Å; T586-R986 HydrophobicContact CG2-CG 4.42Å; T586-R986 WeakPolarHBondContact OG1-CG 3.34Å
587	R	78.3	Confident	78.9	Confident	19 Å²	19	23.1 Å²	23.1	7%	0.072	12%	0.121	C	C	.	.	H	α-helix	trans	-53.3	-36.6	176.6	-172.5	177	-179.6	151.4	9.3	113.4	T589 E590 E591 E809 Q920 D1002	R587-T589 PolarHBondContact O-N 2.84Å; R587-E590 PolarHBondContact O-N 2.89Å; R587-E591 HydrophobicContact CG-CG 3.91Å; R587-E591 IonicContact CZ-OE1 2.69Å; R587-E591 VanDerWaalsContact CZ-OE1 3.25Å; R587-E591 IonicContact NE-OE1 3.77Å; R587-E591 PolarHBondContact NE-OE1 2.97Å; R587-E591 IonicContact NH2-OE1 3.95Å; R587-E591 PolarHBondContact NH2-OE1 2.87Å; R587-E591 WeakPolarHBondContact O-CB 3.44Å; R587-E591 WeakPolarHBondContact O-CG 3.31Å; R587-E591 PolarHBondContact O-N 3.43Å; R587-E809 IonicContact CZ-OE1 2.84Å; R587-E809 IonicContact NH1-OE1 2.81Å; R587-E809 PolarHBondContact NH1-OE1 3.41Å; R587-E809 IonicContact NH2-OE1 4Å; R587-Q920 VanDerWaalsContact CZ-NE2 3.32Å; R587-Q920 VanDerWaalsContact NH2-OE1 3.1Å; R587-D1002 WeakPolarHBondContact CB-O 3.28Å
588	F	84.1	Confident	79.1	Confident	1 Å²	1	22.9 Å²	22.9	0%	0.004	12%	0.12	C	C	.	.	H	α-helix	trans	-52.3	-51.8	173.5	177	-97.9	0	0	0	112.5	T586 A592 F952 Q956 R986 L989 D1002	T586-F588 PolarHBondContact O-N 2.74Å; F588-A592 VanDerWaalsContact O-CB 3.24Å; F588-A592 WeakPolarHBondContact O-CB 3.44Å; F588-A592 PolarHBondContact O-N 3.37Å; F588-A592 VanDerWaalsContact O-N 3.11Å; F588-F952 HydrophobicContact CB-CZ 4.29Å; F588-F952 AromaticContact CD2-CE1 3.68Å; F588-F952 HydrophobicContact CD2-CE1 3.68Å; F588-F952 HydrophobicContact CD2-CE2 4.04Å; F588-F952 AromaticContact CD2-CZ 3.35Å; F588-F952 HydrophobicContact CD2-CZ 3.35Å; F588-F952 HydrophobicContact CE2-CE1 4.16Å; F588-F952 HydrophobicContact CE2-CE2 4.43Å; F588-F952 HydrophobicContact CE2-CZ 4.02Å; F588-F952 HydrophobicContact CG-CZ 4.23Å; F588-Q956 HydrophobicContact CD2-CB 4.18Å; F588-Q956 HydrophobicContact CD2-CG 3.91Å; F588-Q956 HydrophobicContact CE2-CB 3.44Å; F588-Q956 VanDerWaalsContact CE2-CB 3.44Å; F588-Q956 HydrophobicContact CE2-CG 3.55Å; F588-Q956 HydrophobicContact CZ-CB 3.99Å; F588-Q956 HydrophobicContact CZ-CG 4.01Å; F588-Q956 PolarHBondContact O-NE2 3.45Å; F588-R986 HydrophobicContact CB-CG 4.36Å; F588-R986 HydrophobicContact CD1-CB 3.91Å; F588-R986 HydrophobicContact CD1-CG 4.21Å; F588-R986 HydrophobicContact CE1-CB 4.34Å; F588-L989 HydrophobicContact CE2-CD1 4.14Å; F588-L989 HydrophobicContact CZ-CD1 4.1Å; F588-D1002 WeakPolarHBondContact CB-OD1 3.23Å; F588-D1002 PolarHBondContact N-OD1 2.82Å
589	T	82.5	Confident	79.6	Confident	4 Å²	4	25.4 Å²	25.4	3%	0.025	13%	0.131	C	C	.	.	H	α-helix	trans	-71.1	-39	-177.8	55.6	0	0	0	0	111.8	I585 T586 R587 F593 L982 V983 R986	I585-T589 WeakPolarHBondContact CG2-OG1 3.38Å; T586-T589 PolarHBondContact N-OG1 3.44Å; T586-T589 PolarHBondContact O-N 3.09Å; T586-T589 PolarHBondContact O-OG1 3.28Å; R587-T589 PolarHBondContact O-N 2.84Å; T589-F593 WeakPolarHBondContact O-CB 3.43Å; T589-F593 PolarHBondContact O-N 2.98Å; T589-L982 HydrophobicContact CG2-CB 3.89Å; T589-V983 HydrophobicContact CG2-CG2 3.97Å; T589-R986 HydrophobicContact CG2-CB 4.37Å
590	E	79.9	Confident	80.2	Confident	7 Å²	7	26.2 Å²	26.2	3%	0.033	14%	0.136	C	C	.	.	H	α-helix	trans	-64.2	-50.9	178.4	-172.9	-164.5	145.3	0	0	111.9	T586 R587 F593 A594 I804	T586-E590 PolarHBondContact O-N 3.21Å; R587-E590 PolarHBondContact O-N 2.89Å; E590-F593 PolarHBondContact O-N 2.95Å; E590-A594 WeakPolarHBondContact O-CB 3.32Å; E590-A594 PolarHBondContact O-N 3.3Å; E590-I804 HydrophobicContact CG-CD1 4.15Å; E590-I804 HydrophobicContact CG-CG1 3.36Å; E590-I804 WeakPolarHBondContact OE1-CA 3.33Å; E590-I804 WeakPolarHBondContact OE1-CG1 3.24Å
591	E	84.4	Confident	80.9	Confident	4 Å²	4	26.5 Å²	26.5	2%	0.019	13%	0.133	C	C	.	.	H	α-helix	trans	-68.5	-35.9	-179.2	-71.5	-167.4	166.2	0	0	112.1	R587 A595 I919 Q920 F921	R587-E591 HydrophobicContact CG-CG 3.91Å; R587-E591 IonicContact CZ-OE1 2.69Å; R587-E591 VanDerWaalsContact CZ-OE1 3.25Å; R587-E591 IonicContact NE-OE1 3.77Å; R587-E591 PolarHBondContact NE-OE1 2.97Å; R587-E591 IonicContact NH2-OE1 3.95Å; R587-E591 PolarHBondContact NH2-OE1 2.87Å; R587-E591 WeakPolarHBondContact O-CB 3.44Å; R587-E591 WeakPolarHBondContact O-CG 3.31Å; R587-E591 PolarHBondContact O-N 3.43Å; E591-A595 WeakPolarHBondContact O-CB 3.43Å; E591-A595 PolarHBondContact O-N 3.31Å; E591-I919 HydrophobicContact CB-CG2 3.72Å; E591-I919 HydrophobicContact CG-CG2 3.88Å; E591-Q920 WeakPolarHBondContact OE1-CB 3.33Å; E591-Q920 PolarHBondContact OE1-N 2.83Å; E591-Q920 WeakPolarHBondContact OE2-CB 3.2Å; E591-F921 HydrophobicContact CB-CB 4.17Å; E591-F921 PolarHBondContact OE2-N 3.47Å
592	A	85.3	Confident	81.7	Confident	0 Å²	0	23.6 Å²	23.6	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-62.9	-43.8	173.3	0	0	0	0	0	111.3	F588 L596 Q956	F588-A592 VanDerWaalsContact O-CB 3.24Å; F588-A592 WeakPolarHBondContact O-CB 3.44Å; F588-A592 PolarHBondContact O-N 3.37Å; F588-A592 VanDerWaalsContact O-N 3.11Å; A592-L596 WeakPolarHBondContact O-CB 3.47Å; A592-L596 PolarHBondContact O-N 3.47Å; A592-Q956 HydrophobicContact CB-CG 4.12Å
593	F	83.7	Confident	82.4	Confident	2 Å²	2	28 Å²	28	1%	0.009	14%	0.135	C	C	.	.	H	α-helix	trans	-66.2	-46.9	177.1	-176.1	-102	0	0	0	112	T589 E590 A595 L596 I597 I800 T844 F975 V979	T589-F593 WeakPolarHBondContact O-CB 3.43Å; T589-F593 PolarHBondContact O-N 2.98Å; E590-F593 PolarHBondContact O-N 2.95Å; F593-A595 VanDerWaalsContact C-N 3.33Å; F593-A595 PolarHBondContact O-N 2.82Å; F593-L596 WeakPolarHBondContact O-CB 3.36Å; F593-L596 PolarHBondContact O-N 3.42Å; F593-I597 HydrophobicContact CD1-CG1 4.29Å; F593-I597 HydrophobicContact CE1-CG1 3.99Å; F593-I597 HydrophobicContact CE2-CD1 4.31Å; F593-I597 HydrophobicContact CE2-CG1 4.41Å; F593-I597 HydrophobicContact CZ-CD1 4.08Å; F593-I597 HydrophobicContact CZ-CG1 4.05Å; F593-I597 WeakPolarHBondContact O-CG1 3.33Å; F593-I597 PolarHBondContact O-N 3.39Å; F593-I800 HydrophobicContact CB-CG2 4.48Å; F593-I800 HydrophobicContact CD1-CB 4.36Å; F593-I800 HydrophobicContact CD1-CD1 4.4Å; F593-I800 HydrophobicContact CD1-CG2 3.4Å; F593-I800 VanDerWaalsContact CD1-CG2 3.4Å; F593-I800 HydrophobicContact CD2-CD1 4.47Å; F593-I800 HydrophobicContact CE1-CB 4.33Å; F593-I800 HydrophobicContact CE1-CD1 4.43Å; F593-I800 HydrophobicContact CE1-CG2 3.8Å; F593-I800 HydrophobicContact CG-CD1 4.4Å; F593-I800 HydrophobicContact CG-CG2 4.12Å; F593-I800 HydrophobicContact CZ-CD1 4.49Å; F593-T844 HydrophobicContact CD1-CG2 4.4Å; F593-T844 HydrophobicContact CE1-CG2 3.83Å; F593-F975 HydrophobicContact CD2-CZ 4.4Å; F593-F975 AromaticContact CE2-CE1 3.79Å; F593-F975 HydrophobicContact CE2-CE1 3.79Å; F593-F975 AromaticContact CE2-CZ 3.86Å; F593-F975 HydrophobicContact CE2-CZ 3.86Å; F593-V979 HydrophobicContact CD2-CG2 4.09Å; F593-V979 HydrophobicContact CE2-CG2 4.23Å
594	A	82.5	Confident	83	Confident	8 Å²	8	27 Å²	27	7%	0.066	12%	0.124	C	C	.	.	H	α-helix	trans	-59.5	-43.9	177.1	0	0	0	0	0	111.6	E590 I597 C598 I804 I919	E590-A594 WeakPolarHBondContact O-CB 3.32Å; E590-A594 PolarHBondContact O-N 3.3Å; A594-I597 PolarHBondContact O-N 3.32Å; A594-C598 PolarHBondContact O-N 3.01Å; A594-C598 PolarHBondContact O-SG 3.11Å; A594-I804 HydrophobicContact CB-CD1 4.34Å; A594-I919 HydrophobicContact CB-CD1 3.99Å
595	A	86.3	Confident	83.6	Confident	2 Å²	2	19.9 Å²	19.9	2%	0.017	10%	0.097	C	C	.	.	H	α-helix	trans	-63.4	-43	176	0	0	0	0	0	112	E591 F593 C598 I599 I919 F921 L960	E591-A595 WeakPolarHBondContact O-CB 3.43Å; E591-A595 PolarHBondContact O-N 3.31Å; F593-A595 VanDerWaalsContact C-N 3.33Å; F593-A595 PolarHBondContact O-N 2.82Å; A595-C598 PolarHBondContact O-N 2.72Å; A595-I599 VanDerWaalsContact O-CG1 3.27Å; A595-I599 WeakPolarHBondContact O-CG1 3.38Å; A595-I599 PolarHBondContact O-N 3.29Å; A595-I919 HydrophobicContact CB-CD1 4.36Å; A595-F921 HydrophobicContact CB-CD1 3.75Å; A595-F921 HydrophobicContact CB-CE1 4.1Å; A595-L960 HydrophobicContact CB-CD1 3.88Å
596	L	86	Confident	84.2	Confident	0 Å²	0	21.6 Å²	21.6	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-59.1	-49.3	176.8	179	69.5	0	0	0	111.5	A592 F593 C598 I599 I600 L960 L963 W964 F975	A592-L596 WeakPolarHBondContact O-CB 3.47Å; A592-L596 PolarHBondContact O-N 3.47Å; F593-L596 WeakPolarHBondContact O-CB 3.36Å; F593-L596 PolarHBondContact O-N 3.42Å; L596-C598 VanDerWaalsContact C-N 3.32Å; L596-C598 PolarHBondContact O-N 3.15Å; L596-I599 PolarHBondContact O-N 3.31Å; L596-I600 HydrophobicContact CD1-CD1 4.32Å; L596-I600 HydrophobicContact CG-CD1 3.96Å; L596-I600 VanDerWaalsContact O-CG1 3.29Å; L596-I600 WeakPolarHBondContact O-CG1 3.44Å; L596-I600 PolarHBondContact O-N 3.29Å; L596-L960 HydrophobicContact CB-CD1 4.26Å; L596-L960 HydrophobicContact CB-CG 4.44Å; L596-L960 HydrophobicContact CD1-CG 4.33Å; L596-L963 HydrophobicContact CD1-CB 4.3Å; L596-L963 HydrophobicContact CD2-CB 3.7Å; L596-L963 HydrophobicContact CD2-CD1 4.13Å; L596-L963 HydrophobicContact CD2-CG 4.36Å; L596-W964 HydrophobicContact CD1-CB 4.31Å; L596-W964 HydrophobicContact CD1-CE3 3.95Å; L596-F975 HydrophobicContact CD2-CE2 3.68Å; L596-F975 HydrophobicContact CD2-CZ 3.8Å
597	I	84.8	Confident	84.6	Confident	23 Å²	23	24.2 Å²	24.2	12%	0.118	12%	0.115	C	C	.	.	H	α-helix	trans	-62.8	-40.5	178.8	-58.8	-64.2	0	0	0	110.9	F593 A594 I599 I600 F601 T844 V845	F593-I597 HydrophobicContact CD1-CG1 4.29Å; F593-I597 HydrophobicContact CE1-CG1 3.99Å; F593-I597 HydrophobicContact CE2-CD1 4.31Å; F593-I597 HydrophobicContact CE2-CG1 4.41Å; F593-I597 HydrophobicContact CZ-CD1 4.08Å; F593-I597 HydrophobicContact CZ-CG1 4.05Å; F593-I597 WeakPolarHBondContact O-CG1 3.33Å; F593-I597 PolarHBondContact O-N 3.39Å; A594-I597 PolarHBondContact O-N 3.32Å; I597-I599 PolarHBondContact O-N 3.4Å; I597-I600 HydrophobicContact CD1-CD1 4.36Å; I597-I600 PolarHBondContact O-N 3.42Å; I597-F601 HydrophobicContact CG2-CD2 3.84Å; I597-F601 HydrophobicContact CG2-CE2 3.92Å; I597-F601 WeakPolarHBondContact O-CD2 3.21Å; I597-F601 PolarHBondContact O-N 3.49Å; I597-T844 WeakPolarHBondContact CG2-OG1 3.5Å; I597-V845 HydrophobicContact CG2-CG2 3.73Å
598	C	84.9	Confident	84.7	Confident	2 Å²	2	24.8 Å²	24.8	1%	0.014	12%	0.118	C	C	.	.	H	α-helix	trans	-61.7	-42.4	176.5	-66.2	0	0	0	0	112.1	A594 A595 L596 F601 I602 S915 L916	A594-C598 PolarHBondContact O-N 3.01Å; A594-C598 PolarHBondContact O-SG 3.11Å; A595-C598 PolarHBondContact O-N 2.72Å; L596-C598 VanDerWaalsContact C-N 3.32Å; L596-C598 PolarHBondContact O-N 3.15Å; C598-F601 PolarHBondContact O-N 2.97Å; C598-I602 WeakPolarHBondContact O-CG1 3.39Å; C598-I602 PolarHBondContact O-N 3.19Å; C598-S915 VanDerWaalsContact SG-CB 3.52Å; C598-L916 HydrophobicContact CB-CD2 3.57Å; C598-L916 HydrophobicContact CB-CG 3.83Å
599	I	87.3	Confident	84.8	Confident	63 Å²	63	25.5 Å²	25.5	32%	0.323	12%	0.122	S	C	.	.	H	α-helix	trans	-66	-39.5	176.3	-65	164.2	0	0	0	110.6	A595 L596 I597 F601 I602 Y603 L960 W964	A595-I599 VanDerWaalsContact O-CG1 3.27Å; A595-I599 WeakPolarHBondContact O-CG1 3.38Å; A595-I599 PolarHBondContact O-N 3.29Å; L596-I599 PolarHBondContact O-N 3.31Å; I597-I599 PolarHBondContact O-N 3.4Å; I599-F601 VanDerWaalsContact C-N 3.33Å; I599-F601 PolarHBondContact O-N 2.89Å; I599-I602 PolarHBondContact O-N 2.95Å; I599-Y603 WeakPolarHBondContact O-CB 3.46Å; I599-Y603 PolarHBondContact O-N 3.44Å; I599-L960 HydrophobicContact CD1-CD1 4.35Å; I599-L960 HydrophobicContact CD1-CD2 3.93Å; I599-W964 HydrophobicContact CB-CZ3 4.29Å; I599-W964 HydrophobicContact CG2-CE3 4.12Å; I599-W964 HydrophobicContact CG2-CH2 4.13Å; I599-W964 HydrophobicContact CG2-CZ3 3.6Å
600	I	84.7	Confident	85	Confident	18 Å²	18	32.5 Å²	32.5	9%	0.092	15%	0.152	C	C	.	.	H	α-helix	trans	-59.5	-45.2	175	-70.8	168.4	0	0	0	110.5	L596 I597 Y603 E604 W964 K967	L596-I600 HydrophobicContact CD1-CD1 4.32Å; L596-I600 HydrophobicContact CG-CD1 3.96Å; L596-I600 VanDerWaalsContact O-CG1 3.29Å; L596-I600 WeakPolarHBondContact O-CG1 3.44Å; L596-I600 PolarHBondContact O-N 3.29Å; I597-I600 HydrophobicContact CD1-CD1 4.36Å; I597-I600 PolarHBondContact O-N 3.42Å; I600-Y603 PolarHBondContact O-N 3.08Å; I600-E604 WeakPolarHBondContact O-CB 3.37Å; I600-E604 PolarHBondContact O-N 3.3Å; I600-W964 HydrophobicContact CB-CZ3 4.23Å; I600-W964 HydrophobicContact CG1-CE3 4.01Å; I600-W964 HydrophobicContact CG1-CH2 4.29Å; I600-W964 HydrophobicContact CG1-CZ3 3.44Å; I600-W964 VanDerWaalsContact CG1-CZ3 3.44Å; I600-K967 HydrophobicContact CD1-CD 4Å; I600-K967 HydrophobicContact CD1-CG 4.13Å; I600-K967 HydrophobicContact CG1-CD 4.23Å
601	F	82.5	Confident	85.2	Confident	34 Å²	34	38 Å²	38	15%	0.149	18%	0.178	C	C	.	.	H	α-helix	trans	-63.5	-41.8	178.4	-96.6	-106	0	0	0	112.7	I597 C598 I599 A605 V845 L846	I597-F601 HydrophobicContact CG2-CD2 3.84Å; I597-F601 HydrophobicContact CG2-CE2 3.92Å; I597-F601 WeakPolarHBondContact O-CD2 3.21Å; I597-F601 PolarHBondContact O-N 3.49Å; C598-F601 PolarHBondContact O-N 2.97Å; I599-F601 VanDerWaalsContact C-N 3.33Å; I599-F601 PolarHBondContact O-N 2.89Å; F601-A605 WeakPolarHBondContact O-CB 3.35Å; F601-A605 PolarHBondContact O-N 3.03Å; F601-V845 HydrophobicContact CD2-CG2 4.08Å; F601-V845 HydrophobicContact CE2-CG2 4.19Å; F601-V845 HydrophobicContact CG-CG2 4.39Å; F601-V845 HydrophobicContact CZ-CB 4.46Å; F601-L846 HydrophobicContact CE1-CD1 4.33Å; F601-L846 HydrophobicContact CZ-CD1 4.28Å
602	I	88.9	Confident	85	Confident	33 Å²	33	38.7 Å²	38.7	17%	0.169	18%	0.182	C	C	.	.	H	α-helix	trans	-62.9	-46.9	176.1	-69.6	168.4	0	0	0	110.3	C598 I599 A605 L606 L909 V913 L916	C598-I602 WeakPolarHBondContact O-CG1 3.39Å; C598-I602 PolarHBondContact O-N 3.19Å; I599-I602 PolarHBondContact O-N 2.95Å; I602-A605 PolarHBondContact O-N 3.18Å; I602-L606 HydrophobicContact CG2-CD1 4.18Å; I602-L606 WeakPolarHBondContact O-CG 3.47Å; I602-L606 PolarHBondContact O-N 3.36Å; I602-L606 VanDerWaalsContact O-N 3.17Å; I602-L909 HydrophobicContact CB-CD1 4.44Å; I602-L909 HydrophobicContact CG1-CD1 4.34Å; I602-L909 HydrophobicContact CG2-CD1 3.9Å; I602-V913 HydrophobicContact CD1-CG2 3.93Å; I602-V913 HydrophobicContact CG1-CG2 4.27Å; I602-L916 HydrophobicContact CD1-CD1 3.57Å
603	Y	88.4	Confident	84.8	Confident	101 Å²	101	39.7 Å²	39.7	40%	0.396	19%	0.191	S	C	.	.	H	α-helix	trans	-61.8	-46.8	177.5	173.7	-90.8	0	0	0	111.8	I599 I600 A605 L606 E607 W964	I599-Y603 WeakPolarHBondContact O-CB 3.46Å; I599-Y603 PolarHBondContact O-N 3.44Å; I600-Y603 PolarHBondContact O-N 3.08Å; Y603-A605 VanDerWaalsContact C-N 3.32Å; Y603-A605 PolarHBondContact O-N 3.11Å; Y603-L606 PolarHBondContact O-N 3.29Å; Y603-L606 VanDerWaalsContact O-N 3.14Å; Y603-E607 HydrophobicContact CE1-CB 4.17Å; Y603-E607 VanDerWaalsContact CE1-CD 3.48Å; Y603-E607 HydrophobicContact CE1-CG 4.37Å; Y603-E607 VanDerWaalsContact CE1-OE2 3.24Å; Y603-E607 WeakPolarHBondContact CE1-OE2 3.35Å; Y603-E607 WeakPolarHBondContact O-CB 3.34Å; Y603-E607 PolarHBondContact O-N 3.23Å; Y603-E607 PolarHBondContact OH-OE1 3.19Å; Y603-W964 HydrophobicContact CD1-CH2 4.05Å; Y603-W964 HydrophobicContact CD1-CZ2 4.21Å; Y603-W964 HydrophobicContact CD2-CH2 4.15Å; Y603-W964 AromaticContact CD2-CZ2 3.91Å; Y603-W964 HydrophobicContact CD2-CZ2 3.91Å; Y603-W964 HydrophobicContact CE2-CZ2 4.39Å; Y603-W964 AromaticContact CG-CH2 3.64Å; Y603-W964 HydrophobicContact CG-CH2 3.64Å; Y603-W964 AromaticContact CG-CZ2 3.82Å; Y603-W964 HydrophobicContact CG-CZ2 3.82Å
604	E	81.3	Confident	84.7	Confident	34 Å²	34	46.7 Å²	46.7	16%	0.159	22%	0.224	C	C	.	.	H	α-helix	trans	-64.1	-36.4	-179.4	-172.3	179.3	162.3	0	0	112	I600 L606 K608	I600-E604 WeakPolarHBondContact O-CB 3.37Å; I600-E604 PolarHBondContact O-N 3.3Å; E604-L606 VanDerWaalsContact C-N 3.35Å; E604-K608 HydrophobicContact CG-CD 4.42Å; E604-K608 WeakPolarHBondContact O-CB 3.36Å; E604-K608 WeakPolarHBondContact O-CG 3.37Å; E604-K608 PolarHBondContact O-N 3.15Å; E604-K608 VanDerWaalsContact OE1-CE 3.29Å; E604-K608 WeakPolarHBondContact OE1-CE 3.25Å; E604-K608 IonicContact OE1-NZ 2.79Å; E604-K608 PolarHBondContact OE1-NZ 2.87Å
605	A	85	Confident	84.3	Confident	1 Å²	1	53 Å²	53	1%	0.008	25%	0.247	C	C	.	.	H	α-helix	trans	-63.9	-39.7	174.3	0	0	0	0	0	112.1	F601 I602 Y603 L609 F908 L909	F601-A605 WeakPolarHBondContact O-CB 3.35Å; F601-A605 PolarHBondContact O-N 3.03Å; I602-A605 PolarHBondContact O-N 3.18Å; Y603-A605 VanDerWaalsContact C-N 3.32Å; Y603-A605 PolarHBondContact O-N 3.11Å; A605-L609 PolarHBondContact O-N 2.95Å; A605-F908 HydrophobicContact CB-CB 4.1Å; A605-L909 HydrophobicContact CB-CB 4.4Å
606	L	89.7	Confident	84	Confident	59 Å²	59	54.9 Å²	54.9	31%	0.309	25%	0.254	S	S	.	.	H	α-helix	trans	-73.2	-42.5	176.6	-67	168.3	0	0	0	111.9	I602 Y603 E604 K608 L609 F610 F699	I602-L606 HydrophobicContact CG2-CD1 4.18Å; I602-L606 WeakPolarHBondContact O-CG 3.47Å; I602-L606 PolarHBondContact O-N 3.36Å; I602-L606 VanDerWaalsContact O-N 3.17Å; Y603-L606 PolarHBondContact O-N 3.29Å; Y603-L606 VanDerWaalsContact O-N 3.14Å; E604-L606 VanDerWaalsContact C-N 3.35Å; L606-K608 VanDerWaalsContact C-N 3.34Å; L606-K608 PolarHBondContact O-N 2.8Å; L606-L609 WeakPolarHBondContact O-CB 3.41Å; L606-L609 PolarHBondContact O-N 3.27Å; L606-L609 VanDerWaalsContact O-N 3.08Å; L606-F610 HydrophobicContact CB-CE2 4.47Å; L606-F610 WeakPolarHBondContact O-CD2 3.3Å; L606-F610 PolarHBondContact O-N 3.15Å; L606-F699 HydrophobicContact CD2-CE1 4.28Å; L606-F699 HydrophobicContact CD2-CZ 4.19Å
607	E	85.8	Confident	83.6	Confident	93 Å²	93	57.9 Å²	57.9	44%	0.435	27%	0.274	S	S	.	.	H	α-helix	trans	-59.3	-43.1	177.7	-177.2	174.7	-131.4	0	0	111.5	Y603 L609 F610 H611	Y603-E607 HydrophobicContact CE1-CB 4.17Å; Y603-E607 VanDerWaalsContact CE1-CD 3.48Å; Y603-E607 HydrophobicContact CE1-CG 4.37Å; Y603-E607 VanDerWaalsContact CE1-OE2 3.24Å; Y603-E607 WeakPolarHBondContact CE1-OE2 3.35Å; Y603-E607 WeakPolarHBondContact O-CB 3.34Å; Y603-E607 PolarHBondContact O-N 3.23Å; Y603-E607 PolarHBondContact OH-OE1 3.19Å; E607-L609 VanDerWaalsContact C-N 3.3Å; E607-L609 PolarHBondContact O-N 3.31Å; E607-F610 PolarHBondContact O-N 3.32Å; E607-H611 WeakPolarHBondContact O-CB 2.86Å; E607-H611 PolarHBondContact O-N 3Å
608	K	81.6	Confident	83	Confident	31 Å²	31	59.4 Å²	59.4	14%	0.135	28%	0.284	C	S	.	.	H	α-helix	trans	-63.4	-34.3	174.3	-73.6	177.2	-176.5	165.1	0	112.9	T491 E604 L606 L612 Y905	T491-K608 PolarHBondContact OG1-NZ 3.12Å; E604-K608 HydrophobicContact CG-CD 4.42Å; E604-K608 WeakPolarHBondContact O-CB 3.36Å; E604-K608 WeakPolarHBondContact O-CG 3.37Å; E604-K608 PolarHBondContact O-N 3.15Å; E604-K608 VanDerWaalsContact OE1-CE 3.29Å; E604-K608 WeakPolarHBondContact OE1-CE 3.25Å; E604-K608 IonicContact OE1-NZ 2.79Å; E604-K608 PolarHBondContact OE1-NZ 2.87Å; L606-K608 VanDerWaalsContact C-N 3.34Å; L606-K608 PolarHBondContact O-N 2.8Å; K608-L612 PolarHBondContact O-N 3.49Å; K608-L612 VanDerWaalsContact O-N 3.14Å; K608-Y905 HydrophobicContact CB-CD2 4.13Å; K608-Y905 HydrophobicContact CB-CE1 4.25Å; K608-Y905 HydrophobicContact CB-CE2 3.8Å; K608-Y905 HydrophobicContact CB-CG 4.5Å; K608-Y905 HydrophobicContact CD-CD1 4.22Å; K608-Y905 HydrophobicContact CD-CE1 3.69Å
609	L	85.8	Confident	82.3	Confident	16 Å²	16	61.3 Å²	61.3	8%	0.084	29%	0.294	C	S	.	.	H	α-helix	trans	-68.6	-41.1	173.6	-176.9	67.2	0	0	0	111.5	A605 L606 E607 L612 G613 I696 F699	A605-L609 PolarHBondContact O-N 2.95Å; L606-L609 WeakPolarHBondContact O-CB 3.41Å; L606-L609 PolarHBondContact O-N 3.27Å; L606-L609 VanDerWaalsContact O-N 3.08Å; E607-L609 VanDerWaalsContact C-N 3.3Å; E607-L609 PolarHBondContact O-N 3.31Å; L609-L612 WeakPolarHBondContact O-CB 3.42Å; L609-L612 PolarHBondContact O-N 3.32Å; L609-G613 PolarHBondContact O-N 3.23Å; L609-I696 HydrophobicContact CD1-CG1 4.13Å; L609-F699 HydrophobicContact CD1-CB 4.32Å; L609-F699 HydrophobicContact CD1-CG 4.37Å; L609-F699 HydrophobicContact CD2-CD1 3.68Å; L609-F699 HydrophobicContact CD2-CD2 4.49Å; L609-F699 HydrophobicContact CD2-CE1 3.86Å; L609-F699 HydrophobicContact CD2-CG 4.01Å; L609-F699 HydrophobicContact CD2-CZ 4.33Å
610	F	87.1	Confident	81.3	Confident	152 Å²	152	66.4 Å²	66.4	67%	0.667	32%	0.318	S	S	*	.	H	α-helix	trans	-65.8	-43.5	175.7	-78.5	-68.1	0	0	0	112.3	L606 E607 L612 G613 E614	L606-F610 HydrophobicContact CB-CE2 4.47Å; L606-F610 WeakPolarHBondContact O-CD2 3.3Å; L606-F610 PolarHBondContact O-N 3.15Å; E607-F610 PolarHBondContact O-N 3.32Å; F610-L612 PolarHBondContact O-N 3.14Å; F610-G613 WeakPolarHBondContact O-CA 3.41Å; F610-G613 PolarHBondContact O-N 3.33Å; F610-E614 PolarHBondContact O-N 3.02Å; F610-E614 VanDerWaalsContact O-N 3.12Å
611	H	82.7	Confident	80.1	Confident	122 Å²	122	72.9 Å²	72.9	57%	0.565	35%	0.348	S	S	*	.	H	α-helix	trans	-60.1	-32.9	175.1	-172.2	-84.6	0	0	0	111.9	E607 G613 E614 Y615	E607-H611 WeakPolarHBondContact O-CB 2.86Å; E607-H611 PolarHBondContact O-N 3Å; H611-G613 VanDerWaalsContact C-N 3.31Å; H611-E614 PolarHBondContact O-N 3.23Å; H611-Y615 PolarHBondContact O-N 2.9Å; H611-Y615 VanDerWaalsContact O-N 3.13Å
612	L	81.5	Confident	78.9	Confident	19 Å²	19	76.3 Å²	76.3	10%	0.099	37%	0.368	C	S	.	.	H	α-helix	trans	-66.3	-33.9	172.2	-169.4	66.8	0	0	0	112.4	K608 L609 F610 E614 Y615 Y616 P750 P902	K608-L612 PolarHBondContact O-N 3.49Å; K608-L612 VanDerWaalsContact O-N 3.14Å; L609-L612 WeakPolarHBondContact O-CB 3.42Å; L609-L612 PolarHBondContact O-N 3.32Å; F610-L612 PolarHBondContact O-N 3.14Å; L612-E614 VanDerWaalsContact C-N 3.34Å; L612-Y615 PolarHBondContact O-N 3.39Å; L612-Y616 HydrophobicContact CD1-CD2 3.48Å; L612-Y616 VanDerWaalsContact CD1-CD2 3.48Å; L612-Y616 HydrophobicContact CD1-CE2 3.42Å; L612-Y616 VanDerWaalsContact CD1-CE2 3.42Å; L612-Y616 HydrophobicContact CG-CD2 4Å; L612-Y616 HydrophobicContact CG-CE2 4.41Å; L612-Y616 PolarHBondContact O-N 3.34Å; L612-P750 HydrophobicContact CD1-CB 4.35Å; L612-P750 HydrophobicContact CD1-CG 3.85Å; L612-P750 HydrophobicContact CD2-CG 4Å; L612-P902 HydrophobicContact CD2-CG 4.08Å
613	G	80	Confident	77.5	Confident	20 Å²	20	77.3 Å²	77.3	21%	0.206	38%	0.378	C	S	.	.	H	α-helix	trans	-67.2	-29.3	172.4	0	0	0	0	0	114.4	L609 F610 H611 Y616 P617 L692	L609-G613 PolarHBondContact O-N 3.23Å; F610-G613 WeakPolarHBondContact O-CA 3.41Å; F610-G613 PolarHBondContact O-N 3.33Å; H611-G613 VanDerWaalsContact C-N 3.31Å; G613-Y616 CarbonylContact O-C 3.13Å; G613-P617 WeakPolarHBondContact O-CA 3.5Å; G613-L692 VanDerWaalsContact CA-CD1 3.43Å
614	E	81	Confident	76.2	Confident	149 Å²	149	79.6 Å²	79.6	70%	0.696	40%	0.396	S	S	*	.	H	α-helix	trans	-74.7	-37.1	172.3	-66.3	-175.9	169.2	0	0	112	F610 H611 L612	F610-E614 PolarHBondContact O-N 3.02Å; F610-E614 VanDerWaalsContact O-N 3.12Å; H611-E614 PolarHBondContact O-N 3.23Å; L612-E614 VanDerWaalsContact C-N 3.34Å
615	Y	75.8	Confident	75.1	Confident	140 Å²	140	85.6 Å²	85.6	55%	0.549	43%	0.429	S	S	.	.	H	α-helix	trans	-73.5	-35.1	179.1	-158.7	-90.1	0	0	0	112.8	H611 L612 P617	H611-Y615 PolarHBondContact O-N 2.9Å; H611-Y615 VanDerWaalsContact O-N 3.13Å; L612-Y615 PolarHBondContact O-N 3.39Å; Y615-P617 VanDerWaalsContact C-CD 3.47Å; Y615-P617 WeakPolarHBondContact O-CD 3.19Å
616	Y	80	Confident	73.9	Confident	43 Å²	43	89.3 Å²	89.3	17%	0.169	45%	0.449	C	S	.	.	S	Bend	trans	-117.6	74.3	175.3	-58.7	-80.9	0	0	0	109.3	L612 G613 I688 V691	L612-Y616 HydrophobicContact CD1-CD2 3.48Å; L612-Y616 VanDerWaalsContact CD1-CD2 3.48Å; L612-Y616 HydrophobicContact CD1-CE2 3.42Å; L612-Y616 VanDerWaalsContact CD1-CE2 3.42Å; L612-Y616 HydrophobicContact CG-CD2 4Å; L612-Y616 HydrophobicContact CG-CE2 4.41Å; L612-Y616 PolarHBondContact O-N 3.34Å; G613-Y616 CarbonylContact O-C 3.13Å; Y616-I688 HydrophobicContact CD1-CB 4.47Å; Y616-I688 HydrophobicContact CD1-CD1 4.16Å; Y616-I688 HydrophobicContact CE1-CD1 3.79Å; Y616-V691 HydrophobicContact CD1-CB 4.26Å; Y616-V691 HydrophobicContact CD1-CG1 3.99Å; Y616-V691 HydrophobicContact CD2-CG1 4.17Å; Y616-V691 HydrophobicContact CE1-CG1 4.19Å; Y616-V691 HydrophobicContact CE2-CG1 4.38Å; Y616-V691 HydrophobicContact CG-CB 4.41Å; Y616-V691 HydrophobicContact CG-CG1 3.98Å
617	P	77.1	Confident	72.3	Confident	63 Å²	63	92.7 Å²	92.7	41%	0.409	47%	0.467	S	S	.	.			trans	-61.1	161.8	-179.8	26.9	-34.5	0	0	0	110.8	G613 Y615 Y687	G613-P617 WeakPolarHBondContact O-CA 3.5Å; Y615-P617 VanDerWaalsContact C-CD 3.47Å; Y615-P617 WeakPolarHBondContact O-CD 3.19Å; P617-Y687 WeakPolarHBondContact O-CE2 3.08Å
618	V	72.6	Confident	70.8	Confident	55 Å²	55	94.3 Å²	94.3	33%	0.333	48%	0.483	S	S	.	.			trans	-99.2	134.7	173.4	-179.3	0	0	0	0	110.2	M620 Y687 L692 F693	V618-M620 PolarHBondContact O-N 2.88Å; V618-M620 VanDerWaalsContact O-N 3.15Å; V618-Y687 VanDerWaalsContact CA-OH 3.31Å; V618-Y687 WeakPolarHBondContact CA-OH 3.48Å; V618-L692 HydrophobicContact CG2-CB 4.44Å; V618-L692 HydrophobicContact CG2-CD2 3.59Å; V618-F693 HydrophobicContact CG1-CE2 3.91Å; V618-F693 HydrophobicContact CG1-CZ 4Å; V618-F693 HydrophobicContact CG2-CE2 4.02Å; V618-F693 HydrophobicContact CG2-CZ 4.05Å
619	N	68.6	Low	69.6	Low	42 Å²	42	99.3 Å²	99.3	23%	0.225	51%	0.505	C	S	.	.			trans	-80.4	100.7	179	-171.6	1	0	0	0	108.1	H621 Y687	N619-H621 PolarHBondContact O-N 3.26Å; N619-H621 PolarHBondContact OD1-N 2.98Å; N619-H621 VanDerWaalsContact OD1-N 3.1Å; N619-Y687 HydrophobicContact CB-CD1 4.28Å; N619-Y687 HydrophobicContact CB-CD2 3.97Å; N619-Y687 HydrophobicContact CB-CE1 3.84Å; N619-Y687 HydrophobicContact CB-CE2 3.47Å; N619-Y687 VanDerWaalsContact CB-CE2 3.47Å; N619-Y687 HydrophobicContact CB-CG 4.35Å; N619-Y687 VanDerWaalsContact CB-CZ 3.45Å; N619-Y687 PolarHBondContact N-OH 2.9Å
620	M	66.8	Low	68.5	Low	169 Å²	169	101.8 Å²	101.8	83%	0.833	51%	0.514	S	S	*	.			trans	-75.9	-10.4	178.1	-64.3	-167.5	66.4	0	0	113.4	V618	V618-M620 PolarHBondContact O-N 2.88Å; V618-M620 VanDerWaalsContact O-N 3.15Å
621	H	60.8	Low	67.6	Low	154 Å²	154	97.4 Å²	97.4	71%	0.713	50%	0.502	S	S	*	.			trans	-106.1	57.7	-175.3	-62.5	87.6	0	0	0	111.7	N619 Y630	N619-H621 PolarHBondContact O-N 3.26Å; N619-H621 PolarHBondContact OD1-N 2.98Å; N619-H621 VanDerWaalsContact OD1-N 3.1Å; H621-Y630 PolarHBondContact O-OH 2.97Å
622	N	56.7	Low	67.3	Low	106 Å²	106	93.5 Å²	93.5	57%	0.567	49%	0.488	S	S	*	.			trans	-97.4	85.2	178.3	-162.6	10.2	0	0	0	111.4	Y630	N622-Y630 WeakPolarHBondContact CA-OH 3.4Å
623	S	59.7	Low	67.1	Low	54 Å²	54	98 Å²	98	38%	0.378	51%	0.508	S	S	.	.			trans	-86.3	110.7	168.1	58.2	0	0	0	0	108.8	D625 N626 Y630	S623-D625 PolarHBondContact O-N 3.44Å; S623-N626 PolarHBondContact O-N 3.06Å; S623-N626 VanDerWaalsContact O-N 3.07Å; S623-Y630 PolarHBondContact N-OH 2.85Å
624	L	59.7	Low	67.1	Low	150 Å²	150	97.6 Å²	97.6	79%	0.785	50%	0.503	S	S	*	.	G	3₁₀ helix	trans	-52.9	-26.4	-179.4	-98.3	114.9	0	0	0	113.7	N626	L624-N626 VanDerWaalsContact C-N 3.34Å; L624-N626 PolarHBondContact O-N 3.26Å
625	D	60.1	Low	67	Low	159 Å²	159	92 Å²	92	85%	0.85	48%	0.48	S	S	*	.	G	3₁₀ helix	trans	-75	-14.6	-179	-64	-29.2	0	0	0	114.7	S623	S623-D625 PolarHBondContact O-N 3.44Å
626	N	59.6	Low	67	Low	80 Å²	80	88 Å²	88	43%	0.428	47%	0.471	S	S	.	.	G	3₁₀ helix	trans	-110.6	27.9	-177	-85.5	-17.5	0	0	0	113.9	S623 L624 T628 F629 Y630	S623-N626 PolarHBondContact O-N 3.06Å; S623-N626 VanDerWaalsContact O-N 3.07Å; L624-N626 VanDerWaalsContact C-N 3.34Å; L624-N626 PolarHBondContact O-N 3.26Å; N626-T628 PolarHBondContact O-N 3.26Å; N626-F629 HydrophobicContact CB-CD2 4.36Å; N626-F629 PolarHBondContact O-N 2.93Å; N626-Y630 WeakPolarHBondContact O-CD2 3.44Å
627	L	55.9	Low	66.8	Low	130 Å²	130	87 Å²	87	68%	0.681	47%	0.47	S	S	*	.	G	3₁₀ helix	trans	-57	-27.3	-174.8	-157	70.7	0	0	0	113.8	F629	L627-F629 PolarHBondContact O-N 3.3Å
628	T	54.7	Low	66.4	Low	127 Å²	127	88.3 Å²	88.3	78%	0.779	49%	0.486	S	S	*	.	G	3₁₀ helix	trans	-77.9	-10.6	180	49.9	0	0	0	0	114.9	N626	N626-T628 PolarHBondContact O-N 3.26Å
629	F	55.8	Low	66.2	Low	136 Å²	136	93.1 Å²	93.1	60%	0.596	51%	0.51	S	S	*	.	G	3₁₀ helix	trans	-103.3	-0.2	-177.7	-66.9	-76.5	0	0	0	114.3	N626 L627 S631 P679	N626-F629 HydrophobicContact CB-CD2 4.36Å; N626-F629 PolarHBondContact O-N 2.93Å; L627-F629 PolarHBondContact O-N 3.3Å; F629-S631 PolarHBondContact O-N 3.05Å; F629-P679 VanDerWaalsContact O-CG 3.25Å; F629-P679 WeakPolarHBondContact O-CG 3.42Å
630	Y	62.9	Low	66	Low	67 Å²	67	93.2 Å²	93.2	26%	0.263	52%	0.516	S	S	.	.			trans	-78.6	84.9	175.2	-69.3	-78.5	0	0	0	111	H621 N622 S623 N626 A680	H621-Y630 PolarHBondContact O-OH 2.97Å; N622-Y630 WeakPolarHBondContact CA-OH 3.4Å; S623-Y630 PolarHBondContact N-OH 2.85Å; N626-Y630 WeakPolarHBondContact O-CD2 3.44Å; Y630-A680 HydrophobicContact CD1-CB 4.38Å
631	S	67.3	Low	66.2	Low	60 Å²	60	87.7 Å²	87.7	42%	0.42	50%	0.495	S	S	.	.			trans	-122.6	142.3	170	62.1	0	0	0	0	110.8	F629 G678	F629-S631 PolarHBondContact O-N 3.05Å; S631-G678 WeakPolarHBondContact O-CA 3.48Å
632	C	76.3	Confident	66.6	Low	40 Å²	40	87 Å²	87	27%	0.27	50%	0.496	S	S	.	.			trans	-117.9	116	168.6	-173.8	0	0	0	0	108.7	A680 C681 P686	C632-A680 HydrophobicContact CB-CB 4.3Å; C632-C681 WeakPolarHBondContact CA-SG 3.47Å; C632-C681 HydrophobicContact CB-CB 4.19Å; C632-C681 WeakPolarHBondContact CB-SG 3.42Å; C632-C681 VanDerWaalsContact SG-CA 3.52Å; C632-C681 WeakPolarHBondContact SG-CB 3.29Å; C632-C681 CovalentContact SG-SG 2.03Å; C632-C681 PolarHBondContact SG-SG 2.74Å; C632-P686 HydrophobicContact CB-CB 4.08Å
633	Q	77	Confident	67	Low	113 Å²	113	89.5 Å²	89.5	53%	0.528	51%	0.505	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	146	-179.8	-68	-177.1	2.3	0	0	110.1	V677	Q633-V677 PolarHBondContact N-O 3.19Å; Q633-V677 VanDerWaalsContact N-O 3.11Å; Q633-V677 PolarHBondContact O-N 3.49Å
634	C	80.4	Confident	67.5	Low	13 Å²	13	88.6 Å²	88.6	9%	0.088	50%	0.495	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	138.3	170.9	-173.4	0	0	0	0	109.1	W661 C669 E675 F676	C634-W661 WeakPolarHBondContact O-CB 3.49Å; C634-W661 VanDerWaalsContact SG-CE3 3.57Å; C634-C669 HydrophobicContact CB-CB 3.76Å; C634-C669 WeakPolarHBondContact CB-SG 3.38Å; C634-C669 WeakPolarHBondContact SG-CB 3.25Å; C634-C669 CovalentContact SG-SG 2.01Å; C634-C669 PolarHBondContact SG-SG 3.04Å; C634-E675 CarbonylContact C-O 3.59Å; C634-F676 HydrophobicContact CB-CE1 4.49Å
635	S	78.3	Confident	67.9	Low	31 Å²	31	85.4 Å²	85.4	22%	0.217	48%	0.479	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	157.1	176	66.2	0	0	0	0	110.9	E675 V677	S635-E675 PolarHBondContact N-O 3Å; S635-E675 PolarHBondContact O-N 3.5Å; S635-E675 PolarHBondContact OG-O 2.78Å; S635-V677 WeakPolarHBondContact OG-CG2 3.45Å
636	P	76.9	Confident	68.2	Low	56 Å²	56	83.9 Å²	83.9	36%	0.364	47%	0.466	S	S	.	.			trans	-62.9	148.2	174.5	24.8	-32.7	0	0	0	111.6	W661	P636-W661 HydrophobicContact CB-CD2 4.33Å; P636-W661 HydrophobicContact CB-CH2 4.23Å; P636-W661 HydrophobicContact CB-CZ2 3.62Å
637	P	75.7	Confident	68.6	Low	23 Å²	23	84.2 Å²	84.2	15%	0.149	47%	0.465	C	S	.	.			trans	-66.1	140	175	27.1	-33.4	0	0	0	111.1	N639 W648 E675	P637-N639 VanDerWaalsContact C-N 3.26Å; P637-N639 PolarHBondContact O-N 3.44Å; P637-W648 HydrophobicContact CG-CH2 4.15Å; P637-W648 HydrophobicContact CG-CZ2 4.25Å; P637-E675 HydrophobicContact CB-CG 4.41Å
638	A	68.5	Low	69.5	Low	90 Å²	90	78.3 Å²	78.3	74%	0.744	43%	0.434	S	S	*	.	S	Bend	trans	-63	-26.3	-173.5	0	0	0	0	0	114.5
639	N	68.4	Low	70.2	Confident	155 Å²	155	76 Å²	76	83%	0.829	42%	0.416	S	S	*	.	S	Bend	trans	-132	95.9	176.3	-77.9	-21.2	0	0	0	110.5	P637	P637-N639 VanDerWaalsContact C-N 3.26Å; P637-N639 PolarHBondContact O-N 3.44Å
640	A	64.1	Low	70.6	Confident	44 Å²	44	76.7 Å²	76.7	36%	0.364	43%	0.426	S	S	.	.			trans	-75.9	127.2	174.8	0	0	0	0	0	110.9	L645 W648	A640-L645 HydrophobicContact CB-CD1 3.9Å; A640-W648 HydrophobicContact CB-CH2 4.05Å; A640-W648 HydrophobicContact CB-CZ3 4.08Å
641	S	71	Confident	70.7	Confident	54 Å²	54	76.6 Å²	76.6	38%	0.378	43%	0.432	S	S	.	.			trans	-77.4	151.3	172.7	63.6	0	0	0	0	111	Q643 L644 L645	S641-Q643 PolarHBondContact O-N 3.34Å; S641-L644 WeakPolarHBondContact O-CB 3.47Å; S641-L644 PolarHBondContact O-N 3.41Å; S641-L644 WeakPolarHBondContact OG-CD1 3.4Å; S641-L644 WeakPolarHBondContact OG-CG 3.44Å; S641-L644 PolarHBondContact OG-N 3.28Å; S641-L645 PolarHBondContact O-N 3.4Å
642	D	68.8	Low	70.6	Confident	140 Å²	140	76.6 Å²	76.6	75%	0.749	44%	0.442	S	S	*	.	H	α-helix	trans	-56.1	-27.3	178.8	-71.7	-32.8	0	0	0	113	Q646	D642-Q646 WeakPolarHBondContact O-CG 3.4Å; D642-Q646 PolarHBondContact O-N 3.47Å
643	Q	66.1	Low	70	Confident	158 Å²	158	79 Å²	79	74%	0.738	45%	0.446	S	S	*	.	H	α-helix	trans	-70.7	-36.4	174.4	-69.2	-178.6	-16.1	0	0	112.9	S641 Q646 H647	S641-Q643 PolarHBondContact O-N 3.34Å; Q643-Q646 PolarHBondContact O-N 3.16Å; Q643-H647 PolarHBondContact O-N 3.5Å; Q643-H647 VanDerWaalsContact O-N 3.1Å
644	L	69.4	Low	69.2	Low	34 Å²	34	79.8 Å²	79.8	18%	0.178	45%	0.454	C	S	.	.	H	α-helix	trans	-70.2	-38.4	176	-77.3	167.1	0	0	0	111.4	S641 Q646 H647 W648 D673	S641-L644 WeakPolarHBondContact O-CB 3.47Å; S641-L644 PolarHBondContact O-N 3.41Å; S641-L644 WeakPolarHBondContact OG-CD1 3.4Å; S641-L644 WeakPolarHBondContact OG-CG 3.44Å; S641-L644 PolarHBondContact OG-N 3.28Å; L644-Q646 VanDerWaalsContact C-N 3.3Å; L644-Q646 PolarHBondContact O-N 2.98Å; L644-H647 WeakPolarHBondContact O-CB 3.41Å; L644-H647 PolarHBondContact O-N 3.4Å; L644-H647 VanDerWaalsContact O-N 3.12Å; L644-W648 PolarHBondContact O-N 2.97Å; L644-D673 HydrophobicContact CD2-CB 3.96Å; L644-D673 WeakPolarHBondContact CD2-OD2 3.31Å
645	L	68.8	Low	68.2	Low	84 Å²	84	81.8 Å²	81.8	44%	0.44	47%	0.468	S	S	.	.	H	α-helix	trans	-60.6	-39.7	173.7	-115	94.8	0	0	0	112.1	A640 S641 W648 N649	A640-L645 HydrophobicContact CB-CD1 3.9Å; S641-L645 PolarHBondContact O-N 3.4Å; L645-W648 HydrophobicContact CD1-CZ3 4.36Å; L645-W648 PolarHBondContact O-N 3.17Å; L645-N649 PolarHBondContact O-N 3.35Å; L645-N649 VanDerWaalsContact O-N 3.08Å; L645-N649 PolarHBondContact O-ND2 3.01Å
646	Q	65.7	Low	67.2	Low	127 Å²	127	82.3 Å²	82.3	59%	0.593	47%	0.471	S	S	*	.	H	α-helix	trans	-66.5	-36.6	174.3	-72.8	179.6	0.2	0	0	112.3	D642 Q643 L644 N649 L650	D642-Q646 WeakPolarHBondContact O-CG 3.4Å; D642-Q646 PolarHBondContact O-N 3.47Å; Q643-Q646 PolarHBondContact O-N 3.16Å; L644-Q646 VanDerWaalsContact C-N 3.3Å; L644-Q646 PolarHBondContact O-N 2.98Å; Q646-N649 PolarHBondContact O-N 3.17Å; Q646-L650 PolarHBondContact O-N 3.33Å
647	H	69.5	Low	66.4	Low	86 Å²	86	86.7 Å²	86.7	40%	0.398	49%	0.492	S	S	.	.	H	α-helix	trans	-65.4	-40.4	176	-167.3	79.4	0	0	0	112.5	Q643 L644 L650 T651	Q643-H647 PolarHBondContact O-N 3.5Å; Q643-H647 VanDerWaalsContact O-N 3.1Å; L644-H647 WeakPolarHBondContact O-CB 3.41Å; L644-H647 PolarHBondContact O-N 3.4Å; L644-H647 VanDerWaalsContact O-N 3.12Å; H647-L650 PolarHBondContact O-N 3.42Å; H647-T651 PolarHBondContact O-N 3.43Å; H647-T651 PolarHBondContact O-OG1 3.49Å
648	W	73.6	Confident	65.8	Low	6 Å²	6	93.4 Å²	93.4	2%	0.023	52%	0.519	C	S	.	.	H	α-helix	trans	-66.5	-40.7	174.2	-64.1	-23.1	0	0	0	112.4	P637 A640 L644 L645 L650 T651 G652 Y653 I659 W661 L672	P637-W648 HydrophobicContact CG-CH2 4.15Å; P637-W648 HydrophobicContact CG-CZ2 4.25Å; A640-W648 HydrophobicContact CB-CH2 4.05Å; A640-W648 HydrophobicContact CB-CZ3 4.08Å; L644-W648 PolarHBondContact O-N 2.97Å; L645-W648 HydrophobicContact CD1-CZ3 4.36Å; L645-W648 PolarHBondContact O-N 3.17Å; W648-L650 VanDerWaalsContact C-N 3.35Å; W648-L650 PolarHBondContact O-N 2.83Å; W648-T651 WeakPolarHBondContact CA-OG1 3.4Å; W648-T651 PolarHBondContact O-N 2.96Å; W648-T651 PolarHBondContact O-OG1 3.39Å; W648-G652 PolarHBondContact O-N 3.4Å; W648-Y653 CarbonylContact C-O 3.55Å; W648-Y653 PolarHBondContact O-N 2.82Å; W648-I659 HydrophobicContact CG-CD1 4.48Å; W648-W661 HydrophobicContact CZ2-CH2 4.26Å; W648-L672 PolarHBondContact NE1-O 2.92Å
649	N	68.8	Low	65.8	Low	78 Å²	78	89.4 Å²	89.4	42%	0.417	49%	0.485	S	S	.	.	H	α-helix	trans	-62.5	-39.2	174.9	-76	-23.2	0	0	0	112.6	L645 Q646 T651 G652 Y653 N654	L645-N649 PolarHBondContact O-N 3.35Å; L645-N649 VanDerWaalsContact O-N 3.08Å; L645-N649 PolarHBondContact O-ND2 3.01Å; Q646-N649 PolarHBondContact O-N 3.17Å; N649-T651 VanDerWaalsContact C-N 3.31Å; N649-T651 PolarHBondContact O-N 3.23Å; N649-G652 PolarHBondContact O-N 3.21Å; N649-Y653 PolarHBondContact N-O 2.73Å; N649-Y653 PolarHBondContact OD1-O 2.96Å; N649-N654 WeakPolarHBondContact OD1-CA 3.34Å
650	L	65.8	Low	65.9	Low	152 Å²	152	85.6 Å²	85.6	80%	0.796	47%	0.469	S	S	*	.	H	α-helix	trans	-66.8	-28.9	176	-84.7	159	0	0	0	113.3	Q646 H647 W648 G652	Q646-L650 PolarHBondContact O-N 3.33Å; H647-L650 PolarHBondContact O-N 3.42Å; W648-L650 VanDerWaalsContact C-N 3.35Å; W648-L650 PolarHBondContact O-N 2.83Å; L650-G652 VanDerWaalsContact C-N 3.29Å
651	T	64.4	Low	66.3	Low	64 Å²	64	84.8 Å²	84.8	39%	0.393	46%	0.456	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87	2.4	177.6	45.1	0	0	0	0	113.2	H647 W648 N649	H647-T651 PolarHBondContact O-N 3.43Å; H647-T651 PolarHBondContact O-OG1 3.49Å; W648-T651 WeakPolarHBondContact CA-OG1 3.4Å; W648-T651 PolarHBondContact O-N 2.96Å; W648-T651 PolarHBondContact O-OG1 3.39Å; N649-T651 VanDerWaalsContact C-N 3.31Å; N649-T651 PolarHBondContact O-N 3.23Å
652	G	64.4	Low	66.2	Low	61 Å²	61	86.2 Å²	86.2	63%	0.629	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	92.8	10.5	174.7	0	0	0	0	0	115.1	W648 N649 L650	W648-G652 PolarHBondContact O-N 3.4Å; N649-G652 PolarHBondContact O-N 3.21Å; L650-G652 VanDerWaalsContact C-N 3.29Å
653	Y	65	Low	66.3	Low	91 Å²	91	86.1 Å²	86.1	36%	0.357	47%	0.466	S	S	.	.			trans	-112.1	112.6	179.7	-60.5	-79.5	0	0	0	110.7	W648 N649 S655 I659	W648-Y653 CarbonylContact C-O 3.55Å; W648-Y653 PolarHBondContact O-N 2.82Å; N649-Y653 PolarHBondContact N-O 2.73Å; N649-Y653 PolarHBondContact OD1-O 2.96Å; Y653-S655 PolarHBondContact O-N 3.36Å; Y653-I659 HydrophobicContact CD1-CG1 4.07Å; Y653-I659 HydrophobicContact CG-CD1 4.47Å; Y653-I659 HydrophobicContact CG-CG1 4.04Å
654	N	58.8	Low	66.6	Low	128 Å²	128	80.3 Å²	80.3	68%	0.684	44%	0.44	S	S	*	.			trans	-79.6	-8.9	-170.8	-72.2	-17	0	0	0	115	N649	N649-N654 WeakPolarHBondContact OD1-CA 3.34Å
655	S	59.4	Low	66.8	Low	56 Å²	56	84.3 Å²	84.3	39%	0.392	46%	0.461	S	S	.	.	S	Bend	trans	-165.5	153.2	-177.4	-33.7	0	0	0	0	111.9	Y653 D657 F658	Y653-S655 PolarHBondContact O-N 3.36Å; S655-D657 PolarHBondContact O-N 3.48Å; S655-D657 VanDerWaalsContact O-N 3.14Å; S655-F658 PolarHBondContact O-N 3.43Å
656	S	58.2	Low	66.9	Low	41 Å²	41	83.5 Å²	83.5	29%	0.287	46%	0.459	S	S	.	.	G	3₁₀ helix	trans	-54.8	-27.8	173.8	53.9	0	0	0	0	113.9	W661	S656-W661 PolarHBondContact O-NE1 3.21Å
657	D	59.8	Low	67.2	Low	148 Å²	148	81.3 Å²	81.3	79%	0.791	46%	0.459	S	S	*	.	G	3₁₀ helix	trans	-80.8	-17.9	-176.2	-68.4	-11.7	0	0	0	114.1	S655	S655-D657 PolarHBondContact O-N 3.48Å; S655-D657 VanDerWaalsContact O-N 3.14Å
658	F	62.7	Low	67.2	Low	165 Å²	165	80.8 Å²	80.8	72%	0.724	46%	0.457	S	S	*	.	G	3₁₀ helix	trans	-89.6	-6.5	178.1	-98.1	-85.7	0	0	0	113.5	S655 P660	S655-F658 PolarHBondContact O-N 3.43Å; F658-P660 WeakPolarHBondContact O-CD 3.39Å
659	I	67.9	Low	67.3	Low	6 Å²	6	80.5 Å²	80.5	3%	0.031	46%	0.456	C	S	.	.	S	Bend	trans	-88	119.7	176.9	-56.2	176.2	0	0	0	107.9	W648 Y653 W661 L664 L672	W648-I659 HydrophobicContact CG-CD1 4.48Å; Y653-I659 HydrophobicContact CD1-CG1 4.07Å; Y653-I659 HydrophobicContact CG-CD1 4.47Å; Y653-I659 HydrophobicContact CG-CG1 4.04Å; I659-W661 VanDerWaalsContact C-N 3.28Å; I659-W661 HydrophobicContact CB-CZ2 4.25Å; I659-W661 HydrophobicContact CD1-CH2 4.46Å; I659-W661 HydrophobicContact CD1-CZ2 3.98Å; I659-W661 HydrophobicContact CG2-CD2 4.21Å; I659-W661 HydrophobicContact CG2-CZ2 4.32Å; I659-W661 PolarHBondContact O-N 3.04Å; I659-W661 PolarHBondContact O-NE1 3.5Å; I659-L664 HydrophobicContact CG2-CD1 3.78Å; I659-L664 HydrophobicContact CG2-CD2 4.42Å; I659-L664 HydrophobicContact CG2-CG 4.47Å; I659-L672 HydrophobicContact CD1-CD2 4.38Å; I659-L672 HydrophobicContact CG2-CD1 4.01Å
660	P	71.5	Confident	67.5	Low	74 Å²	74	81.4 Å²	81.4	48%	0.481	46%	0.456	S	S	.	.			trans	-76.9	78.7	179.2	31.2	-34	0	0	0	110.6	F658 S662 N663 L664	F658-P660 WeakPolarHBondContact O-CD 3.39Å; P660-S662 PolarHBondContact O-N 3.41Å; P660-S662 VanDerWaalsContact O-N 3.13Å; P660-N663 PolarHBondContact O-N 3.05Å; P660-L664 PolarHBondContact O-N 2.63Å
661	W	73	Confident	67.9	Low	27 Å²	27	79.1 Å²	79.1	10%	0.102	44%	0.444	C	S	.	.	G	3₁₀ helix	trans	-53.4	-35	-172.9	-65.8	98.7	0	0	0	114.5	C634 P636 W648 S656 I659 N663 L664 L672	C634-W661 WeakPolarHBondContact O-CB 3.49Å; C634-W661 VanDerWaalsContact SG-CE3 3.57Å; P636-W661 HydrophobicContact CB-CD2 4.33Å; P636-W661 HydrophobicContact CB-CH2 4.23Å; P636-W661 HydrophobicContact CB-CZ2 3.62Å; W648-W661 HydrophobicContact CZ2-CH2 4.26Å; S656-W661 PolarHBondContact O-NE1 3.21Å; I659-W661 VanDerWaalsContact C-N 3.28Å; I659-W661 HydrophobicContact CB-CZ2 4.25Å; I659-W661 HydrophobicContact CD1-CH2 4.46Å; I659-W661 HydrophobicContact CD1-CZ2 3.98Å; I659-W661 HydrophobicContact CG2-CD2 4.21Å; I659-W661 HydrophobicContact CG2-CZ2 4.32Å; I659-W661 PolarHBondContact O-N 3.04Å; I659-W661 PolarHBondContact O-NE1 3.5Å; W661-N663 PolarHBondContact O-N 2.63Å; W661-L664 HydrophobicContact CD2-CD1 4.28Å; W661-L664 HydrophobicContact CE3-CD1 3.73Å; W661-L664 HydrophobicContact CZ3-CD1 4.25Å; W661-L672 HydrophobicContact CH2-CB 4.48Å
662	S	68.1	Low	68.3	Low	85 Å²	85	76.3 Å²	76.3	59%	0.594	43%	0.427	S	S	*	.	G	3₁₀ helix	trans	-73	-21.9	-180	54.8	0	0	0	0	115.1	P660	P660-S662 PolarHBondContact O-N 3.41Å; P660-S662 VanDerWaalsContact O-N 3.13Å
663	N	71.6	Confident	68.7	Low	138 Å²	138	78 Å²	78	74%	0.738	42%	0.422	S	S	*	.	G	3₁₀ helix	trans	-105.1	5.2	-179.1	-77.9	-9.8	0	0	0	112.9	P660 W661	P660-N663 PolarHBondContact O-N 3.05Å; W661-N663 PolarHBondContact O-N 2.63Å
664	L	71.1	Confident	69.2	Low	36 Å²	36	74.3 Å²	74.3	19%	0.188	41%	0.411	C	S	.	.			trans	-74.8	134.6	177.9	-72.3	166.3	0	0	0	110.9	I659 P660 W661 M668 C669 L672	I659-L664 HydrophobicContact CG2-CD1 3.78Å; I659-L664 HydrophobicContact CG2-CD2 4.42Å; I659-L664 HydrophobicContact CG2-CG 4.47Å; P660-L664 PolarHBondContact O-N 2.63Å; W661-L664 HydrophobicContact CD2-CD1 4.28Å; W661-L664 HydrophobicContact CE3-CD1 3.73Å; W661-L664 HydrophobicContact CZ3-CD1 4.25Å; L664-M668 HydrophobicContact CD2-CB 3.84Å; L664-C669 HydrophobicContact CB-CB 4.47Å; L664-L672 HydrophobicContact CD1-CD1 4.14Å; L664-L672 HydrophobicContact CD2-CD1 3.93Å
665	N	74.3	Confident	70.1	Confident	118 Å²	118	73.2 Å²	73.2	63%	0.631	40%	0.402	S	S	*	.			trans	-63.7	150.7	163.5	-81.2	-13.7	0	0	0	110.4	S667 M668 C669	N665-S667 PolarHBondContact O-N 2.7Å; N665-S667 VanDerWaalsContact O-N 3.08Å; N665-M668 PolarHBondContact O-N 2.58Å; N665-C669 PolarHBondContact O-N 3.14Å
666	V	71.5	Confident	70.9	Confident	66 Å²	66	72.5 Å²	72.5	40%	0.4	39%	0.392	S	S	.	.	H	α-helix	trans	-51	-36.8	178.9	179.6	0	0	0	0	112.5	K670 F676 P686	V666-K670 PolarHBondContact O-N 3.37Å; V666-K670 VanDerWaalsContact O-N 3.15Å; V666-F676 HydrophobicContact CG1-CE1 4.27Å; V666-F676 HydrophobicContact CG1-CZ 3.79Å; V666-P686 HydrophobicContact CG2-CG 3.97Å
667	S	71.1	Confident	71.7	Confident	82 Å²	82	74.7 Å²	74.7	57%	0.573	40%	0.403	S	S	*	.	H	α-helix	trans	-69.2	-40.4	177	51.3	0	0	0	0	113.4	N665 L671	N665-S667 PolarHBondContact O-N 2.7Å; N665-S667 VanDerWaalsContact O-N 3.08Å; S667-L671 WeakPolarHBondContact O-CB 3.09Å; S667-L671 PolarHBondContact O-N 2.84Å
668	M	69.9	Low	72.4	Confident	74 Å²	74	69.1 Å²	69.1	37%	0.365	38%	0.38	S	S	.	.	H	α-helix	trans	-73.1	-35.1	177.2	-69.6	-61.5	-67.7	0	0	111.6	L664 N665 L671 L672	L664-M668 HydrophobicContact CD2-CB 3.84Å; N665-M668 PolarHBondContact O-N 2.58Å; M668-L671 HydrophobicContact CE-CD2 4.21Å; M668-L671 PolarHBondContact O-N 2.9Å; M668-L671 HydrophobicContact SD-CD2 3.99Å; M668-L672 WeakPolarHBondContact O-CB 3.37Å; M668-L672 WeakPolarHBondContact O-CD1 3.26Å; M668-L672 WeakPolarHBondContact O-CG 3.34Å; M668-L672 PolarHBondContact O-N 3.2Å
669	C	75.8	Confident	72.7	Confident	0 Å²	0	65.4 Å²	65.4	0%	0	37%	0.373	C	S	.	.	H	α-helix	trans	-58.9	-46.6	172	178.4	0	0	0	0	111.6	C634 L664 N665 L672 D673 G674 F676	C634-C669 HydrophobicContact CB-CB 3.76Å; C634-C669 WeakPolarHBondContact CB-SG 3.38Å; C634-C669 WeakPolarHBondContact SG-CB 3.25Å; C634-C669 CovalentContact SG-SG 2.01Å; C634-C669 PolarHBondContact SG-SG 3.04Å; L664-C669 HydrophobicContact CB-CB 4.47Å; N665-C669 PolarHBondContact O-N 3.14Å; C669-L672 PolarHBondContact O-N 3.12Å; C669-D673 PolarHBondContact O-N 3.31Å; C669-G674 PolarHBondContact O-N 2.87Å; C669-F676 HydrophobicContact CB-CE1 4.14Å; C669-F676 HydrophobicContact CB-CZ 4Å; C669-F676 VanDerWaalsContact SG-CE1 3.53Å; C669-F676 VanDerWaalsContact SG-CZ 3.52Å
670	K	73.9	Confident	72.6	Confident	98 Å²	98	66 Å²	66	43%	0.426	38%	0.379	S	S	.	.	H	α-helix	trans	-67.2	-37.6	175.2	-74.1	-177	177.9	-176.5	0	113.3	V666 L672 D673 F676 H684	V666-K670 PolarHBondContact O-N 3.37Å; V666-K670 VanDerWaalsContact O-N 3.15Å; K670-L672 PolarHBondContact O-N 3.03Å; K670-D673 PolarHBondContact O-N 2.99Å; K670-F676 HydrophobicContact CG-CE2 4.12Å; K670-F676 HydrophobicContact CG-CZ 4.3Å; K670-H684 WeakPolarHBondContact CE-O 3.34Å; K670-H684 PolarHBondContact NZ-O 3.19Å
671	L	73.9	Confident	72.6	Confident	103 Å²	103	63.9 Å²	63.9	54%	0.539	37%	0.365	S	S	.	.	H	α-helix	trans	-62.4	-32.9	177	-171.6	76.4	0	0	0	111.9	S667 M668 D673	S667-L671 WeakPolarHBondContact O-CB 3.09Å; S667-L671 PolarHBondContact O-N 2.84Å; M668-L671 HydrophobicContact CE-CD2 4.21Å; M668-L671 PolarHBondContact O-N 2.9Å; M668-L671 HydrophobicContact SD-CD2 3.99Å; L671-D673 VanDerWaalsContact C-N 3.34Å
672	L	72.9	Confident	72.3	Confident	5 Å²	5	64.1 Å²	64.1	3%	0.026	38%	0.376	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92	8.4	179.7	-68	163.3	0	0	0	113	W648 I659 W661 L664 M668 C669 K670 G674	W648-L672 PolarHBondContact NE1-O 2.92Å; I659-L672 HydrophobicContact CD1-CD2 4.38Å; I659-L672 HydrophobicContact CG2-CD1 4.01Å; W661-L672 HydrophobicContact CH2-CB 4.48Å; L664-L672 HydrophobicContact CD1-CD1 4.14Å; L664-L672 HydrophobicContact CD2-CD1 3.93Å; M668-L672 WeakPolarHBondContact O-CB 3.37Å; M668-L672 WeakPolarHBondContact O-CD1 3.26Å; M668-L672 WeakPolarHBondContact O-CG 3.34Å; M668-L672 PolarHBondContact O-N 3.2Å; C669-L672 PolarHBondContact O-N 3.12Å; K670-L672 PolarHBondContact O-N 3.03Å; L672-G674 VanDerWaalsContact C-N 3.31Å; L672-G674 PolarHBondContact O-N 3.41Å
673	D	72.7	Confident	72.1	Confident	98 Å²	98	69.2 Å²	69.2	52%	0.524	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.7	43.6	-174.7	-81	-38.1	0	0	0	113.5	L644 C669 K670 L671	L644-D673 HydrophobicContact CD2-CB 3.96Å; L644-D673 WeakPolarHBondContact CD2-OD2 3.31Å; C669-D673 PolarHBondContact O-N 3.31Å; K670-D673 PolarHBondContact O-N 2.99Å; L671-D673 VanDerWaalsContact C-N 3.34Å
674	G	75.5	Confident	71.6	Confident	13 Å²	13	69.4 Å²	69.4	13%	0.134	39%	0.386	C	S	.	.	P	Polyproline II helix	trans	-78.5	149.5	173.1	0	0	0	0	0	113.6	C669 L672	C669-G674 PolarHBondContact O-N 2.87Å; L672-G674 VanDerWaalsContact C-N 3.31Å; L672-G674 PolarHBondContact O-N 3.41Å
675	E	76.4	Confident	71.5	Confident	104 Å²	104	68.2 Å²	68.2	49%	0.486	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	144.3	173.6	-69.4	-172.5	160.9	0	0	110.8	C634 S635 P637	C634-E675 CarbonylContact C-O 3.59Å; S635-E675 PolarHBondContact N-O 3Å; S635-E675 PolarHBondContact O-N 3.5Å; S635-E675 PolarHBondContact OG-O 2.78Å; P637-E675 HydrophobicContact CB-CG 4.41Å
676	F	77.9	Confident	71.3	Confident	42 Å²	42	65.1 Å²	65.1	18%	0.184	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	117.9	177.2	-68.3	-75.7	0	0	0	110.1	C634 V666 C669 K670 C681	C634-F676 HydrophobicContact CB-CE1 4.49Å; V666-F676 HydrophobicContact CG1-CE1 4.27Å; V666-F676 HydrophobicContact CG1-CZ 3.79Å; C669-F676 HydrophobicContact CB-CE1 4.14Å; C669-F676 HydrophobicContact CB-CZ 4Å; C669-F676 VanDerWaalsContact SG-CE1 3.53Å; C669-F676 VanDerWaalsContact SG-CZ 3.52Å; K670-F676 HydrophobicContact CG-CE2 4.12Å; K670-F676 HydrophobicContact CG-CZ 4.3Å; F676-C681 HydrophobicContact CB-CB 3.87Å
677	V	75.1	Confident	71.2	Confident	87 Å²	87	65 Å²	65	53%	0.527	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	127.3	-177.1	179.2	0	0	0	0	110.3	Q633 S635 C681	Q633-V677 PolarHBondContact N-O 3.19Å; Q633-V677 VanDerWaalsContact N-O 3.11Å; Q633-V677 PolarHBondContact O-N 3.49Å; S635-V677 WeakPolarHBondContact OG-CG2 3.45Å; V677-C681 PolarHBondContact O-SG 3.12Å
678	G	74.5	Confident	71	Confident	30 Å²	30	64.7 Å²	64.7	31%	0.309	35%	0.353	S	S	.	.	S	Bend	trans	145.9	160.1	174.7	0	0	0	0	0	113.6	S631 A680 C681	S631-G678 WeakPolarHBondContact O-CA 3.48Å; G678-A680 PolarHBondContact O-N 2.88Å; G678-C681 WeakPolarHBondContact O-CB 3.48Å; G678-C681 PolarHBondContact O-N 2.86Å
679	P	67.8	Low	71.1	Confident	87 Å²	87	64.6 Å²	64.6	57%	0.565	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.6	-12.1	-179.2	28.4	-34.8	0	0	0	113.6	F629	F629-P679 VanDerWaalsContact O-CG 3.25Å; F629-P679 WeakPolarHBondContact O-CG 3.42Å
680	A	66.1	Low	71.2	Confident	20 Å²	20	69.1 Å²	69.1	17%	0.165	38%	0.383	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.3	9.1	174	0	0	0	0	0	113.3	Y630 C632 G678 Y687	Y630-A680 HydrophobicContact CD1-CB 4.38Å; C632-A680 HydrophobicContact CB-CB 4.3Å; G678-A680 PolarHBondContact O-N 2.88Å; A680-Y687 VanDerWaalsContact O-CB 3.3Å; A680-Y687 WeakPolarHBondContact O-CB 3.4Å; A680-Y687 PolarHBondContact O-N 3.24Å
681	C	70.8	Confident	71.7	Confident	28 Å²	28	64.5 Å²	64.5	19%	0.189	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	136.7	175.7	-55.7	0	0	0	0	111.1	C632 F676 V677 G678	C632-C681 WeakPolarHBondContact CA-SG 3.47Å; C632-C681 HydrophobicContact CB-CB 4.19Å; C632-C681 WeakPolarHBondContact CB-SG 3.42Å; C632-C681 VanDerWaalsContact SG-CA 3.52Å; C632-C681 WeakPolarHBondContact SG-CB 3.29Å; C632-C681 CovalentContact SG-SG 2.03Å; C632-C681 PolarHBondContact SG-SG 2.74Å; F676-C681 HydrophobicContact CB-CB 3.87Å; V677-C681 PolarHBondContact O-SG 3.12Å; G678-C681 WeakPolarHBondContact O-CB 3.48Å; G678-C681 PolarHBondContact O-N 2.86Å
682	G	66.7	Low	72.2	Confident	33 Å²	33	60.9 Å²	60.9	34%	0.34	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	-179.8	166	0	0	0	0	0	112.3	H684 G685	G682-H684 PolarHBondContact O-N 3.21Å; G682-G685 PolarHBondContact N-O 2.97Å; G682-G685 PolarHBondContact O-N 3.44Å
683	H	64.1	Low	72.9	Confident	191 Å²	191	65.8 Å²	65.8	88%	0.884	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	-20.9	-178.9	-85.1	-72.6	0	0	0	115.2
684	H	61.8	Low	73.8	Confident	142 Å²	142	62.5 Å²	62.5	66%	0.657	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-124.4	4.1	-174.7	-64.1	-45.3	0	0	0	114.7	K670 G682	K670-H684 WeakPolarHBondContact CE-O 3.34Å; K670-H684 PolarHBondContact NZ-O 3.19Å; G682-H684 PolarHBondContact O-N 3.21Å
685	G	69.3	Low	74.5	Confident	12 Å²	12	61.9 Å²	61.9	12%	0.124	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	150.1	-173.3	-179.4	0	0	0	0	0	114.4	G682	G682-G685 PolarHBondContact N-O 2.97Å; G682-G685 PolarHBondContact O-N 3.44Å
686	P	69.3	Low	75.2	Confident	52 Å²	52	59.7 Å²	59.7	34%	0.338	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	144.7	176.9	27.2	-33.7	0	0	0	111.8	C632 V666	C632-P686 HydrophobicContact CB-CB 4.08Å; V666-P686 HydrophobicContact CG2-CG 3.97Å
687	Y	69.4	Low	75.9	Confident	64 Å²	64	61.9 Å²	61.9	25%	0.251	34%	0.342	S	S	.	.			trans	-65.4	129.7	176.2	-176	-94.6	0	0	0	111.3	P617 V618 N619 A680 P689	P617-Y687 WeakPolarHBondContact O-CE2 3.08Å; V618-Y687 VanDerWaalsContact CA-OH 3.31Å; V618-Y687 WeakPolarHBondContact CA-OH 3.48Å; N619-Y687 HydrophobicContact CB-CD1 4.28Å; N619-Y687 HydrophobicContact CB-CD2 3.97Å; N619-Y687 HydrophobicContact CB-CE1 3.84Å; N619-Y687 HydrophobicContact CB-CE2 3.47Å; N619-Y687 VanDerWaalsContact CB-CE2 3.47Å; N619-Y687 HydrophobicContact CB-CG 4.35Å; N619-Y687 VanDerWaalsContact CB-CZ 3.45Å; N619-Y687 PolarHBondContact N-OH 2.9Å; A680-Y687 VanDerWaalsContact O-CB 3.3Å; A680-Y687 WeakPolarHBondContact O-CB 3.4Å; A680-Y687 PolarHBondContact O-N 3.24Å; Y687-P689 HydrophobicContact CD1-CB 4.4Å; Y687-P689 VanDerWaalsContact CE1-CA 3.49Å; Y687-P689 HydrophobicContact CE1-CB 3.85Å
688	I	68	Low	76.7	Confident	75 Å²	75	57.8 Å²	57.8	39%	0.385	32%	0.318	S	S	.	.			trans	-109.3	108.7	174.9	-54.1	163.1	0	0	0	107.4	Y616 V691 P748	Y616-I688 HydrophobicContact CD1-CB 4.47Å; Y616-I688 HydrophobicContact CD1-CD1 4.16Å; Y616-I688 HydrophobicContact CE1-CD1 3.79Å; I688-V691 HydrophobicContact CB-CG2 4.37Å; I688-V691 HydrophobicContact CG2-CG2 3.51Å; I688-P748 HydrophobicContact CG2-CG 4.38Å
689	P	70.5	Confident	77.6	Confident	72 Å²	72	56.4 Å²	56.4	47%	0.468	30%	0.303	S	S	.	.	S	Bend	trans	-65.7	154.7	-177.8	26.4	-32.9	0	0	0	112.5	Y687 V691	Y687-P689 HydrophobicContact CD1-CB 4.4Å; Y687-P689 VanDerWaalsContact CE1-CA 3.49Å; Y687-P689 HydrophobicContact CE1-CB 3.85Å; P689-V691 PolarHBondContact O-N 3.48Å
690	D	77.7	Confident	78.8	Confident	96 Å²	96	56.1 Å²	56.1	51%	0.513	29%	0.293	S	S	.	.	S	Bend	trans	65.1	-11.1	166.6	-50.6	-35.8	0	0	0	118.4	L692 F693 W694	D690-L692 PolarHBondContact O-N 3.5Å; D690-F693 PolarHBondContact O-N 3.36Å; D690-W694 WeakPolarHBondContact O-CB 3.22Å; D690-W694 PolarHBondContact O-N 2.94Å
691	V	84.3	Confident	80.2	Confident	1 Å²	1	58 Å²	58	1%	0.006	30%	0.302	C	S	.	.	H	α-helix	trans	-61.3	-40.5	-179.2	175.6	0	0	0	0	112.4	Y616 I688 P689 S695 I747 P748	Y616-V691 HydrophobicContact CD1-CB 4.26Å; Y616-V691 HydrophobicContact CD1-CG1 3.99Å; Y616-V691 HydrophobicContact CD2-CG1 4.17Å; Y616-V691 HydrophobicContact CE1-CG1 4.19Å; Y616-V691 HydrophobicContact CE2-CG1 4.38Å; Y616-V691 HydrophobicContact CG-CB 4.41Å; Y616-V691 HydrophobicContact CG-CG1 3.98Å; I688-V691 HydrophobicContact CB-CG2 4.37Å; I688-V691 HydrophobicContact CG2-CG2 3.51Å; P689-V691 PolarHBondContact O-N 3.48Å; V691-S695 VanDerWaalsContact O-CB 3.28Å; V691-S695 WeakPolarHBondContact O-CB 3.29Å; V691-S695 PolarHBondContact O-N 3.07Å; V691-S695 PolarHBondContact O-OG 2.88Å; V691-I747 HydrophobicContact CG2-CG2 4.33Å; V691-P748 HydrophobicContact CG2-CG 4.11Å
692	L	85.6	Confident	81.2	Confident	26 Å²	26	56.6 Å²	56.6	14%	0.136	29%	0.293	C	S	.	.	H	α-helix	trans	-67.4	-49.1	179.8	-177.1	62.2	0	0	0	111.8	G613 V618 D690 W694 S695 I696	G613-L692 VanDerWaalsContact CA-CD1 3.43Å; V618-L692 HydrophobicContact CG2-CB 4.44Å; V618-L692 HydrophobicContact CG2-CD2 3.59Å; D690-L692 PolarHBondContact O-N 3.5Å; L692-W694 VanDerWaalsContact C-N 3.31Å; L692-W694 PolarHBondContact O-N 3.24Å; L692-S695 WeakPolarHBondContact O-CB 3.31Å; L692-S695 PolarHBondContact O-N 3.47Å; L692-S695 VanDerWaalsContact O-N 3.16Å; L692-I696 HydrophobicContact CD1-CD1 4.22Å; L692-I696 HydrophobicContact CD1-CG1 4.42Å; L692-I696 HydrophobicContact CG-CD1 3.98Å; L692-I696 WeakPolarHBondContact O-CG1 3.22Å; L692-I696 PolarHBondContact O-N 2.87Å
693	F	88.4	Confident	82.5	Confident	109 Å²	109	56.7 Å²	56.7	48%	0.478	28%	0.284	S	S	.	.	H	α-helix	trans	-60.5	-43.7	179	-68.2	-64.2	0	0	0	111	V618 D690 S695 I696 I697	V618-F693 HydrophobicContact CG1-CE2 3.91Å; V618-F693 HydrophobicContact CG1-CZ 4Å; V618-F693 HydrophobicContact CG2-CE2 4.02Å; V618-F693 HydrophobicContact CG2-CZ 4.05Å; D690-F693 PolarHBondContact O-N 3.36Å; F693-S695 VanDerWaalsContact C-N 3.34Å; F693-S695 PolarHBondContact O-N 3.04Å; F693-I696 PolarHBondContact O-N 3.11Å; F693-I697 VanDerWaalsContact O-CG1 3.26Å; F693-I697 WeakPolarHBondContact O-CG1 3.38Å; F693-I697 PolarHBondContact O-N 3.04Å
694	W	90.6	Very high	83.9	Confident	28 Å²	28	53.8 Å²	53.8	11%	0.106	27%	0.27	C	S	.	.	H	α-helix	trans	-61.4	-41.9	175.2	-172.6	-120.7	0	0	0	112.5	D690 L692 I696 I697 L698 V741 D742 M745 I747	D690-W694 WeakPolarHBondContact O-CB 3.22Å; D690-W694 PolarHBondContact O-N 2.94Å; L692-W694 VanDerWaalsContact C-N 3.31Å; L692-W694 PolarHBondContact O-N 3.24Å; W694-I696 PolarHBondContact O-N 2.03Å; W694-I697 HydrophobicContact CE3-CD1 4.41Å; W694-I697 HydrophobicContact CE3-CG2 4.5Å; W694-I697 HydrophobicContact CZ3-CG2 4.25Å; W694-I697 PolarHBondContact O-N 3.45Å; W694-L698 HydrophobicContact CD2-CG 4.42Å; W694-L698 HydrophobicContact CZ2-CD1 4.48Å; W694-L698 HydrophobicContact CZ2-CD2 3.92Å; W694-L698 HydrophobicContact CZ2-CG 4.18Å; W694-L698 WeakPolarHBondContact O-CG 3.48Å; W694-L698 PolarHBondContact O-N 3.12Å; W694-V741 HydrophobicContact CH2-CG1 3.62Å; W694-V741 HydrophobicContact CZ2-CG1 3.9Å; W694-D742 PolarHBondContact NE1-OD1 3.17Å; W694-M745 HydrophobicContact CH2-CB 4.1Å; W694-M745 HydrophobicContact CH2-CG 3.5Å; W694-M745 HydrophobicContact CZ2-CB 3.79Å; W694-M745 HydrophobicContact CZ2-CG 3.68Å; W694-M745 HydrophobicContact CZ3-CG 4.21Å; W694-I747 HydrophobicContact CB-CD1 4.08Å; W694-I747 HydrophobicContact CB-CG2 4.24Å; W694-I747 HydrophobicContact CD2-CD1 3.87Å; W694-I747 HydrophobicContact CE3-CD1 4.21Å; W694-I747 HydrophobicContact CG-CB 4.28Å; W694-I747 HydrophobicContact CG-CD1 3.79Å; W694-I747 HydrophobicContact CG-CG2 4.22Å
695	S	89.8	Confident	85.4	Confident	0 Å²	0	49 Å²	49	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-63.9	-41.1	177.1	-62.2	0	0	0	0	112.6	V691 L692 F693 L698 F699 P902	V691-S695 VanDerWaalsContact O-CB 3.28Å; V691-S695 WeakPolarHBondContact O-CB 3.29Å; V691-S695 PolarHBondContact O-N 3.07Å; V691-S695 PolarHBondContact O-OG 2.88Å; L692-S695 WeakPolarHBondContact O-CB 3.31Å; L692-S695 PolarHBondContact O-N 3.47Å; L692-S695 VanDerWaalsContact O-N 3.16Å; F693-S695 VanDerWaalsContact C-N 3.34Å; F693-S695 PolarHBondContact O-N 3.04Å; S695-L698 PolarHBondContact O-N 3.27Å; S695-F699 VanDerWaalsContact O-CB 3.3Å; S695-F699 WeakPolarHBondContact O-CB 3.43Å; S695-F699 PolarHBondContact O-N 3.14Å; S695-P902 WeakPolarHBondContact O-CB 3.1Å
696	I	91.5	Very high	86.3	Confident	59 Å²	59	48.4 Å²	48.4	30%	0.303	24%	0.242	S	C	.	.	H	α-helix	trans	-64.6	-42.8	175.5	-69.1	169.9	0	0	0	110.7	L609 L692 F693 W694 F699 F700	L609-I696 HydrophobicContact CD1-CG1 4.13Å; L692-I696 HydrophobicContact CD1-CD1 4.22Å; L692-I696 HydrophobicContact CD1-CG1 4.42Å; L692-I696 HydrophobicContact CG-CD1 3.98Å; L692-I696 WeakPolarHBondContact O-CG1 3.22Å; L692-I696 PolarHBondContact O-N 2.87Å; F693-I696 PolarHBondContact O-N 3.11Å; W694-I696 PolarHBondContact O-N 2.03Å; I696-F699 PolarHBondContact O-N 3.3Å; I696-F700 HydrophobicContact CG2-CD2 3.73Å; I696-F700 HydrophobicContact CG2-CE2 3.88Å; I696-F700 WeakPolarHBondContact O-CD2 3.34Å; I696-F700 PolarHBondContact O-N 2.84Å
697	I	93.1	Very high	87.2	Confident	87 Å²	87	47 Å²	47	45%	0.446	23%	0.234	S	C	.	.	H	α-helix	trans	-61.2	-50.5	176.5	-69.7	164.1	0	0	0	110.2	F693 W694 F699 T701	F693-I697 VanDerWaalsContact O-CG1 3.26Å; F693-I697 WeakPolarHBondContact O-CG1 3.38Å; F693-I697 PolarHBondContact O-N 3.04Å; W694-I697 HydrophobicContact CE3-CD1 4.41Å; W694-I697 HydrophobicContact CE3-CG2 4.5Å; W694-I697 HydrophobicContact CZ3-CG2 4.25Å; W694-I697 PolarHBondContact O-N 3.45Å; I697-F699 VanDerWaalsContact C-N 3.3Å; I697-F699 PolarHBondContact O-N 2.96Å; I697-T701 WeakPolarHBondContact O-CB 3.32Å; I697-T701 PolarHBondContact O-N 3.38Å; I697-T701 PolarHBondContact O-OG1 3.03Å
698	L	92.1	Very high	88.2	Confident	2 Å²	2	48.8 Å²	48.8	1%	0.01	24%	0.243	C	C	.	.	H	α-helix	trans	-58.5	-42.4	177.5	-75	177	0	0	0	111.7	W694 S695 T702 M738 D742 P900 P902 V903	W694-L698 HydrophobicContact CD2-CG 4.42Å; W694-L698 HydrophobicContact CZ2-CD1 4.48Å; W694-L698 HydrophobicContact CZ2-CD2 3.92Å; W694-L698 HydrophobicContact CZ2-CG 4.18Å; W694-L698 WeakPolarHBondContact O-CG 3.48Å; W694-L698 PolarHBondContact O-N 3.12Å; S695-L698 PolarHBondContact O-N 3.27Å; L698-T702 WeakPolarHBondContact O-CB 3.32Å; L698-T702 PolarHBondContact O-N 3.39Å; L698-T702 PolarHBondContact O-OG1 3.31Å; L698-M738 HydrophobicContact CD2-CB 4.49Å; L698-M738 HydrophobicContact CD2-SD 4.35Å; L698-D742 HydrophobicContact CD1-CB 4.32Å; L698-P900 HydrophobicContact CD1-CB 4.32Å; L698-P900 HydrophobicContact CD1-CG 4.22Å; L698-P902 HydrophobicContact CB-CB 4.24Å; L698-V903 HydrophobicContact CB-CG2 4.09Å; L698-V903 HydrophobicContact CD1-CG2 4.45Å; L698-V903 HydrophobicContact CD2-CG2 4.2Å; L698-V903 HydrophobicContact CG-CG2 4.5Å
699	F	92.4	Very high	89.2	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-60.2	-57.2	179.3	175.9	-96.4	0	0	0	112.5	L606 L609 S695 I696 I697 T702 F703 Y905 G906 L909	L606-F699 HydrophobicContact CD2-CE1 4.28Å; L606-F699 HydrophobicContact CD2-CZ 4.19Å; L609-F699 HydrophobicContact CD1-CB 4.32Å; L609-F699 HydrophobicContact CD1-CG 4.37Å; L609-F699 HydrophobicContact CD2-CD1 3.68Å; L609-F699 HydrophobicContact CD2-CD2 4.49Å; L609-F699 HydrophobicContact CD2-CE1 3.86Å; L609-F699 HydrophobicContact CD2-CG 4.01Å; L609-F699 HydrophobicContact CD2-CZ 4.33Å; S695-F699 VanDerWaalsContact O-CB 3.3Å; S695-F699 WeakPolarHBondContact O-CB 3.43Å; S695-F699 PolarHBondContact O-N 3.14Å; I696-F699 PolarHBondContact O-N 3.3Å; I697-F699 VanDerWaalsContact C-N 3.3Å; I697-F699 PolarHBondContact O-N 2.96Å; F699-T702 PolarHBondContact O-N 3.44Å; F699-F703 PolarHBondContact O-N 3.32Å; F699-Y905 WeakPolarHBondContact CE2-O 3.21Å; F699-G906 VanDerWaalsContact CD2-N 3.32Å; F699-L909 HydrophobicContact CE1-CD2 3.77Å; F699-L909 HydrophobicContact CE2-CB 4.43Å; F699-L909 HydrophobicContact CZ-CB 4.06Å; F699-L909 HydrophobicContact CZ-CD2 3.7Å; F699-L909 HydrophobicContact CZ-CG 4.37Å
700	F	94.4	Very high	89.8	Confident	82 Å²	82	46 Å²	46	36%	0.36	22%	0.222	S	C	.	.	H	α-helix	trans	-70.9	-38.8	-177.2	-77.7	-67.1	0	0	0	112.3	I696 T702 F703 F704	I696-F700 HydrophobicContact CG2-CD2 3.73Å; I696-F700 HydrophobicContact CG2-CE2 3.88Å; I696-F700 WeakPolarHBondContact O-CD2 3.34Å; I696-F700 PolarHBondContact O-N 2.84Å; F700-T702 VanDerWaalsContact C-N 3.3Å; F700-T702 PolarHBondContact O-N 3.03Å; F700-F703 WeakPolarHBondContact O-CB 3.27Å; F700-F703 PolarHBondContact O-N 3.13Å; F700-F703 VanDerWaalsContact O-N 3.15Å; F700-F704 HydrophobicContact CB-CD2 4.25Å; F700-F704 HydrophobicContact CB-CE2 4.1Å; F700-F704 HydrophobicContact CD1-CE2 4.25Å; F700-F704 WeakPolarHBondContact O-CD2 3.23Å; F700-F704 PolarHBondContact O-N 3.4Å
701	T	94.2	Very high	90	Very high	58 Å²	58	46 Å²	46	36%	0.356	22%	0.219	S	C	.	.	H	α-helix	trans	-63.4	-39.3	178.6	-50.6	0	0	0	0	110.9	I697 F703 F704 L705 M738	I697-T701 WeakPolarHBondContact O-CB 3.32Å; I697-T701 PolarHBondContact O-N 3.38Å; I697-T701 PolarHBondContact O-OG1 3.03Å; T701-F703 PolarHBondContact O-N 3.08Å; T701-F704 PolarHBondContact O-N 3.39Å; T701-L705 WeakPolarHBondContact O-CB 3.44Å; T701-L705 PolarHBondContact O-N 3.43Å; T701-M738 HydrophobicContact CG2-CE 3.41Å; T701-M738 VanDerWaalsContact CG2-CE 3.41Å; T701-M738 HydrophobicContact CG2-SD 3.89Å
702	T	93	Very high	90	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-60.3	-44.1	173.7	-61.4	0	0	0	0	111.9	L698 F699 F700 S706 T734 M738 V903 V907	L698-T702 WeakPolarHBondContact O-CB 3.32Å; L698-T702 PolarHBondContact O-N 3.39Å; L698-T702 PolarHBondContact O-OG1 3.31Å; F699-T702 PolarHBondContact O-N 3.44Å; F700-T702 VanDerWaalsContact C-N 3.3Å; F700-T702 PolarHBondContact O-N 3.03Å; T702-S706 VanDerWaalsContact O-CB 3.27Å; T702-S706 WeakPolarHBondContact O-CB 3.28Å; T702-S706 PolarHBondContact O-N 3.12Å; T702-S706 PolarHBondContact O-OG 2.79Å; T702-T734 HydrophobicContact CG2-CG2 3.88Å; T702-T734 WeakPolarHBondContact O-CG2 3.47Å; T702-M738 WeakPolarHBondContact OG1-CG 3.27Å; T702-V903 HydrophobicContact CG2-CG1 3.99Å; T702-V903 WeakPolarHBondContact CG2-O 3.27Å; T702-V907 HydrophobicContact CG2-CG2 3.65Å
703	F	92.8	Very high	89.5	Confident	35 Å²	35	47.5 Å²	47.5	15%	0.154	22%	0.224	C	C	.	.	H	α-helix	trans	-63.5	-50.3	178.1	170.2	-101.9	0	0	0	112	F699 F700 T701 S706 S707 L909 V913	F699-F703 PolarHBondContact O-N 3.32Å; F700-F703 WeakPolarHBondContact O-CB 3.27Å; F700-F703 PolarHBondContact O-N 3.13Å; F700-F703 VanDerWaalsContact O-N 3.15Å; T701-F703 PolarHBondContact O-N 3.08Å; F703-S706 PolarHBondContact O-N 2.68Å; F703-S707 WeakPolarHBondContact O-CB 3.29Å; F703-S707 PolarHBondContact O-N 3.45Å; F703-L909 HydrophobicContact CB-CD2 4.25Å; F703-L909 HydrophobicContact CD1-CD2 4.38Å; F703-L909 HydrophobicContact CD2-CB 4.2Å; F703-L909 HydrophobicContact CD2-CD2 3.79Å; F703-L909 HydrophobicContact CD2-CG 3.79Å; F703-L909 HydrophobicContact CE2-CD2 4.21Å; F703-L909 HydrophobicContact CE2-CG 4.03Å; F703-L909 HydrophobicContact CG-CD2 3.88Å; F703-L909 HydrophobicContact CG-CG 4.39Å; F703-V913 HydrophobicContact CE2-CB 4.15Å; F703-V913 HydrophobicContact CE2-CG1 4.44Å; F703-V913 HydrophobicContact CE2-CG2 4.05Å; F703-V913 HydrophobicContact CZ-CG1 4.44Å; F703-V913 HydrophobicContact CZ-CG2 4.38Å
704	F	93.9	Very high	88.7	Confident	130 Å²	130	47.8 Å²	47.8	57%	0.57	24%	0.235	S	C	*	.	H	α-helix	trans	-66	-43.8	-178.9	-72.6	-61.7	0	0	0	112.1	F700 T701 S706 S707 F708	F700-F704 HydrophobicContact CB-CD2 4.25Å; F700-F704 HydrophobicContact CB-CE2 4.1Å; F700-F704 HydrophobicContact CD1-CE2 4.25Å; F700-F704 WeakPolarHBondContact O-CD2 3.23Å; F700-F704 PolarHBondContact O-N 3.4Å; T701-F704 PolarHBondContact O-N 3.39Å; F704-S706 PolarHBondContact O-N 2.97Å; F704-S707 PolarHBondContact O-N 2.97Å; F704-F708 WeakPolarHBondContact O-CB 3.15Å; F704-F708 PolarHBondContact O-N 3.44Å
705	L	92.8	Very high	88.1	Confident	40 Å²	40	49.2 Å²	49.2	21%	0.209	24%	0.243	C	C	.	.	H	α-helix	trans	-64.6	-41.3	178.7	-174.1	57.8	0	0	0	111.5	T701 S707 F708 L709 T734 I737 M738	T701-L705 WeakPolarHBondContact O-CB 3.44Å; T701-L705 PolarHBondContact O-N 3.43Å; L705-S707 PolarHBondContact O-N 3.05Å; L705-F708 PolarHBondContact O-N 3.34Å; L705-L709 HydrophobicContact CD1-CD1 4.09Å; L705-L709 HydrophobicContact CD1-CG 4.09Å; L705-L709 HydrophobicContact CG-CD1 4.01Å; L705-L709 HydrophobicContact CG-CG 4.44Å; L705-L709 WeakPolarHBondContact O-CB 3.08Å; L705-L709 WeakPolarHBondContact O-CG 3.13Å; L705-L709 PolarHBondContact O-N 3.22Å; L705-T734 HydrophobicContact CB-CG2 3.93Å; L705-T734 HydrophobicContact CD2-CG2 4.02Å; L705-T734 HydrophobicContact CG-CG2 4.05Å; L705-I737 HydrophobicContact CD2-CD1 4.31Å; L705-I737 HydrophobicContact CD2-CG2 4.26Å; L705-M738 HydrophobicContact CD2-CE 3.52Å
706	S	89.3	Confident	87.4	Confident	0 Å²	0	60.1 Å²	60.1	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-61.8	-43.7	174.7	-63.2	0	0	0	0	111.8	T702 F703 F704 K710 T734	T702-S706 VanDerWaalsContact O-CB 3.27Å; T702-S706 WeakPolarHBondContact O-CB 3.28Å; T702-S706 PolarHBondContact O-N 3.12Å; T702-S706 PolarHBondContact O-OG 2.79Å; F703-S706 PolarHBondContact O-N 2.68Å; F704-S706 PolarHBondContact O-N 2.97Å; S706-K710 WeakPolarHBondContact O-CB 3.3Å; S706-K710 PolarHBondContact O-N 2.86Å; S706-K710 VanDerWaalsContact O-N 3.14Å; S706-T734 WeakPolarHBondContact OG-CG2 3.42Å; S706-T734 PolarHBondContact OG-OG1 3.31Å
707	S	88.1	Confident	86.6	Confident	23 Å²	23	65.3 Å²	65.3	16%	0.161	30%	0.301	C	S	.	.	H	α-helix	trans	-65.2	-43.7	176.9	177.7	0	0	0	0	111.9	F703 F704 L705 K710 Q711	F703-S707 WeakPolarHBondContact O-CB 3.29Å; F703-S707 PolarHBondContact O-N 3.45Å; F704-S707 PolarHBondContact O-N 2.97Å; L705-S707 PolarHBondContact O-N 3.05Å; S707-K710 PolarHBondContact O-N 3.21Å; S707-Q711 VanDerWaalsContact O-CG 3.31Å; S707-Q711 WeakPolarHBondContact O-CG 3.16Å; S707-Q711 PolarHBondContact O-N 3.16Å; S707-Q711 PolarHBondContact OG-NE2 2.79Å; S707-Q711 VanDerWaalsContact OG-NE2 3.07Å
708	F	90.3	Very high	86	Confident	101 Å²	101	67.6 Å²	67.6	44%	0.443	31%	0.308	S	S	.	.	H	α-helix	trans	-62.6	-51.7	178.9	176.4	-104.4	0	0	0	111.7	F704 L705 K710 Q711 F712	F704-F708 WeakPolarHBondContact O-CB 3.15Å; F704-F708 PolarHBondContact O-N 3.44Å; L705-F708 PolarHBondContact O-N 3.34Å; F708-K710 PolarHBondContact O-N 3.06Å; F708-Q711 PolarHBondContact O-N 3.12Å; F708-Q711 VanDerWaalsContact O-N 3.08Å; F708-F712 PolarHBondContact O-N 2.89Å
709	L	87.9	Confident	85.4	Confident	19 Å²	19	71.6 Å²	71.6	10%	0.099	33%	0.334	C	S	.	.	H	α-helix	trans	-61.8	-26.7	177.9	-70	173	0	0	0	112.7	L705 F712 I726 A730 L733 T734	L705-L709 HydrophobicContact CD1-CD1 4.09Å; L705-L709 HydrophobicContact CD1-CG 4.09Å; L705-L709 HydrophobicContact CG-CD1 4.01Å; L705-L709 HydrophobicContact CG-CG 4.44Å; L705-L709 WeakPolarHBondContact O-CB 3.08Å; L705-L709 WeakPolarHBondContact O-CG 3.13Å; L705-L709 PolarHBondContact O-N 3.22Å; L709-F712 WeakPolarHBondContact O-CB 2.96Å; L709-I726 HydrophobicContact CD2-CG2 3.89Å; L709-A730 HydrophobicContact CB-CB 3.53Å; L709-L733 HydrophobicContact CD1-CD2 3.49Å; L709-L733 VanDerWaalsContact CD1-CD2 3.49Å; L709-L733 HydrophobicContact CD2-CD2 4.41Å; L709-T734 WeakPolarHBondContact CD1-OG1 3.34Å
710	K	83.8	Confident	84.5	Confident	70 Å²	70	76.2 Å²	76.2	30%	0.304	36%	0.362	S	S	.	.	H	α-helix	trans	-77	-41.3	172.8	-157.3	74.9	-172.5	172.6	0	112.8	S706 S707 F708 F712 K713 S727 A730 Y910	S706-K710 WeakPolarHBondContact O-CB 3.3Å; S706-K710 PolarHBondContact O-N 2.86Å; S706-K710 VanDerWaalsContact O-N 3.14Å; S707-K710 PolarHBondContact O-N 3.21Å; F708-K710 PolarHBondContact O-N 3.06Å; K710-F712 PolarHBondContact O-N 3.14Å; K710-K713 WeakPolarHBondContact O-CB 3.45Å; K710-K713 PolarHBondContact O-N 3.17Å; K710-S727 PolarHBondContact NZ-O 3.34Å; K710-A730 HydrophobicContact CD-CB 4.43Å; K710-Y910 WeakPolarHBondContact CD-OH 3.4Å; K710-Y910 WeakPolarHBondContact CG-OH 3.21Å
711	Q	82.8	Confident	83.5	Confident	96 Å²	96	80.5 Å²	80.5	45%	0.449	38%	0.381	S	S	.	.	H	α-helix	trans	-67.1	-26	176.1	-71.8	176.9	28	0	0	112.5	S707 F708 K713 T714	S707-Q711 VanDerWaalsContact O-CG 3.31Å; S707-Q711 WeakPolarHBondContact O-CG 3.16Å; S707-Q711 PolarHBondContact O-N 3.16Å; S707-Q711 PolarHBondContact OG-NE2 2.79Å; S707-Q711 VanDerWaalsContact OG-NE2 3.07Å; F708-Q711 PolarHBondContact O-N 3.12Å; F708-Q711 VanDerWaalsContact O-N 3.08Å; Q711-K713 PolarHBondContact O-N 2.91Å; Q711-T714 PolarHBondContact O-N 3.26Å; Q711-T714 PolarHBondContact O-OG1 2.93Å
712	F	82.5	Confident	82.8	Confident	18 Å²	18	80.5 Å²	80.5	8%	0.079	38%	0.381	C	S	.	.	G	3₁₀ helix	trans	-51.9	-26.5	172.1	-164.3	-110.1	0	0	0	112.7	F708 L709 K710 T714 E715 F718 R723 I726	F708-F712 PolarHBondContact O-N 2.89Å; L709-F712 WeakPolarHBondContact O-CB 2.96Å; K710-F712 PolarHBondContact O-N 3.14Å; F712-T714 PolarHBondContact O-N 2.94Å; F712-E715 PolarHBondContact O-N 3.27Å; F712-F718 HydrophobicContact CE1-CD2 4.1Å; F712-F718 AromaticContact CE2-CD2 3.88Å; F712-F718 HydrophobicContact CE2-CD2 3.88Å; F712-F718 HydrophobicContact CE2-CE2 4.04Å; F712-F718 HydrophobicContact CZ-CB 4.42Å; F712-F718 AromaticContact CZ-CD2 3.19Å; F712-F718 HydrophobicContact CZ-CD2 3.19Å; F712-F718 AromaticContact CZ-CE2 3.54Å; F712-F718 HydrophobicContact CZ-CE2 3.54Å; F712-F718 AromaticContact CZ-CG 3.98Å; F712-F718 HydrophobicContact CZ-CG 3.98Å; F712-R723 HydrophobicContact CD1-CG 4.01Å; F712-R723 HydrophobicContact CE1-CG 4.33Å; F712-R723 WeakPolarHBondContact O-CD 2.95Å; F712-R723 WeakPolarHBondContact O-CG 3.37Å; F712-I726 HydrophobicContact CD1-CB 4.32Å; F712-I726 HydrophobicContact CD1-CG2 4.02Å; F712-I726 HydrophobicContact CE1-CB 4.42Å; F712-I726 HydrophobicContact CE1-CD1 3.97Å; F712-I726 HydrophobicContact CE1-CG2 4.31Å
713	K	75.2	Confident	82.2	Confident	40 Å²	40	83.2 Å²	83.2	17%	0.174	39%	0.391	C	S	.	.	G	3₁₀ helix	trans	-56.2	-30.1	174.4	-156.4	-170.2	-179.7	-176.8	0	113.8	K710 Q711 R723 S727 E857	K710-K713 WeakPolarHBondContact O-CB 3.45Å; K710-K713 PolarHBondContact O-N 3.17Å; Q711-K713 PolarHBondContact O-N 2.91Å; K713-R723 WeakPolarHBondContact O-CD 3.48Å; K713-R723 PolarHBondContact O-NE 3.12Å; K713-R723 PolarHBondContact O-NH1 3.23Å; K713-R723 PolarHBondContact O-NH2 3.31Å; K713-S727 WeakPolarHBondContact CB-OG 3.33Å; K713-S727 WeakPolarHBondContact CG-OG 3.37Å; K713-E857 WeakPolarHBondContact CE-OE2 3.36Å; K713-E857 IonicContact NZ-OE1 2.95Å; K713-E857 PolarHBondContact NZ-OE1 2.81Å; K713-E857 IonicContact NZ-OE2 2.66Å; K713-E857 PolarHBondContact NZ-OE2 3Å
714	T	71.5	Confident	81.4	Confident	115 Å²	115	83.7 Å²	83.7	71%	0.706	40%	0.399	S	S	*	.	G	3₁₀ helix	trans	-99.9	-11.7	-178.2	46	0	0	0	0	113.1	Q711 F712	Q711-T714 PolarHBondContact O-N 3.26Å; Q711-T714 PolarHBondContact O-OG1 2.93Å; F712-T714 PolarHBondContact O-N 2.94Å
715	E	77.8	Confident	80.7	Confident	58 Å²	58	80 Å²	80	27%	0.271	39%	0.387	S	S	.	.			trans	-69.3	157	-179	-67.5	-165.6	173.4	0	0	112.6	F712 Y717 R723	F712-E715 PolarHBondContact O-N 3.27Å; E715-Y717 HydrophobicContact CB-CD2 4.29Å; E715-R723 WeakPolarHBondContact O-CD 2.94Å; E715-R723 PolarHBondContact O-NH1 2.77Å
716	R	75.4	Confident	80.3	Confident	229 Å²	229	80.5 Å²	80.5	86%	0.864	39%	0.389	S	S	*	.	S	Bend	trans	-86.4	-12.1	-177.9	-60.7	179.2	-172.4	170.6	2.5	112.7
717	Y	76.3	Confident	79.9	Confident	168 Å²	168	80.5 Å²	80.5	66%	0.659	39%	0.389	S	S	*	.	S	Bend	trans	-74.7	139.5	177.4	-53.1	-70.7	0	0	0	109.5	E715	E715-Y717 HydrophobicContact CB-CD2 4.29Å
718	F	79.8	Confident	79.5	Confident	136 Å²	136	81.1 Å²	81.1	60%	0.596	39%	0.39	S	S	*	.	S	Bend	trans	73.9	156.6	178.9	-60.1	-94.1	0	0	0	118.2	F712 V722	F712-F718 HydrophobicContact CE1-CD2 4.1Å; F712-F718 AromaticContact CE2-CD2 3.88Å; F712-F718 HydrophobicContact CE2-CD2 3.88Å; F712-F718 HydrophobicContact CE2-CE2 4.04Å; F712-F718 HydrophobicContact CZ-CB 4.42Å; F712-F718 AromaticContact CZ-CD2 3.19Å; F712-F718 HydrophobicContact CZ-CD2 3.19Å; F712-F718 AromaticContact CZ-CE2 3.54Å; F712-F718 HydrophobicContact CZ-CE2 3.54Å; F712-F718 AromaticContact CZ-CG 3.98Å; F712-F718 HydrophobicContact CZ-CG 3.98Å; F718-V722 HydrophobicContact CD1-CG1 4.49Å
719	P	79.6	Confident	79.3	Confident	85 Å²	85	78.5 Å²	78.5	55%	0.552	38%	0.379	S	S	*	.			trans	-61.5	145.5	173.5	-21.7	33.2	0	0	0	112.8	K721 V722 R723	P719-K721 PolarHBondContact O-N 2.89Å; P719-K721 VanDerWaalsContact O-N 3.11Å; P719-V722 HydrophobicContact CB-CG2 4.48Å; P719-V722 PolarHBondContact O-N 2.8Å; P719-R723 PolarHBondContact O-N 2.8Å
720	T	72.4	Confident	79.2	Confident	98 Å²	98	77.7 Å²	77.7	60%	0.601	38%	0.375	S	S	*	.	H	α-helix	trans	-53.1	-37.2	-176.9	53	0	0	0	0	114.1	S724	T720-S724 WeakPolarHBondContact O-CB 3.41Å; T720-S724 PolarHBondContact O-N 3.25Å
721	K	73.3	Confident	79.2	Confident	172 Å²	172	74.8 Å²	74.8	75%	0.748	36%	0.363	S	S	*	.	H	α-helix	trans	-63.8	-49.8	176.4	-71.8	-168.5	177.1	-174.2	0	112.4	P719 S724 T725	P719-K721 PolarHBondContact O-N 2.89Å; P719-K721 VanDerWaalsContact O-N 3.11Å; K721-S724 PolarHBondContact O-N 3.24Å; K721-T725 WeakPolarHBondContact O-CG2 3.29Å; K721-T725 PolarHBondContact O-N 3.29Å; K721-T725 PolarHBondContact O-OG1 3.42Å
722	V	80.9	Confident	79.4	Confident	58 Å²	58	72.7 Å²	72.7	35%	0.352	35%	0.352	S	S	.	.	H	α-helix	trans	-64.2	-45.1	-179	176.5	0	0	0	0	110.1	F718 P719 S724 T725 I726	F718-V722 HydrophobicContact CD1-CG1 4.49Å; P719-V722 HydrophobicContact CB-CG2 4.48Å; P719-V722 PolarHBondContact O-N 2.8Å; V722-S724 PolarHBondContact O-N 3.48Å; V722-T725 WeakPolarHBondContact CA-OG1 3.14Å; V722-T725 PolarHBondContact O-N 2.73Å; V722-T725 PolarHBondContact O-OG1 2.85Å; V722-I726 HydrophobicContact CG1-CD1 3.67Å; V722-I726 HydrophobicContact CG1-CG1 4.38Å; V722-I726 WeakPolarHBondContact O-CG1 3.35Å; V722-I726 PolarHBondContact O-N 3.32Å
723	R	80.3	Confident	79.7	Confident	56 Å²	56	75.1 Å²	75.1	21%	0.211	37%	0.366	C	S	.	.	H	α-helix	trans	-59.1	-44.6	177.1	-171.2	-176.1	66	151.5	7	112.5	F712 K713 E715 P719 S727	F712-R723 HydrophobicContact CD1-CG 4.01Å; F712-R723 HydrophobicContact CE1-CG 4.33Å; F712-R723 WeakPolarHBondContact O-CD 2.95Å; F712-R723 WeakPolarHBondContact O-CG 3.37Å; K713-R723 WeakPolarHBondContact O-CD 3.48Å; K713-R723 PolarHBondContact O-NE 3.12Å; K713-R723 PolarHBondContact O-NH1 3.23Å; K713-R723 PolarHBondContact O-NH2 3.31Å; E715-R723 WeakPolarHBondContact O-CD 2.94Å; E715-R723 PolarHBondContact O-NH1 2.77Å; P719-R723 PolarHBondContact O-N 2.8Å; R723-S727 WeakPolarHBondContact O-CB 3.24Å; R723-S727 PolarHBondContact O-N 2.97Å
724	S	75.1	Confident	80.4	Confident	46 Å²	46	73.2 Å²	73.2	32%	0.322	36%	0.358	S	S	.	.	H	α-helix	trans	-63.3	-47.1	175.6	-166.1	0	0	0	0	111.2	T720 K721 V722 I726 S727 D728	T720-S724 WeakPolarHBondContact O-CB 3.41Å; T720-S724 PolarHBondContact O-N 3.25Å; K721-S724 PolarHBondContact O-N 3.24Å; V722-S724 PolarHBondContact O-N 3.48Å; S724-I726 PolarHBondContact O-N 2.93Å; S724-S727 PolarHBondContact O-N 3.27Å; S724-D728 WeakPolarHBondContact O-CB 3.37Å; S724-D728 PolarHBondContact O-N 3.07Å
725	T	79.6	Confident	81.3	Confident	53 Å²	53	68 Å²	68	33%	0.325	33%	0.326	S	S	.	.	H	α-helix	trans	-61.9	-44.3	-179.9	49.5	0	0	0	0	112.3	L472 K721 V722 S727 D728 F729	L472-T725 HydrophobicContact CD2-CG2 4.32Å; K721-T725 WeakPolarHBondContact O-CG2 3.29Å; K721-T725 PolarHBondContact O-N 3.29Å; K721-T725 PolarHBondContact O-OG1 3.42Å; V722-T725 WeakPolarHBondContact CA-OG1 3.14Å; V722-T725 PolarHBondContact O-N 2.73Å; V722-T725 PolarHBondContact O-OG1 2.85Å; T725-S727 PolarHBondContact O-N 3.01Å; T725-D728 PolarHBondContact O-N 3.24Å; T725-F729 VanDerWaalsContact O-CD2 3.27Å; T725-F729 WeakPolarHBondContact O-CD2 3.28Å; T725-F729 PolarHBondContact O-N 2.94Å
726	I	84.4	Confident	81.8	Confident	50 Å²	50	70.2 Å²	70.2	26%	0.256	34%	0.337	S	S	.	.	H	α-helix	trans	-64.3	-42.9	179.2	-69.2	171.5	0	0	0	110.8	L709 F712 V722 S724 D728 F729 A730	L709-I726 HydrophobicContact CD2-CG2 3.89Å; F712-I726 HydrophobicContact CD1-CB 4.32Å; F712-I726 HydrophobicContact CD1-CG2 4.02Å; F712-I726 HydrophobicContact CE1-CB 4.42Å; F712-I726 HydrophobicContact CE1-CD1 3.97Å; F712-I726 HydrophobicContact CE1-CG2 4.31Å; V722-I726 HydrophobicContact CG1-CD1 3.67Å; V722-I726 HydrophobicContact CG1-CG1 4.38Å; V722-I726 WeakPolarHBondContact O-CG1 3.35Å; V722-I726 PolarHBondContact O-N 3.32Å; S724-I726 PolarHBondContact O-N 2.93Å; I726-D728 VanDerWaalsContact C-N 3.29Å; I726-D728 PolarHBondContact O-N 3.3Å; I726-F729 CarbonylContact O-C 3.33Å; I726-F729 PolarHBondContact O-N 3.29Å; I726-A730 WeakPolarHBondContact O-CA 3.47Å; I726-A730 PolarHBondContact O-N 3.27Å
727	S	81.1	Confident	82.6	Confident	0 Å²	0	62.4 Å²	62.4	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-63.3	-33.4	175.8	153.9	0	0	0	0	113	K710 K713 R723 S724 T725 A730	K710-S727 PolarHBondContact NZ-O 3.34Å; K713-S727 WeakPolarHBondContact CB-OG 3.33Å; K713-S727 WeakPolarHBondContact CG-OG 3.37Å; R723-S727 WeakPolarHBondContact O-CB 3.24Å; R723-S727 PolarHBondContact O-N 2.97Å; S724-S727 PolarHBondContact O-N 3.27Å; T725-S727 PolarHBondContact O-N 3.01Å; S727-A730 WeakPolarHBondContact O-CB 3.1Å
728	D	80.1	Confident	83.3	Confident	35 Å²	35	55 Å²	55	19%	0.187	28%	0.283	C	S	.	.	H	α-helix	trans	-75.7	-35.5	179.5	-65	-21.7	0	0	0	111.2	A476 S724 T725 I726	A476-D728 HydrophobicContact CB-CB 4.29Å; S724-D728 WeakPolarHBondContact O-CB 3.37Å; S724-D728 PolarHBondContact O-N 3.07Å; T725-D728 PolarHBondContact O-N 3.24Å; I726-D728 VanDerWaalsContact C-N 3.29Å; I726-D728 PolarHBondContact O-N 3.3Å
729	F	84.9	Confident	83.8	Confident	47 Å²	47	49.6 Å²	49.6	21%	0.206	26%	0.261	C	S	.	.	H	α-helix	trans	-88.8	2	174.7	-73.9	-77.7	0	0	0	114.7	A476 L479 T725 I726 V731 F732 L733	A476-F729 VanDerWaalsContact CA-CE1 3.43Å; A476-F729 HydrophobicContact CB-CD1 3.73Å; A476-F729 HydrophobicContact CB-CD2 4.05Å; A476-F729 HydrophobicContact CB-CE1 3.47Å; A476-F729 VanDerWaalsContact CB-CE1 3.47Å; A476-F729 HydrophobicContact CB-CE2 3.79Å; A476-F729 HydrophobicContact CB-CG 4.01Å; A476-F729 HydrophobicContact CB-CZ 3.5Å; A476-F729 VanDerWaalsContact CB-CZ 3.5Å; L479-F729 HydrophobicContact CD1-CE1 4.39Å; T725-F729 VanDerWaalsContact O-CD2 3.27Å; T725-F729 WeakPolarHBondContact O-CD2 3.28Å; T725-F729 PolarHBondContact O-N 2.94Å; I726-F729 CarbonylContact O-C 3.33Å; I726-F729 PolarHBondContact O-N 3.29Å; F729-V731 PolarHBondContact O-N 3Å; F729-F732 HydrophobicContact CD1-CD1 4.42Å; F729-F732 PolarHBondContact O-N 3.18Å; F729-F732 VanDerWaalsContact O-N 3.14Å; F729-L733 WeakPolarHBondContact O-CB 2.95Å; F729-L733 PolarHBondContact O-N 3.03Å
730	A	85.9	Confident	84.4	Confident	1 Å²	1	50.2 Å²	50.2	1%	0.008	26%	0.259	C	S	.	.	H	α-helix	trans	-47.7	-51.5	-169.2	0	0	0	0	0	114.6	L709 K710 I726 S727 T734	L709-A730 HydrophobicContact CB-CB 3.53Å; K710-A730 HydrophobicContact CD-CB 4.43Å; I726-A730 WeakPolarHBondContact O-CA 3.47Å; I726-A730 PolarHBondContact O-N 3.27Å; S727-A730 WeakPolarHBondContact O-CB 3.1Å; A730-T734 WeakPolarHBondContact O-CB 3.22Å; A730-T734 PolarHBondContact O-N 3.45Å; A730-T734 PolarHBondContact O-OG1 3.44Å
731	V	84.4	Confident	85.3	Confident	9 Å²	9	47.7 Å²	47.7	6%	0.055	24%	0.244	C	C	.	.	H	α-helix	trans	-71.9	-41.8	-176.6	-177.2	0	0	0	0	111.6	F480 F729 T734 I735 V907 Y910	F480-V731 HydrophobicContact CD2-CB 3.49Å; F480-V731 VanDerWaalsContact CD2-CB 3.49Å; F480-V731 HydrophobicContact CD2-CG1 3.56Å; F480-V731 HydrophobicContact CD2-CG2 4Å; F480-V731 HydrophobicContact CE2-CB 3.74Å; F480-V731 HydrophobicContact CE2-CG1 3.59Å; F480-V731 HydrophobicContact CE2-CG2 3.81Å; F480-V731 HydrophobicContact CG-CB 4.41Å; F480-V731 HydrophobicContact CZ-CG2 4.5Å; F729-V731 PolarHBondContact O-N 3Å; V731-T734 WeakPolarHBondContact O-CB 3.34Å; V731-T734 PolarHBondContact O-N 3.04Å; V731-I735 HydrophobicContact CG1-CD1 4.32Å; V731-I735 WeakPolarHBondContact O-CG1 3.35Å; V731-I735 PolarHBondContact O-N 3.22Å; V731-V907 HydrophobicContact CG1-CG1 3.66Å; V731-V907 HydrophobicContact CG1-CG2 4.03Å; V731-Y910 HydrophobicContact CG2-CD1 3.97Å; V731-Y910 HydrophobicContact CG2-CE1 3.5Å
732	F	86.6	Confident	86.2	Confident	52 Å²	52	39.6 Å²	39.6	23%	0.228	21%	0.209	C	C	.	.	H	α-helix	trans	-64	-45.4	178.1	176	-100.1	0	0	0	111.6	L479 F729 T734 I735 M736	L479-F732 HydrophobicContact CB-CD2 3.89Å; L479-F732 HydrophobicContact CB-CE2 4.14Å; L479-F732 HydrophobicContact CB-CG 4.24Å; L479-F732 HydrophobicContact CD1-CE1 4.35Å; L479-F732 HydrophobicContact CD1-CZ 4.3Å; F729-F732 HydrophobicContact CD1-CD1 4.42Å; F729-F732 PolarHBondContact O-N 3.18Å; F729-F732 VanDerWaalsContact O-N 3.14Å; F732-T734 VanDerWaalsContact C-N 3.29Å; F732-T734 PolarHBondContact O-N 3.34Å; F732-I735 PolarHBondContact O-N 3.44Å; F732-M736 HydrophobicContact CD1-CG 4.28Å; F732-M736 HydrophobicContact CE1-CG 3.81Å; F732-M736 HydrophobicContact CE1-SD 4.03Å; F732-M736 HydrophobicContact CE2-CG 4.27Å; F732-M736 HydrophobicContact CZ-CG 3.8Å; F732-M736 HydrophobicContact CZ-SD 3.76Å; F732-M736 WeakPolarHBondContact O-CG 3.44Å; F732-M736 PolarHBondContact O-N 3.17Å
733	L	88.7	Confident	86.5	Confident	70 Å²	70	44.4 Å²	44.4	37%	0.366	22%	0.222	S	C	.	.	H	α-helix	trans	-62.3	-38.3	176.4	-174.4	129.3	0	0	0	111.3	L709 F729 M736 I737	L709-L733 HydrophobicContact CD1-CD2 3.49Å; L709-L733 VanDerWaalsContact CD1-CD2 3.49Å; L709-L733 HydrophobicContact CD2-CD2 4.41Å; F729-L733 WeakPolarHBondContact O-CB 2.95Å; F729-L733 PolarHBondContact O-N 3.03Å; L733-M736 PolarHBondContact O-N 2.82Å; L733-I737 HydrophobicContact CD2-CD1 3.42Å; L733-I737 VanDerWaalsContact CD2-CD1 3.42Å; L733-I737 HydrophobicContact CD2-CG1 4.45Å; L733-I737 HydrophobicContact CG-CD1 3.97Å; L733-I737 WeakPolarHBondContact O-CB 3.33Å; L733-I737 VanDerWaalsContact O-CG1 3.25Å; L733-I737 WeakPolarHBondContact O-CG1 3.14Å; L733-I737 PolarHBondContact O-N 3.11Å
734	T	90.8	Very high	87	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-61.2	-47.3	174	-59.4	0	0	0	0	111.8	T702 L705 S706 L709 A730 V731 F732 M736 I737 M738	T702-T734 HydrophobicContact CG2-CG2 3.88Å; T702-T734 WeakPolarHBondContact O-CG2 3.47Å; L705-T734 HydrophobicContact CB-CG2 3.93Å; L705-T734 HydrophobicContact CD2-CG2 4.02Å; L705-T734 HydrophobicContact CG-CG2 4.05Å; S706-T734 WeakPolarHBondContact OG-CG2 3.42Å; S706-T734 PolarHBondContact OG-OG1 3.31Å; L709-T734 WeakPolarHBondContact CD1-OG1 3.34Å; A730-T734 WeakPolarHBondContact O-CB 3.22Å; A730-T734 PolarHBondContact O-N 3.45Å; A730-T734 PolarHBondContact O-OG1 3.44Å; V731-T734 WeakPolarHBondContact O-CB 3.34Å; V731-T734 PolarHBondContact O-N 3.04Å; F732-T734 VanDerWaalsContact C-N 3.29Å; F732-T734 PolarHBondContact O-N 3.34Å; T734-M736 VanDerWaalsContact C-N 3.34Å; T734-M736 PolarHBondContact O-N 3.2Å; T734-I737 PolarHBondContact O-N 2.83Å; T734-M738 HydrophobicContact CG2-CG 4.21Å; T734-M738 WeakPolarHBondContact O-CB 3.34Å; T734-M738 VanDerWaalsContact O-CG 3.25Å; T734-M738 WeakPolarHBondContact O-CG 3.37Å; T734-M738 PolarHBondContact O-N 3.08Å
735	I	89.1	Confident	87.6	Confident	6 Å²	6	51.1 Å²	51.1	3%	0.031	26%	0.255	C	S	.	.	H	α-helix	trans	-59.7	-47	177.4	-64.5	166.8	0	0	0	110	C483 V731 F732 I737 M738 V739 V903 V907	C483-I735 HydrophobicContact CB-CD1 3.64Å; V731-I735 HydrophobicContact CG1-CD1 4.32Å; V731-I735 WeakPolarHBondContact O-CG1 3.35Å; V731-I735 PolarHBondContact O-N 3.22Å; F732-I735 PolarHBondContact O-N 3.44Å; I735-I737 PolarHBondContact O-N 2.8Å; I735-M738 PolarHBondContact O-N 3.04Å; I735-V739 HydrophobicContact CG2-CG2 4.09Å; I735-V739 WeakPolarHBondContact O-CB 3.24Å; I735-V739 WeakPolarHBondContact O-CG2 3.5Å; I735-V739 PolarHBondContact O-N 2.88Å; I735-V903 HydrophobicContact CB-CG1 4.5Å; I735-V903 HydrophobicContact CG1-CG1 4.26Å; I735-V903 HydrophobicContact CG2-CG1 4.39Å; I735-V907 HydrophobicContact CD1-CG2 4.05Å; I735-V907 HydrophobicContact CG1-CG2 3.82Å
736	M	89.1	Confident	87.7	Confident	104 Å²	104	51.5 Å²	51.5	51%	0.512	27%	0.27	S	S	.	.	H	α-helix	trans	-59.5	-44.4	178.9	-70.4	-109.3	72.8	0	0	112.4	F732 L733 T734 L740	F732-M736 HydrophobicContact CD1-CG 4.28Å; F732-M736 HydrophobicContact CE1-CG 3.81Å; F732-M736 HydrophobicContact CE1-SD 4.03Å; F732-M736 HydrophobicContact CE2-CG 4.27Å; F732-M736 HydrophobicContact CZ-CG 3.8Å; F732-M736 HydrophobicContact CZ-SD 3.76Å; F732-M736 WeakPolarHBondContact O-CG 3.44Å; F732-M736 PolarHBondContact O-N 3.17Å; L733-M736 PolarHBondContact O-N 2.82Å; T734-M736 VanDerWaalsContact C-N 3.34Å; T734-M736 PolarHBondContact O-N 3.2Å; M736-L740 WeakPolarHBondContact O-CB 3.47Å; M736-L740 PolarHBondContact O-N 3.05Å
737	I	92.4	Very high	87.7	Confident	65 Å²	65	51.3 Å²	51.3	33%	0.333	27%	0.269	S	S	.	.	H	α-helix	trans	-64.7	-45.6	177.8	-69.3	169.6	0	0	0	110.6	L705 L733 T734 I735 L740 V741	L705-I737 HydrophobicContact CD2-CD1 4.31Å; L705-I737 HydrophobicContact CD2-CG2 4.26Å; L733-I737 HydrophobicContact CD2-CD1 3.42Å; L733-I737 VanDerWaalsContact CD2-CD1 3.42Å; L733-I737 HydrophobicContact CD2-CG1 4.45Å; L733-I737 HydrophobicContact CG-CD1 3.97Å; L733-I737 WeakPolarHBondContact O-CB 3.33Å; L733-I737 VanDerWaalsContact O-CG1 3.25Å; L733-I737 WeakPolarHBondContact O-CG1 3.14Å; L733-I737 PolarHBondContact O-N 3.11Å; T734-I737 PolarHBondContact O-N 2.83Å; I735-I737 PolarHBondContact O-N 2.8Å; I737-L740 WeakPolarHBondContact O-CB 3.41Å; I737-L740 PolarHBondContact O-N 3.4Å; I737-V741 HydrophobicContact CG2-CG2 4.37Å; I737-V741 VanDerWaalsContact O-CG2 3.3Å; I737-V741 WeakPolarHBondContact O-CG2 3.48Å; I737-V741 PolarHBondContact O-N 2.92Å
738	M	91.7	Very high	87.5	Confident	12 Å²	12	55.5 Å²	55.5	6%	0.059	30%	0.296	C	S	.	.	H	α-helix	trans	-69.6	-35.4	-177.6	-66.4	-66.9	136.8	0	0	112.4	L698 T701 T702 L705 T734 I735 V741 D742 V903	L698-M738 HydrophobicContact CD2-CB 4.49Å; L698-M738 HydrophobicContact CD2-SD 4.35Å; T701-M738 HydrophobicContact CG2-CE 3.41Å; T701-M738 VanDerWaalsContact CG2-CE 3.41Å; T701-M738 HydrophobicContact CG2-SD 3.89Å; T702-M738 WeakPolarHBondContact OG1-CG 3.27Å; L705-M738 HydrophobicContact CD2-CE 3.52Å; T734-M738 HydrophobicContact CG2-CG 4.21Å; T734-M738 WeakPolarHBondContact O-CB 3.34Å; T734-M738 VanDerWaalsContact O-CG 3.25Å; T734-M738 WeakPolarHBondContact O-CG 3.37Å; T734-M738 PolarHBondContact O-N 3.08Å; I735-M738 PolarHBondContact O-N 3.04Å; M738-V741 PolarHBondContact O-N 3.26Å; M738-D742 WeakPolarHBondContact O-CB 3.38Å; M738-D742 PolarHBondContact O-N 3.24Å; M738-V903 HydrophobicContact CB-CG1 4.01Å; M738-V903 HydrophobicContact CB-CG2 3.61Å; M738-V903 HydrophobicContact CG-CG2 4.48Å
739	V	90.5	Very high	87.6	Confident	22 Å²	22	54.2 Å²	54.2	13%	0.133	29%	0.29	C	S	.	.	H	α-helix	trans	-64	-41.7	171	171.6	0	0	0	0	110.9	I735 D742 Y743 F898 I899	I735-V739 HydrophobicContact CG2-CG2 4.09Å; I735-V739 WeakPolarHBondContact O-CB 3.24Å; I735-V739 WeakPolarHBondContact O-CG2 3.5Å; I735-V739 PolarHBondContact O-N 2.88Å; V739-D742 PolarHBondContact O-N 2.58Å; V739-Y743 WeakPolarHBondContact O-CB 3.29Å; V739-Y743 PolarHBondContact O-N 3.13Å; V739-F898 HydrophobicContact CG1-CB 4.38Å; V739-I899 HydrophobicContact CG2-CB 4.4Å; V739-I899 HydrophobicContact CG2-CG1 4.15Å; V739-I899 HydrophobicContact CG2-CG2 4.27Å
740	L	91	Very high	87.4	Confident	98 Å²	98	53 Å²	53	51%	0.513	29%	0.287	S	S	.	.	H	α-helix	trans	-64.1	-42.8	175.9	-179.9	63.2	0	0	0	111.4	M736 I737 Y743 L744	M736-L740 WeakPolarHBondContact O-CB 3.47Å; M736-L740 PolarHBondContact O-N 3.05Å; I737-L740 WeakPolarHBondContact O-CB 3.41Å; I737-L740 PolarHBondContact O-N 3.4Å; L740-Y743 PolarHBondContact O-N 3.11Å; L740-L744 HydrophobicContact CD1-CD1 4.36Å; L740-L744 HydrophobicContact CD1-CG 4.34Å; L740-L744 HydrophobicContact CG-CD1 4.09Å; L740-L744 HydrophobicContact CG-CG 4.48Å; L740-L744 WeakPolarHBondContact O-CB 3.31Å; L740-L744 VanDerWaalsContact O-CG 3.24Å; L740-L744 WeakPolarHBondContact O-CG 3.19Å; L740-L744 PolarHBondContact O-N 3.32Å
741	V	92.3	Very high	87.2	Confident	46 Å²	46	57 Å²	57	28%	0.279	30%	0.304	S	S	.	.	H	α-helix	trans	-63.9	-42.8	177	169	0	0	0	0	111.3	W694 I737 M738 L744 M745	W694-V741 HydrophobicContact CH2-CG1 3.62Å; W694-V741 HydrophobicContact CZ2-CG1 3.9Å; I737-V741 HydrophobicContact CG2-CG2 4.37Å; I737-V741 VanDerWaalsContact O-CG2 3.3Å; I737-V741 WeakPolarHBondContact O-CG2 3.48Å; I737-V741 PolarHBondContact O-N 2.92Å; M738-V741 PolarHBondContact O-N 3.26Å; V741-L744 PolarHBondContact O-N 2.94Å; V741-M745 WeakPolarHBondContact O-CB 3.41Å; V741-M745 WeakPolarHBondContact O-CG 3.4Å; V741-M745 PolarHBondContact O-N 3.08Å
742	D	91	Very high	86.5	Confident	2 Å²	2	56.8 Å²	56.8	1%	0.011	30%	0.303	C	S	.	.	H	α-helix	trans	-61.7	-42.7	174.3	-173.3	64.9	0	0	0	111.8	W694 L698 M738 V739 M745 G746 S749 P900	W694-D742 PolarHBondContact NE1-OD1 3.17Å; L698-D742 HydrophobicContact CD1-CB 4.32Å; M738-D742 WeakPolarHBondContact O-CB 3.38Å; M738-D742 PolarHBondContact O-N 3.24Å; V739-D742 PolarHBondContact O-N 2.58Å; D742-M745 PolarHBondContact O-N 2.81Å; D742-G746 PolarHBondContact O-N 3.3Å; D742-G746 VanDerWaalsContact O-N 3.09Å; D742-S749 VanDerWaalsContact CG-OG 3.29Å; D742-S749 WeakPolarHBondContact OD1-CB 3.02Å; D742-S749 PolarHBondContact OD1-OG 3.4Å; D742-S749 PolarHBondContact OD2-OG 3.32Å; D742-P900 HydrophobicContact CB-CG 4.18Å
743	Y	88.4	Confident	85.4	Confident	158 Å²	158	61.5 Å²	61.5	62%	0.62	33%	0.325	S	S	*	.	H	α-helix	trans	-63.3	-41.3	175.8	-178.6	-101.1	0	0	0	112.6	V739 L740	V739-Y743 WeakPolarHBondContact O-CB 3.29Å; V739-Y743 PolarHBondContact O-N 3.13Å; L740-Y743 PolarHBondContact O-N 3.11Å
744	L	90.1	Very high	84.4	Confident	125 Å²	125	58.2 Å²	58.2	65%	0.654	31%	0.308	S	S	*	.	H	α-helix	trans	-69.7	-34.7	179	-71.7	172.5	0	0	0	112.9	L740 V741	L740-L744 HydrophobicContact CD1-CD1 4.36Å; L740-L744 HydrophobicContact CD1-CG 4.34Å; L740-L744 HydrophobicContact CG-CD1 4.09Å; L740-L744 HydrophobicContact CG-CG 4.48Å; L740-L744 WeakPolarHBondContact O-CB 3.31Å; L740-L744 VanDerWaalsContact O-CG 3.24Å; L740-L744 WeakPolarHBondContact O-CG 3.19Å; L740-L744 PolarHBondContact O-N 3.32Å; V741-L744 PolarHBondContact O-N 2.94Å
745	M	88.4	Confident	83.2	Confident	118 Å²	118	60.2 Å²	60.2	58%	0.581	32%	0.321	S	S	*	.	H	α-helix	trans	-78.8	-25.9	179.4	-69.6	-68.8	164.7	0	0	112.9	W694 V741 D742 I747	W694-M745 HydrophobicContact CH2-CB 4.1Å; W694-M745 HydrophobicContact CH2-CG 3.5Å; W694-M745 HydrophobicContact CZ2-CB 3.79Å; W694-M745 HydrophobicContact CZ2-CG 3.68Å; W694-M745 HydrophobicContact CZ3-CG 4.21Å; V741-M745 WeakPolarHBondContact O-CB 3.41Å; V741-M745 WeakPolarHBondContact O-CG 3.4Å; V741-M745 PolarHBondContact O-N 3.08Å; D742-M745 PolarHBondContact O-N 2.81Å; M745-I747 HydrophobicContact CB-CG1 4.49Å; M745-I747 PolarHBondContact O-N 2.84Å; M745-I747 VanDerWaalsContact O-N 3.14Å
746	G	80.6	Confident	82.1	Confident	61 Å²	61	64.4 Å²	64.4	63%	0.629	34%	0.343	S	S	*	.			trans	68.2	11.5	171.6	0	0	0	0	0	115.5	D742	D742-G746 PolarHBondContact O-N 3.3Å; D742-G746 VanDerWaalsContact O-N 3.09Å
747	I	84.6	Confident	81.1	Confident	46 Å²	46	68 Å²	68	24%	0.236	35%	0.351	C	S	.	.			trans	-73.1	138.6	176.5	-60.2	172.2	0	0	0	108.8	V691 W694 M745 S749	V691-I747 HydrophobicContact CG2-CG2 4.33Å; W694-I747 HydrophobicContact CB-CD1 4.08Å; W694-I747 HydrophobicContact CB-CG2 4.24Å; W694-I747 HydrophobicContact CD2-CD1 3.87Å; W694-I747 HydrophobicContact CE3-CD1 4.21Å; W694-I747 HydrophobicContact CG-CB 4.28Å; W694-I747 HydrophobicContact CG-CD1 3.79Å; W694-I747 HydrophobicContact CG-CG2 4.22Å; M745-I747 HydrophobicContact CB-CG1 4.49Å; M745-I747 PolarHBondContact O-N 2.84Å; M745-I747 VanDerWaalsContact O-N 3.14Å; I747-S749 PolarHBondContact O-N 3.35Å
748	P	76.4	Confident	80	Confident	88 Å²	88	68.6 Å²	68.6	57%	0.571	35%	0.351	S	S	*	.			trans	-72.2	75.7	179.6	30.3	-35.7	0	0	0	111.5	I688 V691	I688-P748 HydrophobicContact CG2-CG 4.38Å; V691-P748 HydrophobicContact CG2-CG 4.11Å
749	S	81.9	Confident	78.7	Confident	9 Å²	9	72.9 Å²	72.9	6%	0.063	37%	0.371	C	S	.	.			trans	-70.6	150.8	172.3	65.1	0	0	0	0	111.1	D742 I747 K751	D742-S749 VanDerWaalsContact CG-OG 3.29Å; D742-S749 WeakPolarHBondContact OD1-CB 3.02Å; D742-S749 PolarHBondContact OD1-OG 3.4Å; D742-S749 PolarHBondContact OD2-OG 3.32Å; I747-S749 PolarHBondContact O-N 3.35Å; S749-K751 PolarHBondContact O-N 2.9Å; S749-K751 VanDerWaalsContact O-N 3.14Å
750	P	81.1	Confident	77.6	Confident	21 Å²	21	73.2 Å²	73.2	14%	0.136	37%	0.374	C	S	.	.			trans	-68.5	112.6	175.5	28.7	-35.3	0	0	0	109.7	L612 M901 P902	L612-P750 HydrophobicContact CD1-CB 4.35Å; L612-P750 HydrophobicContact CD1-CG 3.85Å; L612-P750 HydrophobicContact CD2-CG 4Å; P750-M901 PolarHBondContact O-N 3.4Å; P750-P902 HydrophobicContact CG-CG 4.05Å
751	K	81.3	Confident	76.4	Confident	85 Å²	85	71.5 Å²	71.5	37%	0.37	37%	0.367	S	S	.	.	B	Isolated β-bridge	trans	-96.7	158.6	-176.3	-72.9	169.1	-174.8	-174.3	0	112.5	S749 H753 K897 M901	S749-K751 PolarHBondContact O-N 2.9Å; S749-K751 VanDerWaalsContact O-N 3.14Å; K751-H753 PolarHBondContact O-N 3.14Å; K751-H753 VanDerWaalsContact O-N 3.12Å; K751-K897 VanDerWaalsContact CB-O 3.32Å; K751-K897 WeakPolarHBondContact CB-O 3.4Å; K751-K897 VanDerWaalsContact CD-O 3.3Å; K751-K897 WeakPolarHBondContact CD-O 3.21Å; K751-M901 WeakPolarHBondContact O-CE 3.19Å
752	L	70.5	Confident	75.1	Confident	5 Å²	5	71.3 Å²	71.3	3%	0.026	37%	0.368	C	S	.	.			trans	-65	108.4	176.8	-167.5	70.2	0	0	0	111.1	M486 I490 V754 I899 L904	M486-L752 HydrophobicContact CE-CD2 4.14Å; M486-L752 HydrophobicContact SD-CD2 4.41Å; I490-L752 HydrophobicContact CB-CD1 4.33Å; I490-L752 HydrophobicContact CD1-CD1 3.87Å; I490-L752 HydrophobicContact CD1-CD2 3.73Å; I490-L752 HydrophobicContact CD1-CG 3.99Å; I490-L752 HydrophobicContact CG2-CD1 3.86Å; L752-V754 HydrophobicContact CD2-CG2 3.86Å; L752-V754 HydrophobicContact CG-CG2 3.89Å; L752-V754 PolarHBondContact O-N 3.08Å; L752-I899 PolarHBondContact N-O 3.32Å; L752-L904 HydrophobicContact CD1-CD1 4.25Å
753	H	64	Low	73.4	Confident	151 Å²	151	80.6 Å²	80.6	70%	0.699	41%	0.409	S	S	*	.			trans	-83.6	92.6	176.8	-170	-81	0	0	0	110.5	K751	K751-H753 PolarHBondContact O-N 3.14Å; K751-H753 VanDerWaalsContact O-N 3.12Å
754	V	66.8	Low	72.1	Confident	1 Å²	1	82.1 Å²	82.1	1%	0.006	42%	0.421	C	S	.	.			trans	-92.1	130	174.3	-169	0	0	0	0	109.1	M486 I490 L752 T893 L896	M486-V754 HydrophobicContact CE-CG2 4.08Å; I490-V754 HydrophobicContact CD1-CG2 4.19Å; L752-V754 HydrophobicContact CD2-CG2 3.86Å; L752-V754 HydrophobicContact CG-CG2 3.89Å; L752-V754 PolarHBondContact O-N 3.08Å; V754-T893 HydrophobicContact CB-CG2 3.79Å; V754-T893 HydrophobicContact CG1-CG2 3.48Å; V754-T893 VanDerWaalsContact CG1-CG2 3.48Å; V754-L896 HydrophobicContact CG2-CB 4.25Å
755	P	66.1	Low	71	Confident	42 Å²	42	77.9 Å²	77.9	27%	0.273	40%	0.396	S	S	.	.			trans	-67.2	136.7	177.7	26.4	-32.8	0	0	0	111.3	I507	I507-P755 HydrophobicContact CB-CG 3.88Å; I507-P755 HydrophobicContact CD1-CB 4.09Å; I507-P755 HydrophobicContact CD1-CG 3.75Å; I507-P755 HydrophobicContact CG1-CG 3.95Å
756	D	66	Low	70.1	Confident	93 Å²	93	74.5 Å²	74.5	50%	0.497	39%	0.391	S	S	.	.	S	Bend	trans	-85.5	-4.6	-173.7	-65	-47.3	0	0	0	114.3	T893 K897	D756-T893 WeakPolarHBondContact OD1-CB 3.32Å; D756-T893 PolarHBondContact OD1-OG1 2.96Å; D756-K897 VanDerWaalsContact OD1-CE 3.27Å; D756-K897 WeakPolarHBondContact OD1-CE 3.41Å; D756-K897 IonicContact OD1-NZ 3.34Å; D756-K897 PolarHBondContact OD1-NZ 3Å; D756-K897 IonicContact OD2-NZ 3.95Å; D756-K897 PolarHBondContact OD2-NZ 3.4Å
757	R	68.8	Low	69.9	Low	180 Å²	180	76 Å²	76	68%	0.679	38%	0.378	S	S	*	.	S	Bend	trans	-134	130.6	-176.8	-63.7	-170.3	-177.8	-163.1	1.4	112.3	I507 E759	I507-R757 WeakPolarHBondContact CD1-O 3.37Å; R757-E759 VanDerWaalsContact C-N 3.31Å; R757-E759 HydrophobicContact CB-CG 4.45Å; R757-E759 IonicContact NH1-OE1 2.84Å; R757-E759 PolarHBondContact O-N 2.9Å
758	F	67.7	Low	69.7	Low	78 Å²	78	79.8 Å²	79.8	34%	0.342	40%	0.398	S	S	.	.			trans	-74.1	78.3	169.4	-79.8	-72.7	0	0	0	111.2	I507 V890 F891	I507-F758 HydrophobicContact CD1-CD1 4.31Å; I507-F758 HydrophobicContact CG1-CD1 4.42Å; F758-V890 HydrophobicContact CD1-CG2 4.45Å; F758-V890 HydrophobicContact CD2-CB 4.11Å; F758-V890 HydrophobicContact CD2-CG1 3.68Å; F758-V890 HydrophobicContact CE1-CB 4.23Å; F758-V890 HydrophobicContact CE1-CG1 4.48Å; F758-V890 HydrophobicContact CE1-CG2 3.65Å; F758-V890 HydrophobicContact CE2-CB 3.34Å; F758-V890 HydrophobicContact CE2-CG1 3.45Å; F758-V890 VanDerWaalsContact CE2-CG1 3.45Å; F758-V890 HydrophobicContact CE2-CG2 3.75Å; F758-V890 HydrophobicContact CG-CG1 4.31Å; F758-V890 HydrophobicContact CZ-CB 3.42Å; F758-V890 VanDerWaalsContact CZ-CB 3.42Å; F758-V890 HydrophobicContact CZ-CG1 3.89Å; F758-V890 HydrophobicContact CZ-CG2 3.25Å; F758-F891 HydrophobicContact CE2-CE2 4.33Å; F758-F891 HydrophobicContact CE2-CZ 4.36Å
759	E	65.7	Low	69.9	Low	101 Å²	101	77.1 Å²	77.1	47%	0.472	38%	0.378	S	S	.	.			trans	-129.4	143.7	173	-68.6	175.4	-156.1	0	0	109.5	R757 T761	R757-E759 VanDerWaalsContact C-N 3.31Å; R757-E759 HydrophobicContact CB-CG 4.45Å; R757-E759 IonicContact NH1-OE1 2.84Å; R757-E759 PolarHBondContact O-N 2.9Å; E759-T761 PolarHBondContact O-N 3.32Å
760	P	68	Low	69.8	Low	30 Å²	30	82.4 Å²	82.4	20%	0.195	41%	0.406	C	S	.	.			trans	-55.8	138.8	169.8	-20.1	31.1	0	0	0	110.1	S762	P760-S762 PolarHBondContact O-N 2.69Å; P760-S762 VanDerWaalsContact O-N 3.09Å
761	T	65.3	Low	69.4	Low	61 Å²	61	83.6 Å²	83.6	37%	0.374	41%	0.414	S	S	.	.	S	Bend	trans	-57.4	-33	-173.4	-51.2	0	0	0	0	112.5	G502 S505 E508 E759	G502-T761 WeakPolarHBondContact O-CB 3.39Å; G502-T761 VanDerWaalsContact O-CG2 3.27Å; G502-T761 WeakPolarHBondContact O-CG2 3.45Å; S505-T761 WeakPolarHBondContact CB-OG1 3.34Å; S505-T761 WeakPolarHBondContact OG-CG2 3.36Å; S505-T761 PolarHBondContact OG-OG1 3.45Å; E508-T761 VanDerWaalsContact CD-OG1 3.24Å; E508-T761 WeakPolarHBondContact OE1-CB 3.38Å; E508-T761 PolarHBondContact OE1-N 3.11Å; E508-T761 PolarHBondContact OE1-OG1 2.84Å; E508-T761 PolarHBondContact OE2-OG1 3.33Å; E759-T761 PolarHBondContact O-N 3.32Å
762	S	63.6	Low	68.9	Low	42 Å²	42	83.6 Å²	83.6	29%	0.294	42%	0.417	S	S	.	.	S	Bend	trans	-99.1	124.1	174	-177.4	0	0	0	0	111.5	P760 H764 R765	P760-S762 PolarHBondContact O-N 2.69Å; P760-S762 VanDerWaalsContact O-N 3.09Å; S762-H764 PolarHBondContact O-N 2.99Å; S762-H764 VanDerWaalsContact O-N 3.08Å; S762-R765 PolarHBondContact O-N 3.33Å
763	K	56.7	Low	69	Low	198 Å²	198	85.8 Å²	85.8	86%	0.861	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-15.3	177.6	-67	-177.3	179.1	179.1	0	114.1
764	H	60.1	Low	69.3	Low	190 Å²	190	87.3 Å²	87.3	88%	0.88	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.6	4.2	-178.9	-62.7	-68.9	0	0	0	113.9	S762	S762-H764 PolarHBondContact O-N 2.99Å; S762-H764 VanDerWaalsContact O-N 3.08Å
765	R	67	Low	70	Confident	36 Å²	36	88 Å²	88	14%	0.136	45%	0.452	C	S	.	.			trans	-119.5	139.9	-168.7	166.3	179.1	172.6	171.8	6.8	113.2	N503 L556 S762 M769 M835 G836	N503-R765 PolarHBondContact O-NH1 3Å; L556-R765 VanDerWaalsContact CD2-NH1 3.31Å; S762-R765 PolarHBondContact O-N 3.33Å; R765-M769 HydrophobicContact CG-CE 3.44Å; R765-M769 VanDerWaalsContact CG-CE 3.44Å; R765-M835 PolarHBondContact NH2-O 3.17Å; R765-G836 VanDerWaalsContact NH2-C 3.29Å; R765-G836 PolarHBondContact NH2-O 3.41Å
766	G	70.4	Confident	70.9	Confident	46 Å²	46	88.5 Å²	88.5	47%	0.474	46%	0.455	S	S	.	.			trans	-92	171	163.8	0	0	0	0	0	113.6	L768	G766-L768 VanDerWaalsContact C-N 3.32Å; G766-L768 PolarHBondContact O-N 3.13Å
767	W	75.1	Confident	71.8	Confident	93 Å²	93	92.8 Å²	92.8	35%	0.352	47%	0.465	S	S	.	.	S	Bend	trans	-73	-19.9	178.8	-74	92.2	0	0	0	114	F511 M835 L837	F511-W767 HydrophobicContact CD1-CE3 4.41Å; F511-W767 AromaticContact CD1-CH2 3.95Å; F511-W767 HydrophobicContact CD1-CH2 3.95Å; F511-W767 AromaticContact CD1-CZ3 3.47Å; F511-W767 HydrophobicContact CD1-CZ3 3.47Å; F511-W767 VanDerWaalsContact CD1-CZ3 3.47Å; F511-W767 HydrophobicContact CE1-CE3 4.27Å; F511-W767 HydrophobicContact CE1-CH2 4.34Å; F511-W767 AromaticContact CE1-CZ3 3.72Å; F511-W767 HydrophobicContact CE1-CZ3 3.72Å; F511-W767 HydrophobicContact CG-CH2 4.16Å; F511-W767 HydrophobicContact CG-CZ3 4.14Å; W767-M835 HydrophobicContact CE3-CE 4.11Å; W767-M835 CarbonylContact O-C 3.57Å; W767-M835 WeakPolarHBondContact O-CA 3.36Å; W767-L837 HydrophobicContact CZ3-CD2 4.03Å
768	L	81.3	Confident	72.6	Confident	126 Å²	126	90.3 Å²	90.3	66%	0.66	46%	0.456	S	S	*	.			trans	-103.2	132.6	179.5	-164.4	75.8	0	0	0	110.6	G766 I834	G766-L768 VanDerWaalsContact C-N 3.32Å; G766-L768 PolarHBondContact O-N 3.13Å; L768-I834 HydrophobicContact CD1-CG2 3.3Å; L768-I834 HydrophobicContact CG-CG2 4.36Å
769	M	81.3	Confident	73.3	Confident	32 Å²	32	86.9 Å²	86.9	16%	0.158	44%	0.441	C	S	.	.			trans	-108.4	135.6	178.9	-72.1	-68.2	167	0	0	112.4	L556 R765 I834	L556-M769 HydrophobicContact CB-CE 4.35Å; L556-M769 HydrophobicContact CB-SD 4.04Å; L556-M769 HydrophobicContact CD1-CE 3.88Å; L556-M769 HydrophobicContact CD2-CE 4.18Å; L556-M769 HydrophobicContact CG-CE 4.35Å; R765-M769 HydrophobicContact CG-CE 3.44Å; R765-M769 VanDerWaalsContact CG-CE 3.44Å; M769-I834 PolarHBondContact N-O 3.22Å
770	D	78.5	Confident	74.2	Confident	120 Å²	120	84.9 Å²	84.9	64%	0.642	43%	0.433	S	S	*	.			trans	-79.2	131.5	171.5	-67.7	-42.2	0	0	0	110.8	L772	D770-L772 PolarHBondContact O-N 2.86Å
771	P	73.4	Confident	75.1	Confident	46 Å²	46	88.6 Å²	88.6	30%	0.299	45%	0.451	S	S	.	.	S	Bend	trans	-67.3	-35.7	-175	24.2	-32.7	0	0	0	113.2	S557 T560 S561 L564	S557-P771 PolarHBondContact OG-O 3.46Å; T560-P771 HydrophobicContact CG2-CB 4.12Å; S561-P771 PolarHBondContact OG-O 2.9Å; L564-P771 HydrophobicContact CD1-CB 3.92Å
772	L	70.6	Confident	76.1	Confident	85 Å²	85	89.3 Å²	89.3	45%	0.445	46%	0.455	S	S	.	.	S	Bend	trans	-88.4	-29.9	178.3	-90.8	76.2	0	0	0	113.3	S557 D770 E774 N775 L780	S557-L772 VanDerWaalsContact OG-C 3.31Å; S557-L772 PolarHBondContact OG-O 3.33Å; D770-L772 PolarHBondContact O-N 2.86Å; L772-E774 PolarHBondContact O-N 3.15Å; L772-N775 PolarHBondContact O-N 2.77Å; L772-L780 HydrophobicContact CD1-CD2 4.46Å
773	G	73.3	Confident	77.3	Confident	51 Å²	51	87.4 Å²	87.4	53%	0.526	44%	0.441	S	S	.	.	T	Hydrogen-bonded Turn	trans	41.9	-127.3	177.8	0	0	0	0	0	113.7
774	E	70.4	Confident	78.9	Confident	182 Å²	182	79.5 Å²	79.5	85%	0.85	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.7	1.6	176	-62.6	178	167.7	0	0	113.3	L772	L772-E774 PolarHBondContact O-N 3.15Å
775	N	81.7	Confident	80.3	Confident	16 Å²	16	75.3 Å²	75.3	9%	0.086	40%	0.401	C	S	.	.	S	Bend	trans	-85.6	146.5	-173	-69.2	-29.3	0	0	0	111.7	S554 S557 L558 L772 T779	S554-N775 PolarHBondContact N-OD1 3.27Å; S554-N775 PolarHBondContact O-ND2 3.49Å; S554-N775 VanDerWaalsContact O-ND2 3.13Å; S554-N775 PolarHBondContact OG-ND2 3.43Å; S554-N775 PolarHBondContact OG-OD1 2.87Å; S557-N775 WeakPolarHBondContact CB-ND2 3.29Å; S557-N775 PolarHBondContact OG-ND2 2.69Å; L558-N775 PolarHBondContact N-ND2 3.02Å; L772-N775 PolarHBondContact O-N 2.77Å; N775-T779 HydrophobicContact CB-CG2 4.41Å
776	P	84.1	Confident	81.3	Confident	53 Å²	53	75.4 Å²	75.4	34%	0.344	41%	0.406	S	S	.	.			trans	-68.4	145.4	177	27.1	-32.5	0	0	0	111.3	W778 T779	P776-W778 HydrophobicContact CG-CD2 4.39Å; P776-W778 HydrophobicContact CG-CZ2 3.78Å; P776-W778 PolarHBondContact O-N 3.38Å; P776-T779 HydrophobicContact CG-CG2 3.89Å; P776-T779 WeakPolarHBondContact O-CB 3.26Å; P776-T779 WeakPolarHBondContact O-CG2 3.49Å; P776-T779 PolarHBondContact O-N 2.01Å; P776-T779 PolarHBondContact O-OG1 3.39Å
777	W	84	Confident	82.3	Confident	183 Å²	183	73.2 Å²	73.2	69%	0.693	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.7	-28.5	-171.6	72.7	-84.5	0	0	0	115.1	T779 L780 L781	W777-T779 PolarHBondContact O-N 2.79Å; W777-L780 WeakPolarHBondContact O-CB 3.47Å; W777-L780 PolarHBondContact O-N 3.28Å; W777-L781 HydrophobicContact CZ3-CD1 4Å
778	W	85.7	Confident	83	Confident	128 Å²	128	73.3 Å²	73.3	49%	0.485	39%	0.39	S	S	.	.	H	α-helix	trans	-64.9	-23.2	177.9	62.1	-101.5	0	0	0	112.9	P776 L780 L781 V782	P776-W778 HydrophobicContact CG-CD2 4.39Å; P776-W778 HydrophobicContact CG-CZ2 3.78Å; P776-W778 PolarHBondContact O-N 3.38Å; W778-L780 PolarHBondContact O-N 3.45Å; W778-L781 PolarHBondContact O-N 2.95Å; W778-L781 VanDerWaalsContact O-N 3.13Å; W778-V782 HydrophobicContact CE3-CB 4.45Å; W778-V782 HydrophobicContact CE3-CG2 3.77Å; W778-V782 HydrophobicContact CZ3-CG2 4.1Å; W778-V782 PolarHBondContact O-N 3.37Å; W778-V782 VanDerWaalsContact O-N 3.14Å
779	T	83.3	Confident	83.2	Confident	5 Å²	5	70.5 Å²	70.5	3%	0.031	38%	0.376	C	S	.	.	H	α-helix	trans	-62.9	-29	176.1	58.7	0	0	0	0	112.1	L553 N775 P776 W777 L781 V782 A783	L553-T779 HydrophobicContact CD1-CG2 4.28Å; L553-T779 HydrophobicContact CD2-CG2 4.08Å; N775-T779 HydrophobicContact CB-CG2 4.41Å; P776-T779 HydrophobicContact CG-CG2 3.89Å; P776-T779 WeakPolarHBondContact O-CB 3.26Å; P776-T779 WeakPolarHBondContact O-CG2 3.49Å; P776-T779 PolarHBondContact O-N 2.01Å; P776-T779 PolarHBondContact O-OG1 3.39Å; W777-T779 PolarHBondContact O-N 2.79Å; T779-L781 VanDerWaalsContact C-N 3.31Å; T779-L781 PolarHBondContact O-N 2.84Å; T779-V782 PolarHBondContact O-N 3.43Å; T779-A783 VanDerWaalsContact O-CB 3.23Å; T779-A783 WeakPolarHBondContact O-CB 3.46Å; T779-A783 PolarHBondContact O-N 3.28Å
780	L	84.8	Confident	83.5	Confident	60 Å²	60	69.1 Å²	69.1	31%	0.314	37%	0.369	S	S	.	.	H	α-helix	trans	-63.6	-37.2	175.2	-175.4	66.9	0	0	0	111.9	W565 L772 W777 W778	W565-L780 PolarHBondContact NE1-O 2.97Å; L772-L780 HydrophobicContact CD1-CD2 4.46Å; W777-L780 WeakPolarHBondContact O-CB 3.47Å; W777-L780 PolarHBondContact O-N 3.28Å; W778-L780 PolarHBondContact O-N 3.45Å
781	L	86.7	Confident	84	Confident	108 Å²	108	63.6 Å²	63.6	57%	0.565	34%	0.34	S	S	*	.	H	α-helix	trans	-76.2	-42	177.4	-68.9	174.1	0	0	0	111.4	W777 W778 T779 A783 A784	W777-L781 HydrophobicContact CZ3-CD1 4Å; W778-L781 PolarHBondContact O-N 2.95Å; W778-L781 VanDerWaalsContact O-N 3.13Å; T779-L781 VanDerWaalsContact C-N 3.31Å; T779-L781 PolarHBondContact O-N 2.84Å; L781-A783 VanDerWaalsContact C-N 3.26Å; L781-A783 PolarHBondContact O-N 3.02Å; L781-A784 VanDerWaalsContact O-CB 3.29Å; L781-A784 WeakPolarHBondContact O-CB 3.46Å; L781-A784 PolarHBondContact O-N 3.46Å
782	V	87.3	Confident	84.7	Confident	75 Å²	75	63.4 Å²	63.4	46%	0.455	34%	0.336	S	S	.	.	H	α-helix	trans	-65.5	-31.9	178.2	175.6	0	0	0	0	111.5	W778 T779 A784 V785 P786	W778-V782 HydrophobicContact CE3-CB 4.45Å; W778-V782 HydrophobicContact CE3-CG2 3.77Å; W778-V782 HydrophobicContact CZ3-CG2 4.1Å; W778-V782 PolarHBondContact O-N 3.37Å; W778-V782 VanDerWaalsContact O-N 3.14Å; T779-V782 PolarHBondContact O-N 3.43Å; V782-A784 PolarHBondContact O-N 2.99Å; V782-A784 VanDerWaalsContact O-N 3.08Å; V782-V785 PolarHBondContact O-N 2.85Å; V782-V785 VanDerWaalsContact O-N 3.16Å; V782-P786 WeakPolarHBondContact O-CD 3.48Å
783	A	88.5	Confident	85.4	Confident	2 Å²	2	59.7 Å²	59.7	2%	0.017	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-20.2	175.7	0	0	0	0	0	113.8	L558 I562 T779 L781 V785 P786 A787	L558-A783 HydrophobicContact CD1-CB 4.32Å; I562-A783 HydrophobicContact CG1-CB 3.8Å; T779-A783 VanDerWaalsContact O-CB 3.23Å; T779-A783 WeakPolarHBondContact O-CB 3.46Å; T779-A783 PolarHBondContact O-N 3.28Å; L781-A783 VanDerWaalsContact C-N 3.26Å; L781-A783 PolarHBondContact O-N 3.02Å; A783-V785 VanDerWaalsContact C-N 3.27Å; A783-V785 PolarHBondContact O-N 3.24Å; A783-P786 WeakPolarHBondContact O-CD 3.39Å; A783-A787 WeakPolarHBondContact O-CB 3.44Å; A783-A787 PolarHBondContact O-N 3.46Å
784	A	90.3	Very high	86.1	Confident	32 Å²	32	57.3 Å²	57.3	26%	0.264	29%	0.292	S	S	.	.	H	α-helix	trans	-62.2	-31.7	176.5	0	0	0	0	0	113.1	W565 L781 V782 A787 L788	W565-A784 HydrophobicContact CD2-CB 4.31Å; L781-A784 VanDerWaalsContact O-CB 3.29Å; L781-A784 WeakPolarHBondContact O-CB 3.46Å; L781-A784 PolarHBondContact O-N 3.46Å; V782-A784 PolarHBondContact O-N 2.99Å; V782-A784 VanDerWaalsContact O-N 3.08Å; A784-A787 PolarHBondContact O-N 3.42Å; A784-L788 PolarHBondContact O-N 2.91Å
785	V	88.8	Confident	87	Confident	103 Å²	103	49.7 Å²	49.7	62%	0.624	26%	0.256	S	S	*	.	H	α-helix	trans	-71.7	-52.9	-178.7	174.5	0	0	0	0	111.8	V782 A783 A787 L788 L789	V782-V785 PolarHBondContact O-N 2.85Å; V782-V785 VanDerWaalsContact O-N 3.16Å; A783-V785 VanDerWaalsContact C-N 3.27Å; A783-V785 PolarHBondContact O-N 3.24Å; V785-A787 PolarHBondContact O-N 2.84Å; V785-L788 WeakPolarHBondContact O-CB 3.34Å; V785-L788 PolarHBondContact O-N 3.16Å; V785-L789 PolarHBondContact O-N 3.04Å
786	P	87.9	Confident	87.1	Confident	37 Å²	37	49.3 Å²	49.3	24%	0.24	25%	0.254	C	S	.	.	H	α-helix	trans	-60	-34	170.8	-23.6	33.4	0	0	0	112.9	F540 I562 V782 A783 L788 L789 C790	F540-P786 HydrophobicContact CE2-CB 4.25Å; F540-P786 HydrophobicContact CZ-CB 4.02Å; I562-P786 HydrophobicContact CD1-CB 4.03Å; I562-P786 HydrophobicContact CD1-CG 4.48Å; I562-P786 HydrophobicContact CG1-CB 4.36Å; V782-P786 WeakPolarHBondContact O-CD 3.48Å; A783-P786 WeakPolarHBondContact O-CD 3.39Å; P786-L788 VanDerWaalsContact C-N 3.35Å; P786-L788 PolarHBondContact O-N 3.23Å; P786-L789 PolarHBondContact O-N 3Å; P786-C790 WeakPolarHBondContact O-CB 3.32Å; P786-C790 PolarHBondContact O-N 3.27Å
787	A	91.3	Very high	87.1	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-64.6	-37.4	176.6	0	0	0	0	0	112.6	I562 W565 T566 A783 A784 V785 C790 T791	I562-A787 HydrophobicContact CG2-CB 4.13Å; W565-A787 HydrophobicContact CB-CB 3.43Å; W565-A787 VanDerWaalsContact CB-CB 3.43Å; W565-A787 HydrophobicContact CG-CB 4.47Å; T566-A787 HydrophobicContact CG2-CB 3.77Å; T566-A787 WeakPolarHBondContact CG2-O 3.38Å; A783-A787 WeakPolarHBondContact O-CB 3.44Å; A783-A787 PolarHBondContact O-N 3.46Å; A784-A787 PolarHBondContact O-N 3.42Å; V785-A787 PolarHBondContact O-N 2.84Å; A787-C790 PolarHBondContact O-N 3.29Å; A787-T791 WeakPolarHBondContact O-CB 3.26Å; A787-T791 PolarHBondContact O-N 3.48Å; A787-T791 PolarHBondContact O-OG1 3.03Å
788	L	89.2	Confident	87.3	Confident	95 Å²	95	38.7 Å²	38.7	50%	0.497	21%	0.207	S	C	.	.	H	α-helix	trans	-60.7	-47.4	174.1	-174.2	75.9	0	0	0	111.1	L569 A784 V785 P786 T791 I792	L569-L788 HydrophobicContact CD1-CB 4.41Å; L569-L788 HydrophobicContact CD1-CD1 4.18Å; A784-L788 PolarHBondContact O-N 2.91Å; V785-L788 WeakPolarHBondContact O-CB 3.34Å; V785-L788 PolarHBondContact O-N 3.16Å; P786-L788 VanDerWaalsContact C-N 3.35Å; P786-L788 PolarHBondContact O-N 3.23Å; L788-T791 WeakPolarHBondContact O-CB 3.12Å; L788-T791 PolarHBondContact O-N 3.43Å; L788-I792 HydrophobicContact CG-CD1 4.37Å; L788-I792 WeakPolarHBondContact O-CG1 3.42Å; L788-I792 PolarHBondContact O-N 2.86Å
789	L	86	Confident	87.4	Confident	67 Å²	67	32.6 Å²	32.6	35%	0.351	18%	0.184	S	C	.	.	H	α-helix	trans	-61.8	-45.1	177.5	-69.7	173.1	0	0	0	111.9	V785 P786 T791 I792 L793 V973	V785-L789 PolarHBondContact O-N 3.04Å; P786-L789 PolarHBondContact O-N 3Å; L789-T791 VanDerWaalsContact C-N 3.33Å; L789-T791 PolarHBondContact O-N 2.89Å; L789-I792 PolarHBondContact O-N 2.94Å; L789-L793 PolarHBondContact O-N 2.89Å; L789-V973 HydrophobicContact CD1-CG1 4.35Å
790	C	87.6	Confident	87.5	Confident	3 Å²	3	32.6 Å²	32.6	2%	0.02	18%	0.184	C	C	.	.	H	α-helix	trans	-63.2	-39.6	177.2	-172.8	0	0	0	0	111.7	F540 T566 P786 A787 I792 L793 I794 W839	F540-C790 HydrophobicContact CE2-CB 4.31Å; F540-C790 HydrophobicContact CZ-CB 4.14Å; T566-C790 HydrophobicContact CG2-CB 3.7Å; P786-C790 WeakPolarHBondContact O-CB 3.32Å; P786-C790 PolarHBondContact O-N 3.27Å; A787-C790 PolarHBondContact O-N 3.29Å; C790-I792 PolarHBondContact O-N 3.02Å; C790-L793 WeakPolarHBondContact O-CB 3.22Å; C790-L793 PolarHBondContact O-N 3.11Å; C790-I794 WeakPolarHBondContact O-CD1 3.42Å; C790-I794 WeakPolarHBondContact O-CG1 3.46Å; C790-I794 PolarHBondContact O-N 3.36Å; C790-I794 VanDerWaalsContact SG-CD1 3.52Å; C790-W839 VanDerWaalsContact SG-CZ3 3.52Å
791	T	90.3	Very high	87.5	Confident	5 Å²	5	29.8 Å²	29.8	3%	0.031	17%	0.17	C	C	.	.	H	α-helix	trans	-61.3	-45	175.8	-59	0	0	0	0	111.6	L569 L573 A787 L788 L789 L793 I794 F795	L569-T791 HydrophobicContact CB-CG2 3.85Å; L573-T791 HydrophobicContact CD1-CG2 3.73Å; A787-T791 WeakPolarHBondContact O-CB 3.26Å; A787-T791 PolarHBondContact O-N 3.48Å; A787-T791 PolarHBondContact O-OG1 3.03Å; L788-T791 WeakPolarHBondContact O-CB 3.12Å; L788-T791 PolarHBondContact O-N 3.43Å; L789-T791 VanDerWaalsContact C-N 3.33Å; L789-T791 PolarHBondContact O-N 2.89Å; T791-L793 VanDerWaalsContact C-N 3.31Å; T791-L793 PolarHBondContact O-N 3.03Å; T791-I794 PolarHBondContact O-N 2.95Å; T791-F795 WeakPolarHBondContact O-CB 3.37Å; T791-F795 PolarHBondContact O-N 3.33Å
792	I	87.3	Confident	87.5	Confident	42 Å²	42	24.7 Å²	24.7	22%	0.215	14%	0.143	C	C	.	.	H	α-helix	trans	-62.6	-41.5	177	-64.5	166.4	0	0	0	110.2	L788 L789 C790 F795 M796 P976 M977	L788-I792 HydrophobicContact CG-CD1 4.37Å; L788-I792 WeakPolarHBondContact O-CG1 3.42Å; L788-I792 PolarHBondContact O-N 2.86Å; L789-I792 PolarHBondContact O-N 2.94Å; C790-I792 PolarHBondContact O-N 3.02Å; I792-F795 PolarHBondContact O-N 2.72Å; I792-M796 HydrophobicContact CG2-CG 4.29Å; I792-M796 WeakPolarHBondContact O-CB 3.37Å; I792-M796 VanDerWaalsContact O-CG 3.23Å; I792-M796 WeakPolarHBondContact O-CG 3.27Å; I792-M796 PolarHBondContact O-N 3.33Å; I792-P976 HydrophobicContact CG2-CB 3.9Å; I792-M977 HydrophobicContact CD1-SD 4.04Å; I792-M977 HydrophobicContact CG2-SD 4.25Å
793	L	85.4	Confident	87.3	Confident	6 Å²	6	21.9 Å²	21.9	3%	0.031	13%	0.126	C	C	.	.	H	α-helix	trans	-59.1	-53.5	177	-169.7	151	0	0	0	112	P536 V537 L789 C790 T791 F795 M796 D797 P976	P536-L793 HydrophobicContact CB-CD1 3.75Å; P536-L793 HydrophobicContact CB-CD2 4.31Å; P536-L793 HydrophobicContact CB-CG 4.29Å; V537-L793 HydrophobicContact CG2-CD2 3.73Å; L789-L793 PolarHBondContact O-N 2.89Å; C790-L793 WeakPolarHBondContact O-CB 3.22Å; C790-L793 PolarHBondContact O-N 3.11Å; T791-L793 VanDerWaalsContact C-N 3.31Å; T791-L793 PolarHBondContact O-N 3.03Å; L793-F795 VanDerWaalsContact C-N 3.32Å; L793-F795 PolarHBondContact O-N 2.66Å; L793-M796 PolarHBondContact O-N 2.83Å; L793-D797 PolarHBondContact O-N 3.12Å; L793-P976 VanDerWaalsContact CA-CG 3.45Å; L793-P976 HydrophobicContact CB-CB 4.45Å; L793-P976 HydrophobicContact CB-CG 3.54Å; L793-P976 HydrophobicContact CD1-CG 3.93Å; L793-P976 HydrophobicContact CG-CG 3.65Å
794	I	87.8	Confident	87	Confident	2 Å²	2	22.3 Å²	22.3	1%	0.01	13%	0.127	C	C	.	.	H	α-helix	trans	-64	-40.9	-178.5	-66	155.7	0	0	0	110.8	C790 T791 Q798 V825 L829 V841	C790-I794 WeakPolarHBondContact O-CD1 3.42Å; C790-I794 WeakPolarHBondContact O-CG1 3.46Å; C790-I794 PolarHBondContact O-N 3.36Å; C790-I794 VanDerWaalsContact SG-CD1 3.52Å; T791-I794 PolarHBondContact O-N 2.95Å; I794-Q798 WeakPolarHBondContact O-CB 3.14Å; I794-Q798 PolarHBondContact O-N 3.11Å; I794-V825 HydrophobicContact CG2-CG1 4.02Å; I794-L829 HydrophobicContact CD1-CD1 3.2Å; I794-L829 HydrophobicContact CG1-CD1 4.32Å; I794-V841 HydrophobicContact CG1-CG2 3.96Å; I794-V841 HydrophobicContact CG2-CG1 4.49Å; I794-V841 HydrophobicContact CG2-CG2 4.34Å
795	F	88.2	Confident	86.8	Confident	21 Å²	21	20.9 Å²	20.9	9%	0.092	12%	0.116	C	C	.	.	H	α-helix	trans	-61.3	-47.9	177.1	178.6	-96.7	0	0	0	111.6	L573 A578 T791 I792 L793 Q799 L822	L573-F795 HydrophobicContact CD1-CB 4.38Å; L573-F795 HydrophobicContact CD1-CD2 3.95Å; L573-F795 HydrophobicContact CD1-CG 4.24Å; A578-F795 HydrophobicContact CB-CE2 4.39Å; A578-F795 HydrophobicContact CB-CZ 4.47Å; T791-F795 WeakPolarHBondContact O-CB 3.37Å; T791-F795 PolarHBondContact O-N 3.33Å; I792-F795 PolarHBondContact O-N 2.72Å; L793-F795 VanDerWaalsContact C-N 3.32Å; L793-F795 PolarHBondContact O-N 2.66Å; F795-Q799 HydrophobicContact CD2-CG 4.08Å; F795-Q799 HydrophobicContact CE1-CG 4.26Å; F795-Q799 HydrophobicContact CE2-CG 3.8Å; F795-Q799 HydrophobicContact CG-CG 4.43Å; F795-Q799 HydrophobicContact CZ-CG 3.91Å; F795-Q799 WeakPolarHBondContact O-CB 3.38Å; F795-Q799 VanDerWaalsContact O-CG 3.25Å; F795-Q799 WeakPolarHBondContact O-CG 3.32Å; F795-Q799 PolarHBondContact O-N 3.03Å; F795-L822 HydrophobicContact CD2-CD1 4.23Å; F795-L822 HydrophobicContact CD2-CD2 3.73Å; F795-L822 HydrophobicContact CE2-CD2 3.92Å
796	M	84.3	Confident	86.4	Confident	9 Å²	9	17.2 Å²	17.2	4%	0.044	9%	0.092	C	C	.	.	H	α-helix	trans	-65.1	-47.9	-179.3	-70.1	-64.1	-77.4	0	0	111.7	I792 L793 Q798 Q799 I800 P976 V979 L980	I792-M796 HydrophobicContact CG2-CG 4.29Å; I792-M796 WeakPolarHBondContact O-CB 3.37Å; I792-M796 VanDerWaalsContact O-CG 3.23Å; I792-M796 WeakPolarHBondContact O-CG 3.27Å; I792-M796 PolarHBondContact O-N 3.33Å; L793-M796 PolarHBondContact O-N 2.83Å; M796-Q798 PolarHBondContact O-N 3.05Å; M796-Q799 PolarHBondContact O-N 3.34Å; M796-I800 HydrophobicContact CB-CD1 4.43Å; M796-I800 HydrophobicContact CE-CD1 4.16Å; M796-I800 WeakPolarHBondContact O-CB 3.46Å; M796-I800 WeakPolarHBondContact O-CD1 3.49Å; M796-I800 WeakPolarHBondContact O-CG1 3.14Å; M796-I800 PolarHBondContact O-N 2.89Å; M796-P976 HydrophobicContact CB-CB 4.41Å; M796-P976 HydrophobicContact CG-CB 4.21Å; M796-V979 HydrophobicContact CE-CB 3.8Å; M796-V979 HydrophobicContact CE-CG1 3.58Å; M796-L980 HydrophobicContact CE-CD2 3.62Å; M796-L980 HydrophobicContact CE-CG 3.72Å; M796-L980 HydrophobicContact SD-CD2 3.71Å; M796-L980 HydrophobicContact SD-CG 4.04Å
797	D	84.5	Confident	85.9	Confident	12 Å²	12	16.8 Å²	16.8	6%	0.064	9%	0.086	C	C	.	.	H	α-helix	trans	-61.3	-44.5	179.2	-84.2	3.9	0	0	0	111.3	L793 T801 V841	L793-D797 PolarHBondContact O-N 3.12Å; D797-T801 WeakPolarHBondContact O-CB 3.43Å; D797-T801 WeakPolarHBondContact O-CG2 3.3Å; D797-T801 PolarHBondContact O-N 3.34Å; D797-T801 PolarHBondContact O-OG1 3.49Å; D797-V841 HydrophobicContact CB-CG1 3.59Å
798	Q	88.9	Confident	84.9	Confident	0 Å²	0	23.1 Å²	23.1	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-68.9	-39.5	-179.5	-174.9	59.5	42.9	0	0	113.2	Y520 I794 M796 T801 A802 V825	Y520-Q798 PolarHBondContact OH-NE2 3.44Å; I794-Q798 WeakPolarHBondContact O-CB 3.14Å; I794-Q798 PolarHBondContact O-N 3.11Å; M796-Q798 PolarHBondContact O-N 3.05Å; Q798-T801 VanDerWaalsContact C-OG1 3.27Å; Q798-T801 WeakPolarHBondContact CA-OG1 3.27Å; Q798-T801 PolarHBondContact O-OG1 3.39Å; Q798-A802 VanDerWaalsContact O-CB 3.31Å; Q798-A802 WeakPolarHBondContact O-CB 3.45Å; Q798-A802 PolarHBondContact O-N 3.05Å; Q798-A802 VanDerWaalsContact O-N 3.14Å; Q798-V825 HydrophobicContact CG-CG2 4.44Å
799	Q	87	Confident	84	Confident	1 Å²	1	22 Å²	22	1%	0.005	11%	0.106	C	C	.	.	H	α-helix	trans	-77.7	-40.3	-177.7	-66.6	-58.8	-20.1	0	0	112	V582 F795 M796 T801 A802 V803	V582-Q799 HydrophobicContact CG2-CB 3.8Å; V582-Q799 HydrophobicContact CG2-CG 3.86Å; F795-Q799 HydrophobicContact CD2-CG 4.08Å; F795-Q799 HydrophobicContact CE1-CG 4.26Å; F795-Q799 HydrophobicContact CE2-CG 3.8Å; F795-Q799 HydrophobicContact CG-CG 4.43Å; F795-Q799 HydrophobicContact CZ-CG 3.91Å; F795-Q799 WeakPolarHBondContact O-CB 3.38Å; F795-Q799 VanDerWaalsContact O-CG 3.25Å; F795-Q799 WeakPolarHBondContact O-CG 3.32Å; F795-Q799 PolarHBondContact O-N 3.03Å; M796-Q799 PolarHBondContact O-N 3.34Å; Q799-T801 PolarHBondContact O-N 3.43Å; Q799-A802 PolarHBondContact O-N 3.36Å; Q799-V803 WeakPolarHBondContact O-CG2 3.48Å; Q799-V803 PolarHBondContact O-N 2.75Å
800	I	84.8	Confident	83.5	Confident	4 Å²	4	20.5 Å²	20.5	2%	0.021	10%	0.097	C	C	.	.	H	α-helix	trans	-63.9	-44.6	177.5	-65.3	165.4	0	0	0	110.3	I585 F593 M796 A802 V803 I804 V979	I585-I800 HydrophobicContact CD1-CG1 3.99Å; F593-I800 HydrophobicContact CB-CG2 4.48Å; F593-I800 HydrophobicContact CD1-CB 4.36Å; F593-I800 HydrophobicContact CD1-CD1 4.4Å; F593-I800 HydrophobicContact CD1-CG2 3.4Å; F593-I800 VanDerWaalsContact CD1-CG2 3.4Å; F593-I800 HydrophobicContact CD2-CD1 4.47Å; F593-I800 HydrophobicContact CE1-CB 4.33Å; F593-I800 HydrophobicContact CE1-CD1 4.43Å; F593-I800 HydrophobicContact CE1-CG2 3.8Å; F593-I800 HydrophobicContact CG-CD1 4.4Å; F593-I800 HydrophobicContact CG-CG2 4.12Å; F593-I800 HydrophobicContact CZ-CD1 4.49Å; M796-I800 HydrophobicContact CB-CD1 4.43Å; M796-I800 HydrophobicContact CE-CD1 4.16Å; M796-I800 WeakPolarHBondContact O-CB 3.46Å; M796-I800 WeakPolarHBondContact O-CD1 3.49Å; M796-I800 WeakPolarHBondContact O-CG1 3.14Å; M796-I800 PolarHBondContact O-N 2.89Å; I800-A802 PolarHBondContact O-N 3.03Å; I800-V803 PolarHBondContact O-N 3.49Å; I800-I804 HydrophobicContact CG2-CD1 3.75Å; I800-I804 HydrophobicContact CG2-CG1 4.38Å; I800-I804 VanDerWaalsContact O-CG1 3.25Å; I800-I804 WeakPolarHBondContact O-CG1 3Å; I800-I804 PolarHBondContact O-N 3.25Å; I800-V979 HydrophobicContact CD1-CG1 3.7Å
801	T	86.4	Confident	82.9	Confident	2 Å²	2	25.7 Å²	25.7	1%	0.012	12%	0.119	C	C	.	.	H	α-helix	trans	-58.9	-44.9	174.6	45.7	0	0	0	0	112.4	D797 Q798 Q799 V803 I804 I805 A842 T844	D797-T801 WeakPolarHBondContact O-CB 3.43Å; D797-T801 WeakPolarHBondContact O-CG2 3.3Å; D797-T801 PolarHBondContact O-N 3.34Å; D797-T801 PolarHBondContact O-OG1 3.49Å; Q798-T801 VanDerWaalsContact C-OG1 3.27Å; Q798-T801 WeakPolarHBondContact CA-OG1 3.27Å; Q798-T801 PolarHBondContact O-OG1 3.39Å; Q799-T801 PolarHBondContact O-N 3.43Å; T801-V803 VanDerWaalsContact C-N 3.34Å; T801-V803 PolarHBondContact O-N 3.4Å; T801-I804 PolarHBondContact O-N 2.85Å; T801-I805 WeakPolarHBondContact O-CD1 3.29Å; T801-I805 WeakPolarHBondContact O-CG1 3.14Å; T801-I805 PolarHBondContact O-N 3.39Å; T801-I805 VanDerWaalsContact O-N 3.11Å; T801-A842 HydrophobicContact CG2-CB 3.81Å; T801-A842 WeakPolarHBondContact OG1-CB 3.42Å; T801-T844 HydrophobicContact CG2-CG2 3.18Å
802	A	85.6	Confident	82.4	Confident	0 Å²	0	27.4 Å²	27.4	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-62	-40.1	178.3	0	0	0	0	0	112.1	Q798 Q799 I800 N806 Y818	Q798-A802 VanDerWaalsContact O-CB 3.31Å; Q798-A802 WeakPolarHBondContact O-CB 3.45Å; Q798-A802 PolarHBondContact O-N 3.05Å; Q798-A802 VanDerWaalsContact O-N 3.14Å; Q799-A802 PolarHBondContact O-N 3.36Å; I800-A802 PolarHBondContact O-N 3.03Å; A802-N806 VanDerWaalsContact O-CB 3.24Å; A802-N806 WeakPolarHBondContact O-CB 3.43Å; A802-N806 PolarHBondContact O-N 3.49Å; A802-N806 PolarHBondContact O-ND2 2.62Å; A802-Y818 HydrophobicContact CB-CD1 3.7Å; A802-Y818 HydrophobicContact CB-CE1 3.74Å
803	V	82.5	Confident	81.7	Confident	16 Å²	16	34 Å²	34	10%	0.097	16%	0.155	C	C	.	.	H	α-helix	trans	-64.1	-46.4	175.6	173	0	0	0	0	111.6	V582 Q799 I800 T801 I805 N806 R807 Y818	V582-V803 HydrophobicContact CG1-CG2 3.09Å; Q799-V803 WeakPolarHBondContact O-CG2 3.48Å; Q799-V803 PolarHBondContact O-N 2.75Å; I800-V803 PolarHBondContact O-N 3.49Å; T801-V803 VanDerWaalsContact C-N 3.34Å; T801-V803 PolarHBondContact O-N 3.4Å; V803-I805 VanDerWaalsContact C-N 3.28Å; V803-I805 PolarHBondContact O-N 3Å; V803-N806 PolarHBondContact O-N 2.95Å; V803-R807 PolarHBondContact O-N 3Å; V803-Y818 HydrophobicContact CG2-CE1 4.17Å
804	I	83.9	Confident	81.4	Confident	11 Å²	11	35.4 Å²	35.4	6%	0.056	16%	0.161	C	C	.	.	H	α-helix	trans	-57.1	-44.6	-179.9	-68.2	163.5	0	0	0	110.9	E590 A594 I800 T801 R807 T844 I848	E590-I804 HydrophobicContact CG-CD1 4.15Å; E590-I804 HydrophobicContact CG-CG1 3.36Å; E590-I804 WeakPolarHBondContact OE1-CA 3.33Å; E590-I804 WeakPolarHBondContact OE1-CG1 3.24Å; A594-I804 HydrophobicContact CB-CD1 4.34Å; I800-I804 HydrophobicContact CG2-CD1 3.75Å; I800-I804 HydrophobicContact CG2-CG1 4.38Å; I800-I804 VanDerWaalsContact O-CG1 3.25Å; I800-I804 WeakPolarHBondContact O-CG1 3Å; I800-I804 PolarHBondContact O-N 3.25Å; T801-I804 PolarHBondContact O-N 2.85Å; I804-R807 WeakPolarHBondContact O-CB 3.25Å; I804-T844 HydrophobicContact CD1-CG2 4.09Å; I804-I848 HydrophobicContact CG2-CD1 3.82Å; I804-I848 HydrophobicContact CG2-CG1 3.85Å
805	I	84.4	Confident	80.4	Confident	3 Å²	3	36.1 Å²	36.1	2%	0.015	17%	0.169	C	C	.	.	H	α-helix	trans	-70.9	-39.9	-179.4	-64.7	162.8	0	0	0	110.9	Q526 L528 T529 T801 V803 R807 H810 L812 S847 V851	Q526-I805 HydrophobicContact CG-CG2 3.86Å; L528-I805 HydrophobicContact CB-CG2 4.15Å; T529-I805 HydrophobicContact CG2-CD1 3.98Å; T529-I805 WeakPolarHBondContact OG1-CD1 3.43Å; T801-I805 WeakPolarHBondContact O-CD1 3.29Å; T801-I805 WeakPolarHBondContact O-CG1 3.14Å; T801-I805 PolarHBondContact O-N 3.39Å; T801-I805 VanDerWaalsContact O-N 3.11Å; V803-I805 VanDerWaalsContact C-N 3.28Å; V803-I805 PolarHBondContact O-N 3Å; I805-R807 PolarHBondContact O-N 3.44Å; I805-R807 VanDerWaalsContact O-N 3.12Å; I805-H810 PolarHBondContact O-CD2 3.3Å; I805-L812 WeakPolarHBondContact O-CD1 3.34Å; I805-S847 VanDerWaalsContact CD1-CB 3.5Å; I805-V851 HydrophobicContact CG1-CG2 4.49Å; I805-V851 HydrophobicContact CG2-CG2 3.95Å
806	N	81.9	Confident	79.7	Confident	26 Å²	26	35.5 Å²	35.5	14%	0.139	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.9	17.1	-176.1	-67.1	-32.8	0	0	0	113.8	Q526 A802 V803 K808 C816	Q526-N806 PolarHBondContact NE2-OD1 2.84Å; Q526-N806 VanDerWaalsContact NE2-OD1 3.11Å; A802-N806 VanDerWaalsContact O-CB 3.24Å; A802-N806 WeakPolarHBondContact O-CB 3.43Å; A802-N806 PolarHBondContact O-N 3.49Å; A802-N806 PolarHBondContact O-ND2 2.62Å; V803-N806 PolarHBondContact O-N 2.95Å; N806-K808 PolarHBondContact O-N 3.03Å; N806-C816 HydrophobicContact CB-CB 4.45Å
807	R	77.1	Confident	79.7	Confident	28 Å²	28	35 Å²	35	11%	0.106	17%	0.165	C	C	.	.			trans	-59.6	134.1	179.2	-166.7	172.7	175.5	-174.6	-12.7	111.4	V803 I804 I805 E809 H810	V803-R807 PolarHBondContact O-N 3Å; I804-R807 WeakPolarHBondContact O-CB 3.25Å; I805-R807 PolarHBondContact O-N 3.44Å; I805-R807 VanDerWaalsContact O-N 3.12Å; R807-E809 HydrophobicContact CG-CB 4.05Å; R807-E809 HydrophobicContact CG-CG 4.17Å; R807-E809 IonicContact CZ-OE1 3.16Å; R807-E809 IonicContact CZ-OE2 3.83Å; R807-E809 IonicContact NE-OE1 2.64Å; R807-E809 PolarHBondContact NE-OE1 3.12Å; R807-E809 IonicContact NE-OE2 3.37Å; R807-E809 PolarHBondContact NE-OE2 3.31Å; R807-E809 VanDerWaalsContact NE-OE2 3.15Å; R807-E809 IonicContact NH1-OE2 2.71Å; R807-E809 IonicContact NH2-OE1 3.49Å; R807-E809 PolarHBondContact NH2-OE1 3.34Å; R807-E809 IonicContact NH2-OE2 3.7Å; R807-E809 PolarHBondContact NH2-OE2 2.94Å; R807-E809 PolarHBondContact O-N 3.18Å; R807-H810 WeakPolarHBondContact O-CB 3.34Å; R807-H810 PolarHBondContact O-N 3.17Å
808	K	69	Low	79.8	Confident	132 Å²	132	35.3 Å²	35.3	57%	0.574	17%	0.165	S	C	*	.	G	3₁₀ helix	trans	-58.3	-25.5	178.4	-66.6	179	-175.2	168.2	0	113.2	N806 H810 K811 L1004	N806-K808 PolarHBondContact O-N 3.03Å; K808-H810 PolarHBondContact O-N 3.18Å; K808-K811 PolarHBondContact O-N 3.03Å; K808-K811 VanDerWaalsContact O-N 3.08Å; K808-L1004 PolarHBondContact NZ-O 2.86Å
809	E	70.8	Confident	79.8	Confident	72 Å²	72	35.7 Å²	35.7	34%	0.336	17%	0.167	S	C	.	.	G	3₁₀ helix	trans	-63.2	-28.7	176.6	-67.5	179.7	-154.6	0	0	113.3	R587 R807 K811 F869	R587-E809 IonicContact CZ-OE1 2.84Å; R587-E809 IonicContact NH1-OE1 2.81Å; R587-E809 PolarHBondContact NH1-OE1 3.41Å; R587-E809 IonicContact NH2-OE1 4Å; R807-E809 HydrophobicContact CG-CB 4.05Å; R807-E809 HydrophobicContact CG-CG 4.17Å; R807-E809 IonicContact CZ-OE1 3.16Å; R807-E809 IonicContact CZ-OE2 3.83Å; R807-E809 IonicContact NE-OE1 2.64Å; R807-E809 PolarHBondContact NE-OE1 3.12Å; R807-E809 IonicContact NE-OE2 3.37Å; R807-E809 PolarHBondContact NE-OE2 3.31Å; R807-E809 VanDerWaalsContact NE-OE2 3.15Å; R807-E809 IonicContact NH1-OE2 2.71Å; R807-E809 IonicContact NH2-OE1 3.49Å; R807-E809 PolarHBondContact NH2-OE1 3.34Å; R807-E809 IonicContact NH2-OE2 3.7Å; R807-E809 PolarHBondContact NH2-OE2 2.94Å; R807-E809 PolarHBondContact O-N 3.18Å; E809-K811 PolarHBondContact O-N 3.37Å; E809-F869 WeakPolarHBondContact O-CE1 3.48Å
810	H	75.5	Confident	79.9	Confident	35 Å²	35	36.7 Å²	36.7	16%	0.162	17%	0.172	C	C	.	.	G	3₁₀ helix	trans	-72.4	-6.9	175.9	-71.1	-42.7	0	0	0	113.1	I805 R807 K808 L812 F869 I872	I805-H810 PolarHBondContact O-CD2 3.3Å; R807-H810 WeakPolarHBondContact O-CB 3.34Å; R807-H810 PolarHBondContact O-N 3.17Å; K808-H810 PolarHBondContact O-N 3.18Å; H810-L812 HydrophobicContact CB-CD2 4.5Å; H810-L812 HydrophobicContact CB-CG 4.05Å; H810-L812 PolarHBondContact O-N 3.49Å; H810-F869 WeakPolarHBondContact O-CZ 2.82Å; H810-I872 HydrophobicContact CB-CD1 3.41Å; H810-I872 VanDerWaalsContact CB-CD1 3.41Å; H810-I872 WeakPolarHBondContact ND1-CD1 3.36Å
811	K	75.8	Confident	80.2	Confident	112 Å²	112	36.6 Å²	36.6	49%	0.487	17%	0.171	S	C	.	.			trans	48.8	41.9	179.6	-59.9	-179.1	-175.2	174.8	0	112.4	K808 E809 F869	K808-K811 PolarHBondContact O-N 3.03Å; K808-K811 VanDerWaalsContact O-N 3.08Å; E809-K811 PolarHBondContact O-N 3.37Å; K811-F869 HydrophobicContact CB-CE1 4.35Å; K811-F869 HydrophobicContact CD-CD1 4.16Å; K811-F869 HydrophobicContact CD-CE1 4.25Å; K811-F869 HydrophobicContact CG-CE1 4.2Å; K811-F869 PolarHBondContact NZ-O 3.46Å
812	L	78.9	Confident	80.4	Confident	41 Å²	41	36.5 Å²	36.5	22%	0.215	17%	0.171	C	C	.	.			trans	-60.8	138.3	174.2	-67.6	176.9	0	0	0	109.9	L528 I805 H810 I872 E874	L528-L812 HydrophobicContact CD1-CD2 4.19Å; I805-L812 WeakPolarHBondContact O-CD1 3.34Å; H810-L812 HydrophobicContact CB-CD2 4.5Å; H810-L812 HydrophobicContact CB-CG 4.05Å; H810-L812 PolarHBondContact O-N 3.49Å; L812-I872 HydrophobicContact CD2-CB 4.14Å; L812-I872 HydrophobicContact CD2-CG2 4.26Å; L812-E874 VanDerWaalsContact CA-OE1 3.24Å; L812-E874 WeakPolarHBondContact CA-OE1 3.16Å; L812-E874 WeakPolarHBondContact CB-OE1 3.31Å; L812-E874 HydrophobicContact CD2-CG 3.85Å; L812-E874 WeakPolarHBondContact CD2-OE1 3.26Å
813	K	72.2	Confident	80.7	Confident	180 Å²	180	38 Å²	38	78%	0.783	18%	0.179	S	C	*	.			trans	-103.5	-29.9	-172.3	-70.4	-177.6	-178.4	174.7	0	112	E874	K813-E874 PolarHBondContact N-OE1 3.07Å
814	K	80.2	Confident	81.1	Confident	36 Å²	36	38.2 Å²	38.2	16%	0.157	18%	0.179	C	C	.	.	S	Bend	trans	-90.6	140.4	177.8	-63.7	163.6	-163.7	173.2	0	108.3	F461 S464 D465 D468 E874	F461-K814 HydrophobicContact CB-CD 4.03Å; F461-K814 HydrophobicContact CB-CG 4.21Å; F461-K814 HydrophobicContact CD1-CD 4.36Å; F461-K814 HydrophobicContact CD1-CG 3.92Å; F461-K814 HydrophobicContact CD2-CG 4.41Å; F461-K814 HydrophobicContact CE1-CG 4.4Å; F461-K814 HydrophobicContact CG-CD 4.28Å; F461-K814 HydrophobicContact CG-CG 3.93Å; S464-K814 PolarHBondContact OG-NZ 3.47Å; D465-K814 VanDerWaalsContact OD1-CD 3.32Å; D465-K814 WeakPolarHBondContact OD1-CD 3.37Å; D465-K814 WeakPolarHBondContact OD1-CE 3.48Å; D465-K814 IonicContact OD1-NZ 3.55Å; D465-K814 PolarHBondContact OD1-NZ 2.94Å; D468-K814 IonicContact OD2-NZ 2.62Å; D468-K814 PolarHBondContact OD2-NZ 2.94Å; D468-K814 VanDerWaalsContact OD2-NZ 3.14Å; K814-E874 WeakPolarHBondContact CB-OE2 3.42Å; K814-E874 HydrophobicContact CD-CB 3.9Å; K814-E874 WeakPolarHBondContact CD-OE2 3.2Å; K814-E874 WeakPolarHBondContact CG-OE2 3.42Å; K814-E874 PolarHBondContact N-OE1 3.24Å; K814-E874 PolarHBondContact N-OE2 3.39Å; K814-E874 PolarHBondContact NZ-O 2.88Å
815	G	66.6	Low	81.5	Confident	18 Å²	18	37.8 Å²	37.8	19%	0.186	18%	0.177	C	C	.	.	P	Polyproline II helix	trans	-62.9	160.8	-178.5	0	0	0	0	0	112.8	K458	K458-G815 WeakPolarHBondContact CE-O 3.29Å; K458-G815 PolarHBondContact NZ-O 3.14Å; K458-G815 VanDerWaalsContact NZ-O 3.13Å
816	C	74.3	Confident	82	Confident	7 Å²	7	37.7 Å²	37.7	5%	0.047	18%	0.177	C	C	.	.	P	Polyproline II helix	trans	-86.8	172.2	-179.3	72.4	0	0	0	0	112.1	E440 K458 N806 Y818	E440-C816 PolarHBondContact OE1-N 3.47Å; E440-C816 PolarHBondContact OE2-SG 3.06Å; K458-C816 WeakPolarHBondContact CE-O 3.1Å; N806-C816 HydrophobicContact CB-CB 4.45Å; C816-Y818 HydrophobicContact CB-CE2 4.14Å; C816-Y818 WeakPolarHBondContact SG-CE2 3.38Å
817	G	83.8	Confident	82.5	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	19%	0.19	C	C	.	.			trans	-155.4	81.8	177.9	0	0	0	0	0	112.4	D454 D821	D454-G817 WeakPolarHBondContact OD2-CA 3.01Å; G817-D821 PolarHBondContact O-N 3.45Å
818	Y	86.4	Confident	83.3	Confident	17 Å²	17	39.9 Å²	39.9	7%	0.067	19%	0.189	C	C	.	.	H	α-helix	trans	-72.5	-36.7	-174.4	-62.6	-78.7	0	0	0	113.1	L441 D454 A802 V803 C816 L822	L441-Y818 HydrophobicContact CD1-CE2 4.32Å; L441-Y818 HydrophobicContact CD2-CD2 3.95Å; L441-Y818 HydrophobicContact CD2-CE2 4.05Å; L441-Y818 HydrophobicContact CG-CD2 4.44Å; L441-Y818 HydrophobicContact CG-CE2 4.24Å; D454-Y818 PolarHBondContact OD2-N 3.45Å; A802-Y818 HydrophobicContact CB-CD1 3.7Å; A802-Y818 HydrophobicContact CB-CE1 3.74Å; V803-Y818 HydrophobicContact CG2-CE1 4.17Å; C816-Y818 HydrophobicContact CB-CE2 4.14Å; C816-Y818 WeakPolarHBondContact SG-CE2 3.38Å; Y818-L822 PolarHBondContact O-N 2.98Å
819	H	88.5	Confident	84.4	Confident	9 Å²	9	33.9 Å²	33.9	4%	0.042	16%	0.164	C	C	.	.	H	α-helix	trans	-73.4	-38.9	-178.7	-62.2	86.1	0	0	0	110.9	L451 D454 V574 D577 S579 L822 L823	L451-H819 HydrophobicContact CB-CB 4.28Å; L451-H819 HydrophobicContact CD1-CB 4.27Å; D454-H819 WeakPolarHBondContact OD2-CB 3.45Å; D454-H819 IonicContact OD2-CG 3.75Å; D454-H819 PolarHBondContact OD2-N 2.96Å; D454-H819 IonicContact OD2-ND1 3.76Å; D454-H819 PolarHBondContact OD2-ND1 3.31Å; V574-H819 HydrophobicContact CG1-CB 4.47Å; D577-H819 IonicContact OD1-NE2 3.01Å; S579-H819 VanDerWaalsContact CB-CE1 3.49Å; S579-H819 WeakPolarHBondContact CB-CE1 3.33Å; S579-H819 VanDerWaalsContact CB-NE2 3.29Å; S579-H819 WeakPolarHBondContact CB-NE2 3.4Å; S579-H819 PolarHBondContact OG-CD2 3.03Å; S579-H819 PolarHBondContact OG-CE1 2.95Å; S579-H819 PolarHBondContact OG-NE2 3.36Å; H819-L822 PolarHBondContact O-N 2.89Å; H819-L823 WeakPolarHBondContact O-CB 3.42Å; H819-L823 PolarHBondContact O-N 2.8Å
820	L	89.5	Confident	85.4	Confident	22 Å²	22	30.9 Å²	30.9	12%	0.115	15%	0.152	C	C	.	.	H	α-helix	trans	-64	-43.1	176.9	-175.9	60.2	0	0	0	111	L451 D454 V455 L823 I824	L451-L820 HydrophobicContact CD1-CB 4.16Å; L451-L820 HydrophobicContact CD1-CD1 4.09Å; D454-L820 HydrophobicContact CB-CB 4.38Å; V455-L820 HydrophobicContact CG2-CD1 4.05Å; V455-L820 HydrophobicContact CG2-CD2 4.28Å; L820-L823 PolarHBondContact O-N 3.47Å; L820-I824 HydrophobicContact CD1-CG1 4.29Å; L820-I824 WeakPolarHBondContact O-CG1 3.39Å; L820-I824 PolarHBondContact O-N 2.97Å
821	D	90.6	Very high	86.2	Confident	1 Å²	1	31.7 Å²	31.7	1%	0.005	16%	0.159	C	C	.	.	H	α-helix	trans	-60.2	-48.1	176.7	-71.2	-18.7	0	0	0	111.8	G525 Q526 G817 L823 I824 V825	G525-D821 WeakPolarHBondContact CA-OD1 3.27Å; G525-D821 PolarHBondContact N-OD1 2.98Å; Q526-D821 WeakPolarHBondContact CB-OD2 3.37Å; Q526-D821 PolarHBondContact N-OD1 2.89Å; Q526-D821 PolarHBondContact N-OD2 2.7Å; G817-D821 PolarHBondContact O-N 3.45Å; D821-L823 VanDerWaalsContact C-N 3.35Å; D821-L823 PolarHBondContact O-N 2.66Å; D821-I824 PolarHBondContact O-N 3.3Å; D821-V825 WeakPolarHBondContact O-CG2 3.24Å; D821-V825 PolarHBondContact O-N 2.84Å; D821-V825 VanDerWaalsContact O-N 3.09Å
822	L	90.3	Very high	86.9	Confident	1 Å²	1	26.4 Å²	26.4	1%	0.005	14%	0.136	C	C	.	.	H	α-helix	trans	-62.8	-39.8	179	-175.9	63.5	0	0	0	112.4	L573 V574 F795 Y818 H819 V825 A826	L573-L822 HydrophobicContact CB-CD2 4.45Å; V574-L822 HydrophobicContact CG2-CB 4.05Å; V574-L822 HydrophobicContact CG2-CD2 3.68Å; V574-L822 HydrophobicContact CG2-CG 3.79Å; F795-L822 HydrophobicContact CD2-CD1 4.23Å; F795-L822 HydrophobicContact CD2-CD2 3.73Å; F795-L822 HydrophobicContact CE2-CD2 3.92Å; Y818-L822 PolarHBondContact O-N 2.98Å; H819-L822 PolarHBondContact O-N 2.89Å; L822-V825 PolarHBondContact O-N 3.22Å; L822-A826 WeakPolarHBondContact O-CB 3.29Å; L822-A826 PolarHBondContact O-N 3.23Å
823	L	92	Very high	87.5	Confident	30 Å²	30	24.5 Å²	24.5	16%	0.157	13%	0.126	C	C	.	.	H	α-helix	trans	-63.8	-46	178.1	-179.4	68.8	0	0	0	111.9	L451 I571 V574 H819 L820 D821 V825 A826 I827	L451-L823 HydrophobicContact CD1-CB 4.43Å; L451-L823 HydrophobicContact CD1-CD2 3.87Å; L451-L823 HydrophobicContact CD2-CD2 3.66Å; L451-L823 HydrophobicContact CG-CD2 4.42Å; I571-L823 HydrophobicContact CG1-CD1 4.44Å; V574-L823 HydrophobicContact CG1-CB 4.5Å; V574-L823 HydrophobicContact CG2-CB 4.35Å; H819-L823 WeakPolarHBondContact O-CB 3.42Å; H819-L823 PolarHBondContact O-N 2.8Å; L820-L823 PolarHBondContact O-N 3.47Å; D821-L823 VanDerWaalsContact C-N 3.35Å; D821-L823 PolarHBondContact O-N 2.66Å; L823-V825 VanDerWaalsContact C-N 3.34Å; L823-A826 WeakPolarHBondContact O-CB 3.5Å; L823-A826 PolarHBondContact O-N 3.26Å; L823-I827 HydrophobicContact CD1-CD1 4.31Å; L823-I827 HydrophobicContact CG-CD1 4.03Å; L823-I827 WeakPolarHBondContact O-CG1 3.19Å; L823-I827 PolarHBondContact O-N 3.25Å
824	I	92.6	Very high	88.3	Confident	21 Å²	21	19 Å²	19	11%	0.108	11%	0.105	C	C	.	.	H	α-helix	trans	-66	-39.6	-179.2	-63.4	-59.4	0	0	0	110.7	Y520 F523 L820 D821 I827 M828	Y520-I824 HydrophobicContact CD2-CB 4.43Å; Y520-I824 HydrophobicContact CD2-CG2 3.94Å; F523-I824 HydrophobicContact CB-CD1 3.6Å; F523-I824 HydrophobicContact CB-CG1 4Å; L820-I824 HydrophobicContact CD1-CG1 4.29Å; L820-I824 WeakPolarHBondContact O-CG1 3.39Å; L820-I824 PolarHBondContact O-N 2.97Å; D821-I824 PolarHBondContact O-N 3.3Å; I824-I827 PolarHBondContact O-N 3.27Å; I824-M828 HydrophobicContact CG2-CG 4.49Å; I824-M828 WeakPolarHBondContact O-CB 3.24Å; I824-M828 WeakPolarHBondContact O-CG 3.34Å; I824-M828 PolarHBondContact O-N 3.24Å
825	V	92.3	Very high	88.7	Confident	2 Å²	2	19.2 Å²	19.2	1%	0.012	11%	0.107	C	C	.	.	H	α-helix	trans	-62	-42.9	172.8	174.8	0	0	0	0	111.3	Y520 L531 I794 Q798 D821 L822 L823 I827 M828 L829	Y520-V825 HydrophobicContact CD2-CG2 3.95Å; Y520-V825 HydrophobicContact CE2-CG2 3.7Å; L531-V825 HydrophobicContact CD2-CG2 4.08Å; I794-V825 HydrophobicContact CG2-CG1 4.02Å; Q798-V825 HydrophobicContact CG-CG2 4.44Å; D821-V825 WeakPolarHBondContact O-CG2 3.24Å; D821-V825 PolarHBondContact O-N 2.84Å; D821-V825 VanDerWaalsContact O-N 3.09Å; L822-V825 PolarHBondContact O-N 3.22Å; L823-V825 VanDerWaalsContact C-N 3.34Å; V825-I827 PolarHBondContact O-N 3.02Å; V825-M828 PolarHBondContact O-N 2.71Å; V825-L829 VanDerWaalsContact O-CB 3.3Å; V825-L829 WeakPolarHBondContact O-CB 3.09Å; V825-L829 PolarHBondContact O-N 2.78Å
826	A	93.3	Very high	89.6	Confident	2 Å²	2	18.4 Å²	18.4	2%	0.017	10%	0.098	C	C	.	.	H	α-helix	trans	-61.2	-45.2	177.6	0	0	0	0	0	112.4	V567 C570 L822 L823 L829 G830	V567-A826 WeakPolarHBondContact CG2-O 3.35Å; C570-A826 HydrophobicContact CB-CB 3.55Å; L822-A826 WeakPolarHBondContact O-CB 3.29Å; L822-A826 PolarHBondContact O-N 3.23Å; L823-A826 WeakPolarHBondContact O-CB 3.5Å; L823-A826 PolarHBondContact O-N 3.26Å; A826-L829 PolarHBondContact O-N 3.02Å; A826-G830 PolarHBondContact O-N 3.36Å; A826-G830 VanDerWaalsContact O-N 3.11Å
827	I	93.4	Very high	90.2	Very high	81 Å²	81	18 Å²	18	42%	0.415	10%	0.096	S	C	.	.	H	α-helix	trans	-61.5	-47.9	177.2	-68	167.7	0	0	0	110.3	L823 I824 V825 L829 G830 V831	L823-I827 HydrophobicContact CD1-CD1 4.31Å; L823-I827 HydrophobicContact CG-CD1 4.03Å; L823-I827 WeakPolarHBondContact O-CG1 3.19Å; L823-I827 PolarHBondContact O-N 3.25Å; I824-I827 PolarHBondContact O-N 3.27Å; V825-I827 PolarHBondContact O-N 3.02Å; I827-L829 VanDerWaalsContact C-N 3.31Å; I827-L829 PolarHBondContact O-N 3.04Å; I827-G830 PolarHBondContact O-N 2.97Å; I827-G830 VanDerWaalsContact O-N 3.14Å; I827-V831 PolarHBondContact O-N 2.97Å; I827-V831 VanDerWaalsContact O-N 3.09Å
828	M	92.9	Very high	90.5	Very high	18 Å²	18	18.2 Å²	18.2	9%	0.089	10%	0.097	C	C	.	.	H	α-helix	trans	-66.2	-33	-179.8	-72.9	-42.9	-56	0	0	112.9	L515 T516 A519 I824 V825 G830 V831 C832	L515-M828 HydrophobicContact CD2-CE 4.42Å; L515-M828 HydrophobicContact CG-CE 3.97Å; T516-M828 HydrophobicContact CG2-CB 4.13Å; T516-M828 HydrophobicContact CG2-CE 4.01Å; A519-M828 HydrophobicContact CB-CE 4.02Å; A519-M828 HydrophobicContact CB-CG 4Å; A519-M828 HydrophobicContact CB-SD 3.4Å; A519-M828 WeakPolarHBondContact CB-SD 3.34Å; I824-M828 HydrophobicContact CG2-CG 4.49Å; I824-M828 WeakPolarHBondContact O-CB 3.24Å; I824-M828 WeakPolarHBondContact O-CG 3.34Å; I824-M828 PolarHBondContact O-N 3.24Å; V825-M828 PolarHBondContact O-N 2.71Å; M828-G830 VanDerWaalsContact C-N 3.32Å; M828-G830 PolarHBondContact O-N 3.29Å; M828-V831 HydrophobicContact CE-CB 4.26Å; M828-V831 HydrophobicContact CE-CG1 4.32Å; M828-V831 PolarHBondContact O-N 2.89Å; M828-C832 WeakPolarHBondContact O-CB 3.35Å; M828-C832 PolarHBondContact O-N 2.82Å; M828-C832 PolarHBondContact O-SG 3.45Å
829	L	92	Very high	90.7	Very high	7 Å²	7	17.5 Å²	17.5	4%	0.037	9%	0.094	C	C	.	.	H	α-helix	trans	-62.6	-41	172.4	-173.8	152.3	0	0	0	111.6	T566 V567 I794 V825 A826 I827 C832 S833 W839	T566-L829 WeakPolarHBondContact OG1-CD2 3.42Å; V567-L829 HydrophobicContact CG2-CD2 3.73Å; I794-L829 HydrophobicContact CD1-CD1 3.2Å; I794-L829 HydrophobicContact CG1-CD1 4.32Å; V825-L829 VanDerWaalsContact O-CB 3.3Å; V825-L829 WeakPolarHBondContact O-CB 3.09Å; V825-L829 PolarHBondContact O-N 2.78Å; A826-L829 PolarHBondContact O-N 3.02Å; I827-L829 VanDerWaalsContact C-N 3.31Å; I827-L829 PolarHBondContact O-N 3.04Å; L829-C832 PolarHBondContact O-N 3.05Å; L829-S833 WeakPolarHBondContact O-CB 3.33Å; L829-S833 PolarHBondContact O-N 3.29Å; L829-S833 PolarHBondContact O-OG 2.98Å; L829-W839 HydrophobicContact CD1-CG 4.35Å; L829-W839 HydrophobicContact CG-CG 4.23Å
830	G	92.3	Very high	90.8	Very high	8 Å²	8	17.5 Å²	17.5	8%	0.082	9%	0.094	C	C	.	.	H	α-helix	trans	-60.5	-47.7	174.7	0	0	0	0	0	112.3	V567 A826 I827 M828 C832 S833 I834	V567-G830 VanDerWaalsContact CG2-CA 3.41Å; A826-G830 PolarHBondContact O-N 3.36Å; A826-G830 VanDerWaalsContact O-N 3.11Å; I827-G830 PolarHBondContact O-N 2.97Å; I827-G830 VanDerWaalsContact O-N 3.14Å; M828-G830 VanDerWaalsContact C-N 3.32Å; M828-G830 PolarHBondContact O-N 3.29Å; G830-C832 PolarHBondContact O-N 3.14Å; G830-S833 PolarHBondContact O-N 2.84Å; G830-I834 WeakPolarHBondContact O-CG1 3.36Å; G830-I834 PolarHBondContact O-N 2.99Å
831	V	92.1	Very high	90.8	Very high	53 Å²	53	16.5 Å²	16.5	32%	0.321	9%	0.089	S	C	.	.	H	α-helix	trans	-59.3	-48.3	175.9	176.7	0	0	0	0	110.8	L515 I827 M828 S833 I834 M835	L515-V831 HydrophobicContact CD2-CG1 4.07Å; I827-V831 PolarHBondContact O-N 2.97Å; I827-V831 VanDerWaalsContact O-N 3.09Å; M828-V831 HydrophobicContact CE-CB 4.26Å; M828-V831 HydrophobicContact CE-CG1 4.32Å; M828-V831 PolarHBondContact O-N 2.89Å; V831-S833 VanDerWaalsContact C-N 3.29Å; V831-S833 PolarHBondContact O-N 2.65Å; V831-I834 PolarHBondContact O-N 3.31Å; V831-M835 HydrophobicContact CG1-CG 4.48Å; V831-M835 HydrophobicContact CG1-SD 3.87Å; V831-M835 WeakPolarHBondContact O-CB 3.49Å; V831-M835 VanDerWaalsContact O-CG 3.31Å; V831-M835 WeakPolarHBondContact O-CG 3.42Å; V831-M835 PolarHBondContact O-N 3.21Å
832	C	90.4	Very high	90.8	Very high	1 Å²	1	16.5 Å²	16.5	1%	0.007	9%	0.089	C	C	.	.	H	α-helix	trans	-61.1	-37.3	176.1	-75.5	0	0	0	0	112.8	T516 M828 L829 G830 M835 G836 L837	T516-C832 WeakPolarHBondContact CG2-SG 3.25Å; M828-C832 WeakPolarHBondContact O-CB 3.35Å; M828-C832 PolarHBondContact O-N 2.82Å; M828-C832 PolarHBondContact O-SG 3.45Å; L829-C832 PolarHBondContact O-N 3.05Å; G830-C832 PolarHBondContact O-N 3.14Å; C832-M835 PolarHBondContact O-N 3.48Å; C832-G836 CarbonylContact O-C 3.48Å; C832-G836 WeakPolarHBondContact O-CA 3.31Å; C832-G836 PolarHBondContact O-N 3.37Å; C832-L837 HydrophobicContact CB-CB 4.01Å; C832-L837 PolarHBondContact O-N 3.32Å
833	S	91.3	Very high	90.7	Very high	0 Å²	0	17 Å²	17	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-67.1	-45.4	179.8	-58.8	0	0	0	0	111.7	T560 G563 L829 G830 V831 M835 G836 W839	T560-S833 PolarHBondContact OG1-O 3.29Å; G563-S833 WeakPolarHBondContact CA-OG 3.46Å; L829-S833 WeakPolarHBondContact O-CB 3.33Å; L829-S833 PolarHBondContact O-N 3.29Å; L829-S833 PolarHBondContact O-OG 2.98Å; G830-S833 PolarHBondContact O-N 2.84Å; V831-S833 VanDerWaalsContact C-N 3.29Å; V831-S833 PolarHBondContact O-N 2.65Å; S833-M835 VanDerWaalsContact C-N 3.32Å; S833-M835 PolarHBondContact O-N 2.83Å; S833-G836 PolarHBondContact O-N 3.05Å; S833-G836 VanDerWaalsContact O-N 3.11Å; S833-W839 PolarHBondContact OG-NE1 3.2Å
834	I	90.3	Very high	90.4	Very high	65 Å²	65	16.3 Å²	16.3	33%	0.333	9%	0.09	S	C	.	.	H	α-helix	trans	-65.7	-36.6	177.8	-69.3	167.7	0	0	0	111.4	L564 L768 M769 G830 V831 G836	L564-I834 HydrophobicContact CD2-CD1 4.36Å; L564-I834 HydrophobicContact CD2-CG1 4.36Å; L768-I834 HydrophobicContact CD1-CG2 3.3Å; L768-I834 HydrophobicContact CG-CG2 4.36Å; M769-I834 PolarHBondContact N-O 3.22Å; G830-I834 WeakPolarHBondContact O-CG1 3.36Å; G830-I834 PolarHBondContact O-N 2.99Å; V831-I834 PolarHBondContact O-N 3.31Å; I834-G836 PolarHBondContact O-N 3.37Å
835	M	87.5	Confident	90	Very high	41 Å²	41	15.3 Å²	15.3	20%	0.202	9%	0.086	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.5	-7.6	176.2	-64.2	-176.2	76.7	0	0	113.3	F511 L515 R765 W767 V831 C832 S833 L837	F511-M835 HydrophobicContact CE1-CE 3.62Å; F511-M835 HydrophobicContact CZ-CE 4.23Å; L515-M835 HydrophobicContact CD2-SD 3.87Å; R765-M835 PolarHBondContact NH2-O 3.17Å; W767-M835 HydrophobicContact CE3-CE 4.11Å; W767-M835 CarbonylContact O-C 3.57Å; W767-M835 WeakPolarHBondContact O-CA 3.36Å; V831-M835 HydrophobicContact CG1-CG 4.48Å; V831-M835 HydrophobicContact CG1-SD 3.87Å; V831-M835 WeakPolarHBondContact O-CB 3.49Å; V831-M835 VanDerWaalsContact O-CG 3.31Å; V831-M835 WeakPolarHBondContact O-CG 3.42Å; V831-M835 PolarHBondContact O-N 3.21Å; C832-M835 PolarHBondContact O-N 3.48Å; S833-M835 VanDerWaalsContact C-N 3.32Å; S833-M835 PolarHBondContact O-N 2.83Å; M835-L837 VanDerWaalsContact C-N 3.28Å; M835-L837 HydrophobicContact CB-CD1 3.83Å; M835-L837 HydrophobicContact CB-CG 3.77Å; M835-L837 HydrophobicContact CE-CD1 4.38Å; M835-L837 PolarHBondContact O-N 2.87Å; M835-L837 HydrophobicContact SD-CD1 4.08Å
836	G	84.9	Confident	89.7	Confident	0 Å²	0	15.6 Å²	15.6	0%	0	9%	0.087	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.7	38.5	-172.4	0	0	0	0	0	113.5	R765 C832 S833 I834	R765-G836 VanDerWaalsContact NH2-C 3.29Å; R765-G836 PolarHBondContact NH2-O 3.41Å; C832-G836 CarbonylContact O-C 3.48Å; C832-G836 WeakPolarHBondContact O-CA 3.31Å; C832-G836 PolarHBondContact O-N 3.37Å; S833-G836 PolarHBondContact O-N 3.05Å; S833-G836 VanDerWaalsContact O-N 3.11Å; I834-G836 PolarHBondContact O-N 3.37Å
837	L	88.7	Confident	89.5	Confident	0 Å²	0	15.6 Å²	15.6	0%	0	9%	0.087	C	C	.	.	P	Polyproline II helix	trans	-89.2	155.9	170.4	-58	173.6	0	0	0	109.8	E508 F511 L515 R559 W767 C832 M835	E508-L837 HydrophobicContact CB-CD2 3.97Å; E508-L837 HydrophobicContact CG-CD2 4.48Å; F511-L837 HydrophobicContact CD1-CD1 3.77Å; F511-L837 HydrophobicContact CD1-CD2 3.93Å; F511-L837 HydrophobicContact CE1-CD1 3.97Å; L515-L837 HydrophobicContact CD2-CD1 4.43Å; R559-L837 PolarHBondContact NE-O 3.45Å; R559-L837 PolarHBondContact NH2-O 3.32Å; R559-L837 VanDerWaalsContact NH2-O 3.14Å; W767-L837 HydrophobicContact CZ3-CD2 4.03Å; C832-L837 HydrophobicContact CB-CB 4.01Å; C832-L837 PolarHBondContact O-N 3.32Å; M835-L837 VanDerWaalsContact C-N 3.28Å; M835-L837 HydrophobicContact CB-CD1 3.83Å; M835-L837 HydrophobicContact CB-CG 3.77Å; M835-L837 HydrophobicContact CE-CD1 4.38Å; M835-L837 PolarHBondContact O-N 2.87Å; M835-L837 HydrophobicContact SD-CD1 4.08Å
838	P	89.3	Confident	89.1	Confident	4 Å²	4	13 Å²	13	3%	0.026	7%	0.073	C	C	.	.	P	Polyproline II helix	trans	-62.2	151.9	173.2	21.3	-26.5	0	0	0	111.6	L496 I504 S509 F840	L496-P838 HydrophobicContact CD2-CB 4.06Å; I504-P838 HydrophobicContact CG2-CG 4.44Å; S509-P838 WeakPolarHBondContact OG-CG 3.29Å; P838-F840 HydrophobicContact CB-CE2 4.33Å; P838-F840 HydrophobicContact CG-CE2 3.83Å; P838-F840 HydrophobicContact CG-CZ 3.96Å; P838-F840 WeakPolarHBondContact O-CD2 3.41Å; P838-F840 VanDerWaalsContact O-CE2 3.26Å; P838-F840 WeakPolarHBondContact O-CE2 3.44Å
839	W	90.6	Very high	88.6	Confident	2 Å²	2	12.7 Å²	12.7	1%	0.008	7%	0.073	C	C	.	.	P	Polyproline II helix	trans	-81.3	134.6	177.3	-55.5	-39	0	0	0	110.6	V537 F540 R559 I562 C790 L829 S833	V537-W839 HydrophobicContact CG1-CB 4.18Å; V537-W839 HydrophobicContact CG1-CE3 4.31Å; F540-W839 HydrophobicContact CD1-CH2 4.38Å; F540-W839 AromaticContact CD1-CZ3 3.65Å; F540-W839 HydrophobicContact CD1-CZ3 3.65Å; F540-W839 AromaticContact CE1-CH2 3.77Å; F540-W839 HydrophobicContact CE1-CH2 3.77Å; F540-W839 AromaticContact CE1-CZ3 3.45Å; F540-W839 HydrophobicContact CE1-CZ3 3.45Å; F540-W839 VanDerWaalsContact CE1-CZ3 3.45Å; R559-W839 HydrophobicContact CG-CZ2 3.93Å; I562-W839 HydrophobicContact CB-CH2 4.49Å; I562-W839 HydrophobicContact CG2-CH2 3.86Å; I562-W839 HydrophobicContact CG2-CZ2 4.49Å; C790-W839 VanDerWaalsContact SG-CZ3 3.52Å; L829-W839 HydrophobicContact CD1-CG 4.35Å; L829-W839 HydrophobicContact CG-CG 4.23Å; S833-W839 PolarHBondContact OG-NE1 3.2Å
840	F	90.4	Very high	88.3	Confident	8 Å²	8	12.3 Å²	12.3	4%	0.035	7%	0.071	C	C	.	.			trans	-112.8	134	-180	-70.4	-86.1	0	0	0	109.9	S509 A513 T516 L531 G532 P838	S509-F840 WeakPolarHBondContact O-CZ 3.09Å; A513-F840 HydrophobicContact CB-CD1 4.23Å; A513-F840 HydrophobicContact CB-CE1 3.6Å; A513-F840 HydrophobicContact CB-CE2 4.49Å; A513-F840 HydrophobicContact CB-CZ 3.77Å; A513-F840 VanDerWaalsContact N-CE2 3.31Å; A513-F840 VanDerWaalsContact N-CZ 3.33Å; T516-F840 HydrophobicContact CG2-CB 4.36Å; T516-F840 HydrophobicContact CG2-CD2 4.04Å; L531-F840 HydrophobicContact CB-CB 4.35Å; G532-F840 VanDerWaalsContact C-CD1 3.49Å; P838-F840 HydrophobicContact CB-CE2 4.33Å; P838-F840 HydrophobicContact CG-CE2 3.83Å; P838-F840 HydrophobicContact CG-CZ 3.96Å; P838-F840 WeakPolarHBondContact O-CD2 3.41Å; P838-F840 VanDerWaalsContact O-CE2 3.26Å; P838-F840 WeakPolarHBondContact O-CE2 3.44Å
841	V	89.6	Confident	88.1	Confident	1 Å²	1	12 Å²	12	1%	0.006	7%	0.068	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	163.1	-179.5	-172.2	0	0	0	0	108.4	L531 G532 V537 I794 D797 A843	L531-V841 CarbonylContact C-O 3.58Å; L531-V841 WeakPolarHBondContact CA-O 3.4Å; G532-V841 PolarHBondContact N-O 2.96Å; G532-V841 PolarHBondContact O-N 3.44Å; V537-V841 HydrophobicContact CG2-CG2 4.12Å; I794-V841 HydrophobicContact CG1-CG2 3.96Å; I794-V841 HydrophobicContact CG2-CG1 4.49Å; I794-V841 HydrophobicContact CG2-CG2 4.34Å; D797-V841 HydrophobicContact CB-CG1 3.59Å; V841-A843 PolarHBondContact O-N 3.12Å
842	A	89.8	Confident	87.6	Confident	2 Å²	2	12.7 Å²	12.7	2%	0.017	7%	0.07	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.9	127.7	176.5	0	0	0	0	0	112.6	T529 L531 T801	T529-A842 HydrophobicContact CG2-CB 3.38Å; L531-A842 HydrophobicContact CD2-CB 4.35Å; T801-A842 HydrophobicContact CG2-CB 3.81Å; T801-A842 WeakPolarHBondContact OG1-CB 3.42Å
843	A	88.6	Confident	87.1	Confident	12 Å²	12	13.4 Å²	13.4	10%	0.099	7%	0.074	C	C	.	.			trans	-95.5	115.6	175.9	0	0	0	0	0	110.3	I530 V841 L846 S847	I530-A843 PolarHBondContact O-N 3.1Å; V841-A843 PolarHBondContact O-N 3.12Å; A843-L846 HydrophobicContact CB-CB 4.12Å; A843-L846 HydrophobicContact CB-CD1 4.37Å; A843-L846 HydrophobicContact CB-CD2 4.48Å; A843-S847 VanDerWaalsContact O-CB 3.27Å; A843-S847 WeakPolarHBondContact O-CB 3.32Å; A843-S847 PolarHBondContact O-N 3.18Å; A843-S847 PolarHBondContact O-OG 2.99Å
844	T	86.4	Confident	86.7	Confident	14 Å²	14	13.4 Å²	13.4	9%	0.086	7%	0.074	C	C	.	.	H	α-helix	trans	-58.1	-56.3	-177	48.4	0	0	0	0	113	F593 I597 T801 I804 L846 S847 I848	F593-T844 HydrophobicContact CD1-CG2 4.4Å; F593-T844 HydrophobicContact CE1-CG2 3.83Å; I597-T844 WeakPolarHBondContact CG2-OG1 3.5Å; T801-T844 HydrophobicContact CG2-CG2 3.18Å; I804-T844 HydrophobicContact CD1-CG2 4.09Å; T844-L846 PolarHBondContact O-N 3.19Å; T844-S847 PolarHBondContact O-N 3.5Å; T844-I848 VanDerWaalsContact O-CG1 3.28Å; T844-I848 WeakPolarHBondContact O-CG1 3.43Å; T844-I848 PolarHBondContact O-N 2.81Å
845	V	84.4	Confident	86.3	Confident	1 Å²	1	14.1 Å²	14.1	1%	0.006	8%	0.075	C	C	.	.	H	α-helix	trans	-64.5	-42.1	-173.1	176.8	0	0	0	0	111.7	I597 F601 I848 S849 M911	I597-V845 HydrophobicContact CG2-CG2 3.73Å; F601-V845 HydrophobicContact CD2-CG2 4.08Å; F601-V845 HydrophobicContact CE2-CG2 4.19Å; F601-V845 HydrophobicContact CG-CG2 4.39Å; F601-V845 HydrophobicContact CZ-CB 4.46Å; V845-I848 PolarHBondContact O-N 2.98Å; V845-S849 WeakPolarHBondContact O-CB 2.86Å; V845-S849 PolarHBondContact O-N 2.89Å; V845-S849 PolarHBondContact O-OG 3.03Å; V845-M911 HydrophobicContact CG1-CB 4.33Å
846	L	85.3	Confident	85.5	Confident	8 Å²	8	13.6 Å²	13.6	4%	0.042	7%	0.074	C	C	.	.	H	α-helix	trans	-65.6	-41.9	177.6	-81.3	69.4	0	0	0	110.6	C485 I530 F601 A843 T844 S849 H850	C485-L846 HydrophobicContact CB-CD2 4.31Å; I530-L846 HydrophobicContact CB-CB 4.39Å; I530-L846 HydrophobicContact CG2-CB 4.4Å; I530-L846 HydrophobicContact CG2-CD2 4.33Å; F601-L846 HydrophobicContact CE1-CD1 4.33Å; F601-L846 HydrophobicContact CZ-CD1 4.28Å; A843-L846 HydrophobicContact CB-CB 4.12Å; A843-L846 HydrophobicContact CB-CD1 4.37Å; A843-L846 HydrophobicContact CB-CD2 4.48Å; T844-L846 PolarHBondContact O-N 3.19Å; L846-S849 PolarHBondContact O-N 3.07Å; L846-H850 WeakPolarHBondContact O-CB 3.47Å; L846-H850 PolarHBondContact O-N 3.19Å
847	S	88.8	Confident	84.8	Confident	1 Å²	1	16.5 Å²	16.5	1%	0.007	9%	0.088	C	C	.	.	H	α-helix	trans	-67.7	-41.2	178.2	-55.1	0	0	0	0	112.5	I530 I805 A843 T844 S849 H850 V851	I530-S847 PolarHBondContact N-OG 2.73Å; I805-S847 VanDerWaalsContact CD1-CB 3.5Å; A843-S847 VanDerWaalsContact O-CB 3.27Å; A843-S847 WeakPolarHBondContact O-CB 3.32Å; A843-S847 PolarHBondContact O-N 3.18Å; A843-S847 PolarHBondContact O-OG 2.99Å; T844-S847 PolarHBondContact O-N 3.5Å; S847-S849 VanDerWaalsContact C-N 3.33Å; S847-S849 PolarHBondContact O-N 3.37Å; S847-H850 WeakPolarHBondContact O-CB 3.48Å; S847-H850 PolarHBondContact O-N 3.29Å; S847-V851 VanDerWaalsContact O-CG2 3.29Å; S847-V851 WeakPolarHBondContact O-CG2 3.2Å; S847-V851 PolarHBondContact O-N 3.41Å
848	I	85.3	Confident	83.5	Confident	26 Å²	26	17.8 Å²	17.8	13%	0.133	10%	0.096	C	C	.	.	H	α-helix	trans	-62.8	-42.3	174.1	-66.6	164.9	0	0	0	110.4	I804 T844 V845 H850 V851 N852	I804-I848 HydrophobicContact CG2-CD1 3.82Å; I804-I848 HydrophobicContact CG2-CG1 3.85Å; T844-I848 VanDerWaalsContact O-CG1 3.28Å; T844-I848 WeakPolarHBondContact O-CG1 3.43Å; T844-I848 PolarHBondContact O-N 2.81Å; V845-I848 PolarHBondContact O-N 2.98Å; I848-H850 VanDerWaalsContact C-N 3.3Å; I848-H850 PolarHBondContact O-N 3.18Å; I848-V851 PolarHBondContact O-N 3.01Å; I848-N852 WeakPolarHBondContact O-CB 3.4Å; I848-N852 PolarHBondContact O-N 2.68Å; I848-N852 PolarHBondContact O-ND2 2.95Å
849	S	82.6	Confident	81.7	Confident	12 Å²	12	21.2 Å²	21.2	8%	0.084	13%	0.133	C	C	.	.	H	α-helix	trans	-62.9	-38.1	176.6	-62.5	0	0	0	0	111.7	V845 L846 S847 N852 S853	V845-S849 WeakPolarHBondContact O-CB 2.86Å; V845-S849 PolarHBondContact O-N 2.89Å; V845-S849 PolarHBondContact O-OG 3.03Å; L846-S849 PolarHBondContact O-N 3.07Å; S847-S849 VanDerWaalsContact C-N 3.33Å; S847-S849 PolarHBondContact O-N 3.37Å; S849-N852 PolarHBondContact O-N 2.76Å; S849-S853 PolarHBondContact O-N 3.18Å
850	H	87	Confident	79.5	Confident	0 Å²	0	26.7 Å²	26.7	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-62.4	-49.1	174	-177.6	-156.4	0	0	0	111.9	L481 L528 I530 L846 S847 I848 N852 S853 L854 T878	L481-H850 HydrophobicContact CD1-CB 3.73Å; L481-H850 WeakPolarHBondContact CD1-CD2 3.48Å; L481-H850 HydrophobicContact CD2-CB 4.08Å; L528-H850 PolarHBondContact O-ND1 2.98Å; I530-H850 HydrophobicContact CD1-CB 3.76Å; I530-H850 HydrophobicContact CG1-CB 4.37Å; L846-H850 WeakPolarHBondContact O-CB 3.47Å; L846-H850 PolarHBondContact O-N 3.19Å; S847-H850 WeakPolarHBondContact O-CB 3.48Å; S847-H850 PolarHBondContact O-N 3.29Å; I848-H850 VanDerWaalsContact C-N 3.3Å; I848-H850 PolarHBondContact O-N 3.18Å; H850-N852 PolarHBondContact O-N 3.21Å; H850-S853 PolarHBondContact O-N 2.96Å; H850-S853 PolarHBondContact O-OG 3.34Å; H850-L854 WeakPolarHBondContact NE2-CD1 3.45Å; H850-L854 PolarHBondContact O-N 3.4Å; H850-T878 PolarHBondContact NE2-OG1 3.49Å
851	V	86.3	Confident	77.3	Confident	2 Å²	2	28.3 Å²	28.3	1%	0.012	18%	0.182	C	C	.	.	H	α-helix	trans	-58.8	-45.8	176.2	173.8	0	0	0	0	111.4	L528 I805 S847 I848 S853 L854 K855 I872	L528-V851 HydrophobicContact CB-CG2 4.13Å; L528-V851 HydrophobicContact CD1-CG2 4.2Å; I805-V851 HydrophobicContact CG1-CG2 4.49Å; I805-V851 HydrophobicContact CG2-CG2 3.95Å; S847-V851 VanDerWaalsContact O-CG2 3.29Å; S847-V851 WeakPolarHBondContact O-CG2 3.2Å; S847-V851 PolarHBondContact O-N 3.41Å; I848-V851 PolarHBondContact O-N 3.01Å; V851-S853 VanDerWaalsContact C-N 3.29Å; V851-S853 PolarHBondContact O-N 3.41Å; V851-L854 PolarHBondContact O-N 3.01Å; V851-L854 VanDerWaalsContact O-N 3.11Å; V851-K855 PolarHBondContact O-N 3.1Å; V851-I872 HydrophobicContact CG1-CD1 3.33Å; V851-I872 HydrophobicContact CG1-CG1 4.14Å; V851-I872 HydrophobicContact CG1-CG2 4.46Å
852	N	81.4	Confident	75.3	Confident	67 Å²	67	29.1 Å²	29.1	36%	0.358	19%	0.189	S	C	.	.	H	α-helix	trans	-64.4	-31.9	179.2	-77.3	-24.2	0	0	0	112.8	I848 S849 H850 L854 K855	I848-N852 WeakPolarHBondContact O-CB 3.4Å; I848-N852 PolarHBondContact O-N 2.68Å; I848-N852 PolarHBondContact O-ND2 2.95Å; S849-N852 PolarHBondContact O-N 2.76Å; H850-N852 PolarHBondContact O-N 3.21Å; N852-L854 VanDerWaalsContact C-N 3.28Å; N852-L854 PolarHBondContact O-N 3.37Å; N852-K855 WeakPolarHBondContact O-CB 3.26Å
853	S	80.6	Confident	73.2	Confident	15 Å²	15	30.6 Å²	30.6	11%	0.105	20%	0.199	C	C	.	.	H	α-helix	trans	-69.7	-25.2	175.4	79.4	0	0	0	0	113.2	Q473 S477 S849 H850 V851	Q473-S853 PolarHBondContact NE2-O 2.98Å; S477-S853 WeakPolarHBondContact CB-OG 3.35Å; S477-S853 VanDerWaalsContact OG-CB 3.31Å; S477-S853 WeakPolarHBondContact OG-CB 3.41Å; S477-S853 PolarHBondContact OG-OG 3.46Å; S849-S853 PolarHBondContact O-N 3.18Å; H850-S853 PolarHBondContact O-N 2.96Å; H850-S853 PolarHBondContact O-OG 3.34Å; V851-S853 VanDerWaalsContact C-N 3.29Å; V851-S853 PolarHBondContact O-N 3.41Å
854	L	83.3	Confident	71.4	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.9	9.1	-177.6	-65.4	168	0	0	0	113.6	L528 H850 V851 N852 V856 I872 R873	L528-L854 HydrophobicContact CD2-CD1 3.53Å; H850-L854 WeakPolarHBondContact NE2-CD1 3.45Å; H850-L854 PolarHBondContact O-N 3.4Å; V851-L854 PolarHBondContact O-N 3.01Å; V851-L854 VanDerWaalsContact O-N 3.11Å; N852-L854 VanDerWaalsContact C-N 3.28Å; N852-L854 PolarHBondContact O-N 3.37Å; L854-V856 PolarHBondContact O-N 2.88Å; L854-I872 HydrophobicContact CB-CG2 4.03Å; L854-R873 PolarHBondContact O-N 3.46Å
855	K	80.8	Confident	69.6	Low	81 Å²	81	33.5 Å²	33.5	35%	0.352	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.1	123.2	176.3	170	154	-174.2	-168.8	0	110.4	Q473 V851 N852 E857 F869	Q473-K855 PolarHBondContact NE2-O 3.38Å; V851-K855 PolarHBondContact O-N 3.1Å; N852-K855 WeakPolarHBondContact O-CB 3.26Å; K855-E857 HydrophobicContact CG-CG 4.49Å; K855-F869 HydrophobicContact CB-CE2 4.25Å; K855-F869 HydrophobicContact CD-CD2 3.85Å; K855-F869 HydrophobicContact CD-CE2 3.79Å; K855-F869 HydrophobicContact CG-CD2 3.66Å; K855-F869 HydrophobicContact CG-CE2 3.51Å
856	V	72.3	Confident	68.1	Low	30 Å²	30	39.6 Å²	39.6	18%	0.182	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	124.3	175.5	-176.5	0	0	0	0	109.9	L854 L870 G871 R873	L854-V856 PolarHBondContact O-N 2.88Å; V856-L870 PolarHBondContact O-N 3.17Å; V856-L870 VanDerWaalsContact O-N 3.1Å; V856-G871 WeakPolarHBondContact CB-O 3.47Å; V856-G871 PolarHBondContact N-O 3.42Å; V856-R873 HydrophobicContact CG2-CG 3.68Å
857	E	70.5	Confident	66.8	Low	61 Å²	61	42.1 Å²	42.1	29%	0.285	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	150.3	173.1	-74.2	163.5	-155.6	0	0	109.5	K713 K855 G859 P867	K713-E857 WeakPolarHBondContact CE-OE2 3.36Å; K713-E857 IonicContact NZ-OE1 2.95Å; K713-E857 PolarHBondContact NZ-OE1 2.81Å; K713-E857 IonicContact NZ-OE2 2.66Å; K713-E857 PolarHBondContact NZ-OE2 3Å; K855-E857 HydrophobicContact CG-CG 4.49Å; E857-G859 PolarHBondContact O-N 3.16Å; E857-P867 HydrophobicContact CB-CB 4.29Å
858	S	60.5	Low	65.4	Low	26 Å²	26	44.5 Å²	44.5	18%	0.182	28%	0.278	C	S	.	.			trans	-65.5	128.1	-176.5	61.2	0	0	0	0	112.4	K868	S858-K868 PolarHBondContact N-O 3.01Å; S858-K868 PolarHBondContact OG-N 3.5Å; S858-K868 PolarHBondContact OG-O 3.09Å
859	G	51.3	Low	64.8	Low	77 Å²	77	45.2 Å²	45.2	79%	0.794	28%	0.28	S	S	*	.	S	Bend	trans	-87	-7.2	-177.4	0	0	0	0	0	116.2	E857	E857-G859 PolarHBondContact O-N 3.16Å
860	C	45.1	Very low	64.1	Low	116 Å²	116	49.7 Å²	49.7	78%	0.784	30%	0.303	S	S	*	.			trans	-129.5	83.6	177.1	-66.3	0	0	0	0	108.7
861	S	43	Very low	63.7	Low	42 Å²	42	50 Å²	50	29%	0.294	31%	0.306	S	S	.	.			trans	-80.6	132	157.1	-71.3	0	0	0	0	106.8	E865	S861-E865 WeakPolarHBondContact CB-O 3.21Å; S861-E865 PolarHBondContact OG-O 2.98Å
862	A	48.7	Very low	63.5	Low	19 Å²	19	50.7 Å²	50.7	16%	0.157	31%	0.309	C	S	.	.			trans	-49.8	152.3	156.2	0	0	0	0	0	108	G864 E865	A862-G864 PolarHBondContact O-N 3.2Å; A862-E865 PolarHBondContact O-N 3.14Å; A862-E865 VanDerWaalsContact O-N 3.14Å
863	P	44.9	Very low	63.6	Low	32 Å²	32	50.5 Å²	50.5	21%	0.208	30%	0.304	C	S	.	.	T	Hydrogen-bonded Turn	trans	-41.3	132.1	173.2	-27.3	36	0	0	0	109.6	E142 P154 K287	E142-P863 WeakPolarHBondContact OE1-CB 3.41Å; P154-P863 HydrophobicContact CB-CB 4.21Å; P154-P863 WeakPolarHBondContact CB-O 2.94Å; P154-P863 HydrophobicContact CG-CB 3.59Å; P154-P863 WeakPolarHBondContact CG-O 3.42Å; K287-P863 HydrophobicContact CD-CG 4.09Å
864	G	50.1	Low	63.7	Low	50 Å²	50	50.4 Å²	50.4	52%	0.515	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	89.8	-15.1	175.9	0	0	0	0	0	117.4	A862	A862-G864 PolarHBondContact O-N 3.2Å
865	E	49.9	Very low	63.9	Low	38 Å²	38	50.4 Å²	50.4	18%	0.178	30%	0.302	C	S	.	.	P	Polyproline II helix	trans	-88.1	125.9	-178.3	-173.8	176.5	-170.8	0	0	112.2	S861 A862 K868	S861-E865 WeakPolarHBondContact CB-O 3.21Å; S861-E865 PolarHBondContact OG-O 2.98Å; A862-E865 PolarHBondContact O-N 3.14Å; A862-E865 VanDerWaalsContact O-N 3.14Å; E865-K868 WeakPolarHBondContact OE1-CE 3.09Å; E865-K868 IonicContact OE1-NZ 2.72Å; E865-K868 PolarHBondContact OE1-NZ 3.4Å
866	Q	52.2	Low	64.3	Low	129 Å²	129	47.4 Å²	47.4	60%	0.603	29%	0.288	S	S	*	.	P	Polyproline II helix	trans	-63.1	142.1	174.1	-72.2	-86.7	-17.6	0	0	110.6	K868	Q866-K868 PolarHBondContact O-N 2.89Å
867	P	58.1	Low	65.2	Low	61 Å²	61	47.5 Å²	47.5	40%	0.396	29%	0.288	S	S	.	.	P	Polyproline II helix	trans	-60.6	121.9	-176.9	24.7	-33.6	0	0	0	110.9	E857	E857-P867 HydrophobicContact CB-CB 4.29Å
868	K	60.1	Low	66.1	Low	51 Å²	51	44.6 Å²	44.6	22%	0.222	28%	0.275	C	S	.	.	P	Polyproline II helix	trans	-81.8	134.5	179.1	-77.1	175.7	173.5	160.9	0	110.4	S858 E865 Q866 L870	S858-K868 PolarHBondContact N-O 3.01Å; S858-K868 PolarHBondContact OG-N 3.5Å; S858-K868 PolarHBondContact OG-O 3.09Å; E865-K868 WeakPolarHBondContact OE1-CE 3.09Å; E865-K868 IonicContact OE1-NZ 2.72Å; E865-K868 PolarHBondContact OE1-NZ 3.4Å; Q866-K868 PolarHBondContact O-N 2.89Å; K868-L870 PolarHBondContact O-N 2.68Å
869	F	73.3	Confident	67.5	Low	41 Å²	41	43.5 Å²	43.5	18%	0.18	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	109.5	171.9	176	-118.9	0	0	0	110.3	E809 H810 K811 K855 G871 I872	E809-F869 WeakPolarHBondContact O-CE1 3.48Å; H810-F869 WeakPolarHBondContact O-CZ 2.82Å; K811-F869 HydrophobicContact CB-CE1 4.35Å; K811-F869 HydrophobicContact CD-CD1 4.16Å; K811-F869 HydrophobicContact CD-CE1 4.25Å; K811-F869 HydrophobicContact CG-CE1 4.2Å; K811-F869 PolarHBondContact NZ-O 3.46Å; K855-F869 HydrophobicContact CB-CE2 4.25Å; K855-F869 HydrophobicContact CD-CD2 3.85Å; K855-F869 HydrophobicContact CD-CE2 3.79Å; K855-F869 HydrophobicContact CG-CD2 3.66Å; K855-F869 HydrophobicContact CG-CE2 3.51Å; F869-G871 VanDerWaalsContact CE2-C 3.5Å; F869-G871 WeakPolarHBondContact CE2-O 3.34Å; F869-I872 HydrophobicContact CE2-CG1 4.19Å; F869-I872 HydrophobicContact CZ-CD1 3.96Å; F869-I872 HydrophobicContact CZ-CG1 3.97Å
870	L	66.3	Low	69.5	Low	105 Å²	105	43 Å²	43	55%	0.55	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	-27.9	-177.1	-74.3	167.6	0	0	0	112.5	V856 K868	V856-L870 PolarHBondContact O-N 3.17Å; V856-L870 VanDerWaalsContact O-N 3.1Å; K868-L870 PolarHBondContact O-N 2.68Å
871	G	78.3	Confident	71.7	Confident	7 Å²	7	41.2 Å²	41.2	7%	0.072	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	142.6	-177	-179.4	0	0	0	0	0	112.2	V856 F869	V856-G871 WeakPolarHBondContact CB-O 3.47Å; V856-G871 PolarHBondContact N-O 3.42Å; F869-G871 VanDerWaalsContact CE2-C 3.5Å; F869-G871 WeakPolarHBondContact CE2-O 3.34Å
872	I	83.8	Confident	74	Confident	16 Å²	16	39.2 Å²	39.2	8%	0.082	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	145.7	176.1	-75	143.8	0	0	0	110.1	L528 H810 L812 V851 L854 F869 E874	L528-I872 HydrophobicContact CD1-CG2 4.11Å; H810-I872 HydrophobicContact CB-CD1 3.41Å; H810-I872 VanDerWaalsContact CB-CD1 3.41Å; H810-I872 WeakPolarHBondContact ND1-CD1 3.36Å; L812-I872 HydrophobicContact CD2-CB 4.14Å; L812-I872 HydrophobicContact CD2-CG2 4.26Å; V851-I872 HydrophobicContact CG1-CD1 3.33Å; V851-I872 HydrophobicContact CG1-CG1 4.14Å; V851-I872 HydrophobicContact CG1-CG2 4.46Å; L854-I872 HydrophobicContact CB-CG2 4.03Å; F869-I872 HydrophobicContact CE2-CG1 4.19Å; F869-I872 HydrophobicContact CZ-CD1 3.96Å; F869-I872 HydrophobicContact CZ-CG1 3.97Å; I872-E874 PolarHBondContact O-N 2.99Å
873	R	82.9	Confident	76	Confident	64 Å²	64	38.5 Å²	38.5	24%	0.242	21%	0.205	C	C	.	.			trans	-79.8	115.1	171	-72.6	-178.2	-176.4	150.5	4.9	110.5	N471 L854 V856	N471-R873 PolarHBondContact ND2-NH1 3.17Å; N471-R873 PolarHBondContact ND2-NH2 3.42Å; L854-R873 PolarHBondContact O-N 3.46Å; V856-R873 HydrophobicContact CG2-CG 3.68Å
874	E	83.8	Confident	78.2	Confident	12 Å²	12	39.2 Å²	39.2	6%	0.056	21%	0.208	C	C	.	.			trans	-87.1	112.3	173.8	-65.9	157.7	165.7	0	0	109.2	L528 L812 K813 K814 I872	L528-E874 HydrophobicContact CD1-CG 4.45Å; L812-E874 VanDerWaalsContact CA-OE1 3.24Å; L812-E874 WeakPolarHBondContact CA-OE1 3.16Å; L812-E874 WeakPolarHBondContact CB-OE1 3.31Å; L812-E874 HydrophobicContact CD2-CG 3.85Å; L812-E874 WeakPolarHBondContact CD2-OE1 3.26Å; K813-E874 PolarHBondContact N-OE1 3.07Å; K814-E874 WeakPolarHBondContact CB-OE2 3.42Å; K814-E874 HydrophobicContact CD-CB 3.9Å; K814-E874 WeakPolarHBondContact CD-OE2 3.2Å; K814-E874 WeakPolarHBondContact CG-OE2 3.42Å; K814-E874 PolarHBondContact N-OE1 3.24Å; K814-E874 PolarHBondContact N-OE2 3.39Å; K814-E874 PolarHBondContact NZ-O 2.88Å; I872-E874 PolarHBondContact O-N 2.99Å
875	Q	86.8	Confident	80.1	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	20%	0.198	C	C	.	.			trans	-147	154.3	178	47.3	72.8	46.1	0	0	111.3	D465 T878	D465-Q875 VanDerWaalsContact O-CB 3.32Å; D465-Q875 WeakPolarHBondContact O-CB 3.37Å; Q875-T878 PolarHBondContact NE2-OG1 3.37Å; Q875-T878 VanDerWaalsContact OE1-CB 3.28Å; Q875-T878 PolarHBondContact OE1-OG1 3.02Å
876	R	89.3	Confident	81.8	Confident	19 Å²	19	37.9 Å²	37.9	7%	0.072	19%	0.19	C	C	.	.	S	Bend	trans	-96	-24.8	-177.7	-68.8	176.5	-178	-88.1	-7.6	113.5	D465 L522 A524 P527 T878 F880	D465-R876 HydrophobicContact CB-CB 4.42Å; D465-R876 HydrophobicContact CB-CG 3.93Å; D465-R876 WeakPolarHBondContact OD2-CD 3.45Å; D465-R876 IonicContact OD2-CZ 3.31Å; D465-R876 IonicContact OD2-NE 3.84Å; D465-R876 PolarHBondContact OD2-NE 3.26Å; D465-R876 IonicContact OD2-NH2 3.27Å; L522-R876 PolarHBondContact O-NH1 3.06Å; L522-R876 VanDerWaalsContact O-NH1 3.11Å; A524-R876 PolarHBondContact O-NH1 3.41Å; A524-R876 PolarHBondContact O-NH2 3.33Å; A524-R876 VanDerWaalsContact O-NH2 3.08Å; P527-R876 HydrophobicContact CB-CB 4.32Å; P527-R876 HydrophobicContact CB-CG 3.64Å; P527-R876 HydrophobicContact CG-CG 3.69Å; R876-T878 PolarHBondContact O-N 3.32Å; R876-F880 PolarHBondContact O-N 3.31Å
877	V	90.1	Very high	83.4	Confident	31 Å²	31	32.5 Å²	32.5	19%	0.188	17%	0.17	C	C	.	.	H	α-helix	trans	-69.4	-38.5	-166.7	177.4	0	0	0	0	112.4	I466 S469 F880 M881	I466-V877 HydrophobicContact CG2-CG2 4.47Å; S469-V877 WeakPolarHBondContact OG-CG2 3.46Å; V877-F880 PolarHBondContact O-N 2.95Å; V877-M881 HydrophobicContact CG1-CE 4.28Å; V877-M881 HydrophobicContact CG1-CG 3.93Å; V877-M881 WeakPolarHBondContact O-CB 3.17Å; V877-M881 VanDerWaalsContact O-CG 3.22Å; V877-M881 WeakPolarHBondContact O-CG 3.35Å; V877-M881 PolarHBondContact O-N 3.09Å
878	T	90.5	Very high	84.6	Confident	1 Å²	1	32.2 Å²	32.2	1%	0.006	17%	0.169	C	C	.	.	H	α-helix	trans	-56.7	-53.6	176.4	49.2	0	0	0	0	112.2	C474 I478 H850 Q875 R876 F880 M881 I882	C474-T878 HydrophobicContact CB-CG2 4.06Å; I478-T878 HydrophobicContact CD1-CG2 4.31Å; I478-T878 HydrophobicContact CG1-CG2 3.88Å; H850-T878 PolarHBondContact NE2-OG1 3.49Å; Q875-T878 PolarHBondContact NE2-OG1 3.37Å; Q875-T878 VanDerWaalsContact OE1-CB 3.28Å; Q875-T878 PolarHBondContact OE1-OG1 3.02Å; R876-T878 PolarHBondContact O-N 3.32Å; T878-F880 VanDerWaalsContact C-N 3.33Å; T878-F880 PolarHBondContact O-N 3.03Å; T878-M881 PolarHBondContact O-N 3.44Å; T878-I882 VanDerWaalsContact O-CD1 3.28Å; T878-I882 WeakPolarHBondContact O-CD1 3.38Å; T878-I882 WeakPolarHBondContact O-CG1 3.31Å; T878-I882 PolarHBondContact O-N 3.01Å
879	G	89.5	Confident	85.6	Confident	3 Å²	3	29.8 Å²	29.8	3%	0.031	16%	0.158	C	C	.	.	H	α-helix	trans	-57.1	-48	177.6	0	0	0	0	0	111.3	M881 I882 F883	G879-M881 PolarHBondContact O-N 3Å; G879-I882 PolarHBondContact O-N 3.47Å; G879-F883 WeakPolarHBondContact O-CD2 3.43Å; G879-F883 PolarHBondContact O-N 3.32Å; G879-F883 VanDerWaalsContact O-N 3.14Å
880	F	92.6	Very high	85.7	Confident	65 Å²	65	28.2 Å²	28.2	29%	0.285	15%	0.152	S	C	.	.	H	α-helix	trans	-56.3	-47.2	176.1	176	-96.2	0	0	0	112.5	V518 S521 L522 R876 V877 T878 T884	V518-F880 HydrophobicContact CG1-CD2 4Å; V518-F880 HydrophobicContact CG1-CE2 3.78Å; S521-F880 VanDerWaalsContact OG-CA 3.29Å; S521-F880 WeakPolarHBondContact OG-CA 3.4Å; S521-F880 WeakPolarHBondContact OG-CB 3.2Å; S521-F880 PolarHBondContact OG-N 3.27Å; L522-F880 HydrophobicContact CD1-CD2 4.35Å; L522-F880 HydrophobicContact CD1-CE2 4.23Å; L522-F880 HydrophobicContact CD2-CD2 3.94Å; L522-F880 HydrophobicContact CD2-CE2 4.27Å; L522-F880 HydrophobicContact CG-CD2 4.03Å; L522-F880 HydrophobicContact CG-CE2 4.38Å; R876-F880 PolarHBondContact O-N 3.31Å; V877-F880 PolarHBondContact O-N 2.95Å; T878-F880 VanDerWaalsContact C-N 3.33Å; T878-F880 PolarHBondContact O-N 3.03Å; F880-T884 VanDerWaalsContact O-CB 3.31Å; F880-T884 WeakPolarHBondContact O-CB 3.2Å; F880-T884 PolarHBondContact O-N 2.82Å; F880-T884 PolarHBondContact O-OG1 3.5Å
881	M	91.6	Very high	86.2	Confident	79 Å²	79	31.4 Å²	31.4	39%	0.389	16%	0.161	S	C	.	.	H	α-helix	trans	-68	-39.6	-179.9	-72.1	-63.6	-174.2	0	0	112.3	I478 V877 T878 G879 F883 T884 L885	I478-M881 HydrophobicContact CD1-CB 3.88Å; I478-M881 HydrophobicContact CD1-CG 4.12Å; I478-M881 HydrophobicContact CG1-CB 4.14Å; I478-M881 HydrophobicContact CG2-CB 4.09Å; V877-M881 HydrophobicContact CG1-CE 4.28Å; V877-M881 HydrophobicContact CG1-CG 3.93Å; V877-M881 WeakPolarHBondContact O-CB 3.17Å; V877-M881 VanDerWaalsContact O-CG 3.22Å; V877-M881 WeakPolarHBondContact O-CG 3.35Å; V877-M881 PolarHBondContact O-N 3.09Å; T878-M881 PolarHBondContact O-N 3.44Å; G879-M881 PolarHBondContact O-N 3Å; M881-F883 PolarHBondContact O-N 3.46Å; M881-T884 PolarHBondContact O-N 3.2Å; M881-L885 VanDerWaalsContact O-CB 3.29Å; M881-L885 WeakPolarHBondContact O-CB 3.35Å; M881-L885 WeakPolarHBondContact O-CG 3.5Å; M881-L885 PolarHBondContact O-N 2.94Å
882	I	91.3	Very high	85.9	Confident	0 Å²	0	35.2 Å²	35.2	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-59.3	-49.6	177.6	-68.6	155.3	0	0	0	110.4	I478 L481 C485 T878 G879 L885 M886	I478-I882 HydrophobicContact CG2-CG1 4.42Å; L481-I882 HydrophobicContact CB-CD1 3.44Å; L481-I882 VanDerWaalsContact CB-CD1 3.44Å; L481-I882 HydrophobicContact CB-CG1 4.01Å; L481-I882 HydrophobicContact CD1-CD1 3.67Å; L481-I882 HydrophobicContact CG-CD1 4.2Å; C485-I882 HydrophobicContact CB-CG2 4.32Å; T878-I882 VanDerWaalsContact O-CD1 3.28Å; T878-I882 WeakPolarHBondContact O-CD1 3.38Å; T878-I882 WeakPolarHBondContact O-CG1 3.31Å; T878-I882 PolarHBondContact O-N 3.01Å; G879-I882 PolarHBondContact O-N 3.47Å; I882-L885 PolarHBondContact O-N 2.86Å; I882-M886 PolarHBondContact O-N 3.13Å
883	F	92	Very high	85.4	Confident	5 Å²	5	35.1 Å²	35.1	2%	0.022	18%	0.179	C	C	.	.	H	α-helix	trans	-72.9	-32.1	-179	-69.5	-65.8	0	0	0	112.9	A513 S514 G517 V518 I530 L531 G879 M881 M886 G887	A513-F883 VanDerWaalsContact O-CD1 3.26Å; A513-F883 WeakPolarHBondContact O-CD1 3.44Å; S514-F883 PolarHBondContact OG-O 3.44Å; S514-F883 VanDerWaalsContact OG-O 3.04Å; G517-F883 VanDerWaalsContact CA-CG 3.42Å; G517-F883 WeakPolarHBondContact O-CD2 3.38Å; V518-F883 HydrophobicContact CG2-CB 3.82Å; I530-F883 HydrophobicContact CG2-CE1 4.46Å; I530-F883 HydrophobicContact CG2-CE2 4.31Å; I530-F883 HydrophobicContact CG2-CZ 3.65Å; L531-F883 HydrophobicContact CB-CZ 4.49Å; L531-F883 WeakPolarHBondContact O-CZ 3.17Å; G879-F883 WeakPolarHBondContact O-CD2 3.43Å; G879-F883 PolarHBondContact O-N 3.32Å; G879-F883 VanDerWaalsContact O-N 3.14Å; M881-F883 PolarHBondContact O-N 3.46Å; F883-M886 WeakPolarHBondContact O-CB 3.36Å; F883-M886 PolarHBondContact O-N 3.42Å; F883-G887 PolarHBondContact O-N 3.13Å
884	T	91.1	Very high	85	Confident	47 Å²	47	36.2 Å²	36.2	29%	0.288	20%	0.196	S	C	.	.	H	α-helix	trans	-64.9	-44.9	171.6	-57.8	0	0	0	0	111.3	F880 M881 M886 G887 C888	F880-T884 VanDerWaalsContact O-CB 3.31Å; F880-T884 WeakPolarHBondContact O-CB 3.2Å; F880-T884 PolarHBondContact O-N 2.82Å; F880-T884 PolarHBondContact O-OG1 3.5Å; M881-T884 PolarHBondContact O-N 3.2Å; T884-M886 VanDerWaalsContact C-N 3.28Å; T884-M886 PolarHBondContact O-N 3.42Å; T884-G887 PolarHBondContact O-N 3.01Å; T884-C888 PolarHBondContact O-N 2.95Å; T884-C888 PolarHBondContact O-SG 2.74Å
885	L	88.6	Confident	84.7	Confident	58 Å²	58	40.1 Å²	40.1	30%	0.304	22%	0.22	S	C	.	.	H	α-helix	trans	-63.4	-34.4	174.1	-73.7	170	0	0	0	111.7	I478 Y482 M881 I882 C888 S889	I478-L885 HydrophobicContact CG2-CD1 3.56Å; Y482-L885 HydrophobicContact CD2-CB 3.77Å; Y482-L885 HydrophobicContact CE2-CB 4.04Å; M881-L885 VanDerWaalsContact O-CB 3.29Å; M881-L885 WeakPolarHBondContact O-CB 3.35Å; M881-L885 WeakPolarHBondContact O-CG 3.5Å; M881-L885 PolarHBondContact O-N 2.94Å; I882-L885 PolarHBondContact O-N 2.86Å; L885-C888 CarbonylContact O-C 3.6Å; L885-C888 PolarHBondContact O-N 3.34Å; L885-S889 WeakPolarHBondContact O-CB 3.36Å; L885-S889 PolarHBondContact O-N 2.9Å
886	M	87.1	Confident	84.1	Confident	1 Å²	1	40.4 Å²	40.4	1%	0.005	22%	0.222	C	C	.	.	H	α-helix	trans	-61.2	-47.6	172.6	-160.3	69.1	73.6	0	0	111.4	Y482 C485 M486 L510 I882 F883 T884 C888 S889	Y482-M886 HydrophobicContact CE2-SD 4.42Å; C485-M886 VanDerWaalsContact C-CE 3.47Å; C485-M886 HydrophobicContact CB-CE 3.53Å; M486-M886 VanDerWaalsContact CA-CE 3.42Å; M486-M886 HydrophobicContact CB-CE 3.77Å; M486-M886 HydrophobicContact CB-SD 3.64Å; M486-M886 HydrophobicContact CG-SD 3.77Å; M486-M886 VanDerWaalsContact N-CE 3.29Å; L510-M886 WeakPolarHBondContact CD2-O 3.35Å; L510-M886 HydrophobicContact CG-CG 4.32Å; I882-M886 PolarHBondContact O-N 3.13Å; F883-M886 WeakPolarHBondContact O-CB 3.36Å; F883-M886 PolarHBondContact O-N 3.42Å; T884-M886 VanDerWaalsContact C-N 3.28Å; T884-M886 PolarHBondContact O-N 3.42Å; M886-C888 VanDerWaalsContact C-N 3.32Å; M886-C888 PolarHBondContact O-N 3.24Å; M886-S889 VanDerWaalsContact O-CB 3.23Å; M886-S889 WeakPolarHBondContact O-CB 3.48Å; M886-S889 PolarHBondContact O-N 3.42Å; M886-S889 VanDerWaalsContact O-N 3.17Å; M886-S889 PolarHBondContact O-OG 3.45Å
887	G	85	Confident	83.7	Confident	17 Å²	17	43 Å²	43	18%	0.175	23%	0.234	C	C	.	.	H	α-helix	trans	-62	-39.5	174.8	0	0	0	0	0	112.7	S514 F883 T884 S889	S514-G887 WeakPolarHBondContact OG-CA 3.39Å; S514-G887 PolarHBondContact OG-N 3.49Å; F883-G887 PolarHBondContact O-N 3.13Å; T884-G887 PolarHBondContact O-N 3.01Å; G887-S889 PolarHBondContact O-N 2.99Å
888	C	83.4	Confident	83.3	Confident	55 Å²	55	46 Å²	46	37%	0.372	25%	0.245	S	C	.	.	H	α-helix	trans	-72.4	-15.3	177.3	-62	0	0	0	0	113.6	T884 L885 M886 V890 F891 M892	T884-C888 PolarHBondContact O-N 2.95Å; T884-C888 PolarHBondContact O-SG 2.74Å; L885-C888 CarbonylContact O-C 3.6Å; L885-C888 PolarHBondContact O-N 3.34Å; M886-C888 VanDerWaalsContact C-N 3.32Å; M886-C888 PolarHBondContact O-N 3.24Å; C888-V890 PolarHBondContact O-N 3.46Å; C888-F891 WeakPolarHBondContact O-CB 3.41Å; C888-F891 PolarHBondContact O-N 2.98Å; C888-M892 PolarHBondContact O-N 3.13Å
889	S	80.6	Confident	83.1	Confident	0 Å²	0	47 Å²	47	0%	0	25%	0.25	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63	-24	-173.7	72.6	0	0	0	0	114	Y482 L885 M886 G887 F891 M892 T893 L896	Y482-S889 VanDerWaalsContact OH-CB 3.29Å; Y482-S889 WeakPolarHBondContact OH-CB 3.27Å; L885-S889 WeakPolarHBondContact O-CB 3.36Å; L885-S889 PolarHBondContact O-N 2.9Å; M886-S889 VanDerWaalsContact O-CB 3.23Å; M886-S889 WeakPolarHBondContact O-CB 3.48Å; M886-S889 PolarHBondContact O-N 3.42Å; M886-S889 VanDerWaalsContact O-N 3.17Å; M886-S889 PolarHBondContact O-OG 3.45Å; G887-S889 PolarHBondContact O-N 2.99Å; S889-F891 VanDerWaalsContact C-N 3.26Å; S889-F891 PolarHBondContact O-N 3.26Å; S889-M892 CarbonylContact O-C 3.39Å; S889-M892 WeakPolarHBondContact O-CA 3.41Å; S889-M892 PolarHBondContact O-N 3.14Å; S889-T893 PolarHBondContact O-N 3.04Å; S889-T893 VanDerWaalsContact O-N 3.16Å; S889-L896 VanDerWaalsContact O-CD1 3.27Å; S889-L896 WeakPolarHBondContact O-CD1 3.42Å
890	V	75.5	Confident	83	Confident	8 Å²	8	46.9 Å²	46.9	5%	0.048	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-31.8	173.4	-179.7	0	0	0	0	111.5	L510 F758 C888 M892 T893	L510-V890 HydrophobicContact CD2-CG2 3.66Å; F758-V890 HydrophobicContact CD1-CG2 4.45Å; F758-V890 HydrophobicContact CD2-CB 4.11Å; F758-V890 HydrophobicContact CD2-CG1 3.68Å; F758-V890 HydrophobicContact CE1-CB 4.23Å; F758-V890 HydrophobicContact CE1-CG1 4.48Å; F758-V890 HydrophobicContact CE1-CG2 3.65Å; F758-V890 HydrophobicContact CE2-CB 3.34Å; F758-V890 HydrophobicContact CE2-CG1 3.45Å; F758-V890 VanDerWaalsContact CE2-CG1 3.45Å; F758-V890 HydrophobicContact CE2-CG2 3.75Å; F758-V890 HydrophobicContact CG-CG1 4.31Å; F758-V890 HydrophobicContact CZ-CB 3.42Å; F758-V890 VanDerWaalsContact CZ-CB 3.42Å; F758-V890 HydrophobicContact CZ-CG1 3.89Å; F758-V890 HydrophobicContact CZ-CG2 3.25Å; C888-V890 PolarHBondContact O-N 3.46Å; V890-M892 VanDerWaalsContact C-N 3.29Å; V890-T893 WeakPolarHBondContact O-CG2 3.48Å; V890-T893 PolarHBondContact O-OG1 3Å
891	F	75.9	Confident	82.6	Confident	171 Å²	171	46 Å²	46	75%	0.75	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.4	-22.2	171.5	-59.4	-69.3	0	0	0	112.4	F758 C888 S889	F758-F891 HydrophobicContact CE2-CE2 4.33Å; F758-F891 HydrophobicContact CE2-CZ 4.36Å; C888-F891 WeakPolarHBondContact O-CB 3.41Å; C888-F891 PolarHBondContact O-N 2.98Å; S889-F891 VanDerWaalsContact C-N 3.26Å; S889-F891 PolarHBondContact O-N 3.26Å
892	M	72.9	Confident	82.4	Confident	87 Å²	87	42.2 Å²	42.2	43%	0.429	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.6	13	177.6	-63.9	-176	69.9	0	0	113.3	C888 S889 V890 S894 V895 L896	C888-M892 PolarHBondContact O-N 3.13Å; S889-M892 CarbonylContact O-C 3.39Å; S889-M892 WeakPolarHBondContact O-CA 3.41Å; S889-M892 PolarHBondContact O-N 3.14Å; V890-M892 VanDerWaalsContact C-N 3.29Å; M892-S894 PolarHBondContact O-N 3.31Å; M892-V895 PolarHBondContact O-N 3.37Å; M892-L896 HydrophobicContact CB-CD1 4.05Å; M892-L896 PolarHBondContact O-N 3.23Å
893	T	73	Confident	82.4	Confident	15 Å²	15	42.2 Å²	42.2	9%	0.092	23%	0.227	C	C	.	.	H	α-helix	trans	-54	-33	-177.7	55	0	0	0	0	112.7	V754 D756 S889 V890 V895 L896 K897	V754-T893 HydrophobicContact CB-CG2 3.79Å; V754-T893 HydrophobicContact CG1-CG2 3.48Å; V754-T893 VanDerWaalsContact CG1-CG2 3.48Å; D756-T893 WeakPolarHBondContact OD1-CB 3.32Å; D756-T893 PolarHBondContact OD1-OG1 2.96Å; S889-T893 PolarHBondContact O-N 3.04Å; S889-T893 VanDerWaalsContact O-N 3.16Å; V890-T893 WeakPolarHBondContact O-CG2 3.48Å; V890-T893 PolarHBondContact O-OG1 3Å; T893-V895 VanDerWaalsContact C-N 3.26Å; T893-V895 PolarHBondContact O-N 3.38Å; T893-L896 PolarHBondContact O-N 3.4Å; T893-K897 WeakPolarHBondContact O-CB 3.27Å; T893-K897 VanDerWaalsContact O-CG 3.24Å; T893-K897 WeakPolarHBondContact O-CG 3.01Å; T893-K897 PolarHBondContact O-N 3.41Å
894	S	75.6	Confident	82	Confident	87 Å²	87	42.5 Å²	42.5	61%	0.608	23%	0.228	S	C	*	.	H	α-helix	trans	-58.6	-34.4	177.4	-176.4	0	0	0	0	113.3	M892 F898	M892-S894 PolarHBondContact O-N 3.31Å; S894-F898 VanDerWaalsContact O-CD2 3.25Å; S894-F898 WeakPolarHBondContact O-CD2 3.34Å; S894-F898 WeakPolarHBondContact O-CE2 3.43Å
895	V	76.1	Confident	81.8	Confident	93 Å²	93	41.5 Å²	41.5	56%	0.564	22%	0.22	S	C	*	.	H	α-helix	trans	-86	-39.9	177.9	179.8	0	0	0	0	110.8	M892 T893 K897 F898	M892-V895 PolarHBondContact O-N 3.37Å; T893-V895 VanDerWaalsContact C-N 3.26Å; T893-V895 PolarHBondContact O-N 3.38Å; V895-K897 VanDerWaalsContact C-N 3.33Å; V895-K897 PolarHBondContact O-N 2.98Å; V895-F898 PolarHBondContact O-N 3.18Å
896	L	75.3	Confident	81.8	Confident	6 Å²	6	38.7 Å²	38.7	3%	0.031	21%	0.205	C	C	.	.	H	α-helix	trans	-68.8	-29.2	-175.9	-74.9	154.2	0	0	0	113.9	M486 V754 S889 M892 T893 F898 I899	M486-L896 HydrophobicContact CE-CD1 3.58Å; M486-L896 HydrophobicContact CE-CD2 3.69Å; M486-L896 HydrophobicContact CE-CG 4.12Å; M486-L896 HydrophobicContact SD-CD1 4.24Å; M486-L896 HydrophobicContact SD-CD2 3.39Å; M486-L896 WeakPolarHBondContact SD-CD2 3.31Å; M486-L896 HydrophobicContact SD-CG 4.4Å; V754-L896 HydrophobicContact CG2-CB 4.25Å; S889-L896 VanDerWaalsContact O-CD1 3.27Å; S889-L896 WeakPolarHBondContact O-CD1 3.42Å; M892-L896 HydrophobicContact CB-CD1 4.05Å; M892-L896 PolarHBondContact O-N 3.23Å; T893-L896 PolarHBondContact O-N 3.4Å; L896-F898 PolarHBondContact O-N 3.03Å; L896-F898 VanDerWaalsContact O-N 3.14Å; L896-I899 HydrophobicContact CD2-CD1 3.94Å; L896-I899 PolarHBondContact O-N 3.01Å
897	K	79.3	Confident	81.7	Confident	73 Å²	73	38.8 Å²	38.8	32%	0.317	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61	-17.8	174	-78.5	174.8	-175.9	-178.9	0	113.1	K751 D756 T893 V895 I899	K751-K897 VanDerWaalsContact CB-O 3.32Å; K751-K897 WeakPolarHBondContact CB-O 3.4Å; K751-K897 VanDerWaalsContact CD-O 3.3Å; K751-K897 WeakPolarHBondContact CD-O 3.21Å; D756-K897 VanDerWaalsContact OD1-CE 3.27Å; D756-K897 WeakPolarHBondContact OD1-CE 3.41Å; D756-K897 IonicContact OD1-NZ 3.34Å; D756-K897 PolarHBondContact OD1-NZ 3Å; D756-K897 IonicContact OD2-NZ 3.95Å; D756-K897 PolarHBondContact OD2-NZ 3.4Å; T893-K897 WeakPolarHBondContact O-CB 3.27Å; T893-K897 VanDerWaalsContact O-CG 3.24Å; T893-K897 WeakPolarHBondContact O-CG 3.01Å; T893-K897 PolarHBondContact O-N 3.41Å; V895-K897 VanDerWaalsContact C-N 3.33Å; V895-K897 PolarHBondContact O-N 2.98Å; K897-I899 VanDerWaalsContact C-N 3.35Å
898	F	83.4	Confident	81.7	Confident	96 Å²	96	38.5 Å²	38.5	42%	0.421	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.1	-9.8	175.7	-65.7	-70.2	0	0	0	113.6	V739 S894 V895 L896 P900	V739-F898 HydrophobicContact CG1-CB 4.38Å; S894-F898 VanDerWaalsContact O-CD2 3.25Å; S894-F898 WeakPolarHBondContact O-CD2 3.34Å; S894-F898 WeakPolarHBondContact O-CE2 3.43Å; V895-F898 PolarHBondContact O-N 3.18Å; L896-F898 PolarHBondContact O-N 3.03Å; L896-F898 VanDerWaalsContact O-N 3.14Å; F898-P900 VanDerWaalsContact O-CD 3.29Å; F898-P900 WeakPolarHBondContact O-CD 3.45Å
899	I	85.2	Confident	81.9	Confident	22 Å²	22	36.6 Å²	36.6	11%	0.113	19%	0.185	C	C	.	.			trans	-81	117.6	-178.5	-54.6	-178.6	0	0	0	109.8	V739 L752 L896 K897 L904	V739-I899 HydrophobicContact CG2-CB 4.4Å; V739-I899 HydrophobicContact CG2-CG1 4.15Å; V739-I899 HydrophobicContact CG2-CG2 4.27Å; L752-I899 PolarHBondContact N-O 3.32Å; L896-I899 HydrophobicContact CD2-CD1 3.94Å; L896-I899 PolarHBondContact O-N 3.01Å; K897-I899 VanDerWaalsContact C-N 3.35Å; I899-L904 HydrophobicContact CG2-CD1 4.08Å; I899-L904 HydrophobicContact CG2-CD2 4.04Å; I899-L904 HydrophobicContact CG2-CG 3.95Å
900	P	86.9	Confident	82.3	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	19%	0.19	C	C	.	.	B	Isolated β-bridge	trans	-75.8	137.4	177.2	33.2	-35	0	0	0	110.2	L698 D742 F898 P902 V903	L698-P900 HydrophobicContact CD1-CB 4.32Å; L698-P900 HydrophobicContact CD1-CG 4.22Å; D742-P900 HydrophobicContact CB-CG 4.18Å; F898-P900 VanDerWaalsContact O-CD 3.29Å; F898-P900 WeakPolarHBondContact O-CD 3.45Å; P900-P902 VanDerWaalsContact C-CD 3.42Å; P900-V903 HydrophobicContact CG-CB 4.07Å; P900-V903 HydrophobicContact CG-CG2 3.54Å; P900-V903 PolarHBondContact O-N 2.95Å
901	M	83.9	Confident	82.7	Confident	45 Å²	45	37.3 Å²	37.3	22%	0.222	19%	0.188	C	C	.	.	H	α-helix	trans	-58.6	-37.9	179.1	-63.2	-155.5	-167.1	0	0	114.1	P750 K751 V903 L904 Y905	P750-M901 PolarHBondContact O-N 3.4Å; K751-M901 WeakPolarHBondContact O-CE 3.19Å; M901-V903 PolarHBondContact O-N 3.17Å; M901-L904 WeakPolarHBondContact O-CB 3.27Å; M901-L904 PolarHBondContact O-N 3.26Å; M901-Y905 HydrophobicContact CB-CE1 4.49Å; M901-Y905 HydrophobicContact CB-CE2 4.26Å; M901-Y905 PolarHBondContact O-N 3.03Å
902	P	89.2	Confident	83.1	Confident	0 Å²	0	29.2 Å²	29.2	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-59.7	-32.4	179.4	-26.5	35.6	0	0	0	113.8	L612 S695 L698 P750 P900 Y905 G906	L612-P902 HydrophobicContact CD2-CG 4.08Å; S695-P902 WeakPolarHBondContact O-CB 3.1Å; L698-P902 HydrophobicContact CB-CB 4.24Å; P750-P902 HydrophobicContact CG-CG 4.05Å; P900-P902 VanDerWaalsContact C-CD 3.42Å; P902-Y905 PolarHBondContact O-N 3.26Å; P902-G906 PolarHBondContact O-N 3.27Å
903	V	89.3	Confident	83.8	Confident	0 Å²	0	27 Å²	27	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-65.2	-43.9	174.1	171.5	0	0	0	0	110.2	L698 T702 I735 M738 P900 M901 Y905 G906 V907	L698-V903 HydrophobicContact CB-CG2 4.09Å; L698-V903 HydrophobicContact CD1-CG2 4.45Å; L698-V903 HydrophobicContact CD2-CG2 4.2Å; L698-V903 HydrophobicContact CG-CG2 4.5Å; T702-V903 HydrophobicContact CG2-CG1 3.99Å; T702-V903 WeakPolarHBondContact CG2-O 3.27Å; I735-V903 HydrophobicContact CB-CG1 4.5Å; I735-V903 HydrophobicContact CG1-CG1 4.26Å; I735-V903 HydrophobicContact CG2-CG1 4.39Å; M738-V903 HydrophobicContact CB-CG1 4.01Å; M738-V903 HydrophobicContact CB-CG2 3.61Å; M738-V903 HydrophobicContact CG-CG2 4.48Å; P900-V903 HydrophobicContact CG-CB 4.07Å; P900-V903 HydrophobicContact CG-CG2 3.54Å; P900-V903 PolarHBondContact O-N 2.95Å; M901-V903 PolarHBondContact O-N 3.17Å; V903-Y905 VanDerWaalsContact C-N 3.31Å; V903-Y905 PolarHBondContact O-N 3.2Å; V903-G906 PolarHBondContact O-N 3.1Å; V903-G906 VanDerWaalsContact O-N 3.14Å; V903-V907 WeakPolarHBondContact O-CG2 3.3Å; V903-V907 PolarHBondContact O-N 3.21Å
904	L	84.5	Confident	84.3	Confident	11 Å²	11	28.2 Å²	28.2	6%	0.058	15%	0.152	C	C	.	.	H	α-helix	trans	-64	-37.4	177.2	-62	172.7	0	0	0	111.9	L752 I899 M901 G906 V907 F908	L752-L904 HydrophobicContact CD1-CD1 4.25Å; I899-L904 HydrophobicContact CG2-CD1 4.08Å; I899-L904 HydrophobicContact CG2-CD2 4.04Å; I899-L904 HydrophobicContact CG2-CG 3.95Å; M901-L904 WeakPolarHBondContact O-CB 3.27Å; M901-L904 PolarHBondContact O-N 3.26Å; L904-G906 VanDerWaalsContact C-N 3.35Å; L904-V907 PolarHBondContact O-N 3.22Å; L904-F908 WeakPolarHBondContact O-CD1 3.37Å; L904-F908 WeakPolarHBondContact O-CG 3.38Å; L904-F908 PolarHBondContact O-N 3.04Å
905	Y	86.9	Confident	84.6	Confident	26 Å²	26	24.4 Å²	24.4	10%	0.102	13%	0.126	C	C	.	.	H	α-helix	trans	-65.3	-37.6	173.5	-58	-20.4	0	0	0	111.8	K608 F699 M901 P902 V903 V907 F908 L909	K608-Y905 HydrophobicContact CB-CD2 4.13Å; K608-Y905 HydrophobicContact CB-CE1 4.25Å; K608-Y905 HydrophobicContact CB-CE2 3.8Å; K608-Y905 HydrophobicContact CB-CG 4.5Å; K608-Y905 HydrophobicContact CD-CD1 4.22Å; K608-Y905 HydrophobicContact CD-CE1 3.69Å; F699-Y905 WeakPolarHBondContact CE2-O 3.21Å; M901-Y905 HydrophobicContact CB-CE1 4.49Å; M901-Y905 HydrophobicContact CB-CE2 4.26Å; M901-Y905 PolarHBondContact O-N 3.03Å; P902-Y905 PolarHBondContact O-N 3.26Å; V903-Y905 VanDerWaalsContact C-N 3.31Å; V903-Y905 PolarHBondContact O-N 3.2Å; Y905-V907 VanDerWaalsContact C-N 3.34Å; Y905-V907 PolarHBondContact O-N 3.21Å; Y905-F908 HydrophobicContact CD1-CD2 4.24Å; Y905-F908 HydrophobicContact CD1-CE2 4.46Å; Y905-F908 WeakPolarHBondContact O-CB 3.41Å; Y905-F908 PolarHBondContact O-N 3.35Å; Y905-L909 PolarHBondContact O-N 3.21Å
906	G	88.8	Confident	84.9	Confident	0 Å²	0	20.8 Å²	20.8	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-62.9	-38.9	173.3	0	0	0	0	0	112.6	F699 P902 V903 L904 L909 Y910	F699-G906 VanDerWaalsContact CD2-N 3.32Å; P902-G906 PolarHBondContact O-N 3.27Å; V903-G906 PolarHBondContact O-N 3.1Å; V903-G906 VanDerWaalsContact O-N 3.14Å; L904-G906 VanDerWaalsContact C-N 3.35Å; G906-L909 PolarHBondContact O-N 3.49Å; G906-Y910 PolarHBondContact O-N 2.93Å
907	V	85.4	Confident	85	Confident	3 Å²	3	26.7 Å²	26.7	2%	0.018	13%	0.129	C	C	.	.	H	α-helix	trans	-66.6	-37.5	172.3	176.9	0	0	0	0	111.6	T702 V731 I735 V903 L904 Y905 Y910 M911	T702-V907 HydrophobicContact CG2-CG2 3.65Å; V731-V907 HydrophobicContact CG1-CG1 3.66Å; V731-V907 HydrophobicContact CG1-CG2 4.03Å; I735-V907 HydrophobicContact CD1-CG2 4.05Å; I735-V907 HydrophobicContact CG1-CG2 3.82Å; V903-V907 WeakPolarHBondContact O-CG2 3.3Å; V903-V907 PolarHBondContact O-N 3.21Å; L904-V907 PolarHBondContact O-N 3.22Å; Y905-V907 VanDerWaalsContact C-N 3.34Å; Y905-V907 PolarHBondContact O-N 3.21Å; V907-Y910 WeakPolarHBondContact O-CB 3.35Å; V907-Y910 PolarHBondContact O-N 3.14Å; V907-M911 HydrophobicContact CG1-CE 4.23Å; V907-M911 HydrophobicContact CG1-CG 4.46Å; V907-M911 WeakPolarHBondContact O-CG 3.42Å; V907-M911 PolarHBondContact O-N 3.06Å
908	F	84.1	Confident	84.6	Confident	11 Å²	11	25.4 Å²	25.4	5%	0.048	14%	0.136	C	C	.	.	H	α-helix	trans	-61.5	-45.2	174	-72.7	-7.7	0	0	0	112.4	S487 P488 A605 L904 Y905 Y910 M911 G912	S487-F908 WeakPolarHBondContact OG-CE2 3.41Å; S487-F908 WeakPolarHBondContact OG-CZ 3.48Å; P488-F908 HydrophobicContact CB-CZ 4.31Å; P488-F908 VanDerWaalsContact CD-CZ 3.43Å; P488-F908 HydrophobicContact CG-CE1 3.67Å; P488-F908 HydrophobicContact CG-CZ 3.48Å; P488-F908 VanDerWaalsContact CG-CZ 3.48Å; A605-F908 HydrophobicContact CB-CB 4.1Å; L904-F908 WeakPolarHBondContact O-CD1 3.37Å; L904-F908 WeakPolarHBondContact O-CG 3.38Å; L904-F908 PolarHBondContact O-N 3.04Å; Y905-F908 HydrophobicContact CD1-CD2 4.24Å; Y905-F908 HydrophobicContact CD1-CE2 4.46Å; Y905-F908 WeakPolarHBondContact O-CB 3.41Å; Y905-F908 PolarHBondContact O-N 3.35Å; F908-Y910 VanDerWaalsContact C-N 3.29Å; F908-Y910 PolarHBondContact O-N 3.49Å; F908-M911 HydrophobicContact CD1-CE 3.49Å; F908-M911 VanDerWaalsContact CD1-CE 3.49Å; F908-M911 HydrophobicContact CE1-CE 3.98Å; F908-M911 PolarHBondContact O-N 3Å; F908-G912 PolarHBondContact O-N 3.44Å
909	L	88.4	Confident	84.6	Confident	14 Å²	14	21.5 Å²	21.5	7%	0.073	12%	0.119	C	C	.	.	H	α-helix	trans	-58.7	-44.6	174.5	-176.6	67.2	0	0	0	110.7	I602 A605 F699 F703 Y905 G906 G912 V913	I602-L909 HydrophobicContact CB-CD1 4.44Å; I602-L909 HydrophobicContact CG1-CD1 4.34Å; I602-L909 HydrophobicContact CG2-CD1 3.9Å; A605-L909 HydrophobicContact CB-CB 4.4Å; F699-L909 HydrophobicContact CE1-CD2 3.77Å; F699-L909 HydrophobicContact CE2-CB 4.43Å; F699-L909 HydrophobicContact CZ-CB 4.06Å; F699-L909 HydrophobicContact CZ-CD2 3.7Å; F699-L909 HydrophobicContact CZ-CG 4.37Å; F703-L909 HydrophobicContact CB-CD2 4.25Å; F703-L909 HydrophobicContact CD1-CD2 4.38Å; F703-L909 HydrophobicContact CD2-CB 4.2Å; F703-L909 HydrophobicContact CD2-CD2 3.79Å; F703-L909 HydrophobicContact CD2-CG 3.79Å; F703-L909 HydrophobicContact CE2-CD2 4.21Å; F703-L909 HydrophobicContact CE2-CG 4.03Å; F703-L909 HydrophobicContact CG-CD2 3.88Å; F703-L909 HydrophobicContact CG-CG 4.39Å; Y905-L909 PolarHBondContact O-N 3.21Å; G906-L909 PolarHBondContact O-N 3.49Å; L909-G912 PolarHBondContact O-N 3.41Å; L909-V913 HydrophobicContact CD1-CG2 4.38Å; L909-V913 WeakPolarHBondContact O-CG2 3.49Å; L909-V913 PolarHBondContact O-N 3.44Å
910	Y	87.9	Confident	84.4	Confident	22 Å²	22	21.6 Å²	21.6	9%	0.086	12%	0.119	C	C	.	.	H	α-helix	trans	-60.4	-46.6	176.7	168.9	-96.8	0	0	0	112.4	K710 V731 G906 V907 F908 G912 V913 S914	K710-Y910 WeakPolarHBondContact CD-OH 3.4Å; K710-Y910 WeakPolarHBondContact CG-OH 3.21Å; V731-Y910 HydrophobicContact CG2-CD1 3.97Å; V731-Y910 HydrophobicContact CG2-CE1 3.5Å; G906-Y910 PolarHBondContact O-N 2.93Å; V907-Y910 WeakPolarHBondContact O-CB 3.35Å; V907-Y910 PolarHBondContact O-N 3.14Å; F908-Y910 VanDerWaalsContact C-N 3.29Å; F908-Y910 PolarHBondContact O-N 3.49Å; Y910-G912 PolarHBondContact O-N 3.13Å; Y910-V913 PolarHBondContact O-N 3.12Å; Y910-S914 WeakPolarHBondContact O-CB 3.3Å; Y910-S914 PolarHBondContact O-N 3.44Å
911	M	84.1	Confident	84.4	Confident	2 Å²	2	21.7 Å²	21.7	1%	0.01	12%	0.12	C	C	.	.	H	α-helix	trans	-63.1	-40.4	178.4	-72.2	-169.8	-64.7	0	0	112.3	F480 A484 V845 V907 F908 S915	F480-M911 HydrophobicContact CE2-SD 4.42Å; F480-M911 HydrophobicContact CZ-CG 4.48Å; F480-M911 HydrophobicContact CZ-SD 4.22Å; A484-M911 HydrophobicContact CB-CE 4.02Å; A484-M911 HydrophobicContact CB-SD 3.67Å; V845-M911 HydrophobicContact CG1-CB 4.33Å; V907-M911 HydrophobicContact CG1-CE 4.23Å; V907-M911 HydrophobicContact CG1-CG 4.46Å; V907-M911 WeakPolarHBondContact O-CG 3.42Å; V907-M911 PolarHBondContact O-N 3.06Å; F908-M911 HydrophobicContact CD1-CE 3.49Å; F908-M911 VanDerWaalsContact CD1-CE 3.49Å; F908-M911 HydrophobicContact CE1-CE 3.98Å; F908-M911 PolarHBondContact O-N 3Å; M911-S915 WeakPolarHBondContact O-CB 3.07Å; M911-S915 PolarHBondContact O-N 3.49Å; M911-S915 VanDerWaalsContact O-N 3.09Å; M911-S915 PolarHBondContact O-OG 3.27Å
912	G	85.4	Confident	84.5	Confident	0 Å²	0	22.7 Å²	22.7	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-61.7	-51.1	175.2	0	0	0	0	0	112.1	F908 L909 Y910 S915 L916	F908-G912 PolarHBondContact O-N 3.44Å; L909-G912 PolarHBondContact O-N 3.41Å; Y910-G912 PolarHBondContact O-N 3.13Å; G912-S915 PolarHBondContact O-N 3.39Å; G912-L916 PolarHBondContact O-N 2.98Å
913	V	86.9	Confident	84.2	Confident	42 Å²	42	25.1 Å²	25.1	26%	0.255	14%	0.136	S	C	.	.	H	α-helix	trans	-67.1	-39.9	-179.6	174.3	0	0	0	0	112.1	I602 F703 L909 Y910 S915 L916	I602-V913 HydrophobicContact CD1-CG2 3.93Å; I602-V913 HydrophobicContact CG1-CG2 4.27Å; F703-V913 HydrophobicContact CE2-CB 4.15Å; F703-V913 HydrophobicContact CE2-CG1 4.44Å; F703-V913 HydrophobicContact CE2-CG2 4.05Å; F703-V913 HydrophobicContact CZ-CG1 4.44Å; F703-V913 HydrophobicContact CZ-CG2 4.38Å; L909-V913 HydrophobicContact CD1-CG2 4.38Å; L909-V913 WeakPolarHBondContact O-CG2 3.49Å; L909-V913 PolarHBondContact O-N 3.44Å; Y910-V913 PolarHBondContact O-N 3.12Å; V913-S915 VanDerWaalsContact C-N 3.27Å; V913-S915 PolarHBondContact O-N 3.09Å; V913-L916 PolarHBondContact O-N 3.25Å
914	S	83.9	Confident	84.1	Confident	39 Å²	39	25.2 Å²	25.2	27%	0.273	14%	0.137	S	C	.	.	H	α-helix	trans	-66.2	-30.8	178	-173.8	0	0	0	0	112.2	Y910 K917	Y910-S914 WeakPolarHBondContact O-CB 3.3Å; Y910-S914 PolarHBondContact O-N 3.44Å; S914-K917 PolarHBondContact O-N 3.4Å
915	S	82.3	Confident	84.2	Confident	8 Å²	8	27.3 Å²	27.3	6%	0.056	15%	0.147	C	C	.	.	H	α-helix	trans	-76.5	-24.6	178.8	-58.9	0	0	0	0	112.6	C598 M911 G912 V913 K917	C598-S915 VanDerWaalsContact SG-CB 3.52Å; M911-S915 WeakPolarHBondContact O-CB 3.07Å; M911-S915 PolarHBondContact O-N 3.49Å; M911-S915 VanDerWaalsContact O-N 3.09Å; M911-S915 PolarHBondContact O-OG 3.27Å; G912-S915 PolarHBondContact O-N 3.39Å; V913-S915 VanDerWaalsContact C-N 3.27Å; V913-S915 PolarHBondContact O-N 3.09Å; S915-K917 VanDerWaalsContact C-N 3.31Å
916	L	82.6	Confident	84.1	Confident	16 Å²	16	30.6 Å²	30.6	8%	0.084	16%	0.162	C	C	.	.	H	α-helix	trans	-68.4	-29.2	170.4	-69.9	173.2	0	0	0	112.5	C598 I602 G912 V913 G918 I919 F922	C598-L916 HydrophobicContact CB-CD2 3.57Å; C598-L916 HydrophobicContact CB-CG 3.83Å; I602-L916 HydrophobicContact CD1-CD1 3.57Å; G912-L916 PolarHBondContact O-N 2.98Å; V913-L916 PolarHBondContact O-N 3.25Å; L916-G918 PolarHBondContact O-N 3.3Å; L916-I919 HydrophobicContact CD2-CD1 4.37Å; L916-I919 PolarHBondContact O-N 2.67Å; L916-F922 HydrophobicContact CB-CD1 4.26Å; L916-F922 HydrophobicContact CB-CE1 4.44Å; L916-F922 HydrophobicContact CB-CG 4.49Å
917	K	76.3	Confident	83.9	Confident	131 Å²	131	31.2 Å²	31.2	57%	0.57	17%	0.165	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.4	89.4	176.3	-67.4	-178.8	-179.4	178.7	0	109.7	S914 S915	S914-K917 PolarHBondContact O-N 3.4Å; S915-K917 VanDerWaalsContact C-N 3.31Å
918	G	71.5	Confident	83.8	Confident	46 Å²	46	36 Å²	36	47%	0.474	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	141.7	-6.5	179.5	0	0	0	0	0	114.7	L916	L916-G918 PolarHBondContact O-N 3.3Å
919	I	82.4	Confident	83.8	Confident	13 Å²	13	39 Å²	39	7%	0.067	22%	0.22	C	C	.	.			trans	-87.9	122.8	173.9	-54.2	179.6	0	0	0	108.4	E591 A594 A595 L916 F921 F922 D923	E591-I919 HydrophobicContact CB-CG2 3.72Å; E591-I919 HydrophobicContact CG-CG2 3.88Å; A594-I919 HydrophobicContact CB-CD1 3.99Å; A595-I919 HydrophobicContact CB-CD1 4.36Å; L916-I919 HydrophobicContact CD2-CD1 4.37Å; L916-I919 PolarHBondContact O-N 2.67Å; I919-F921 VanDerWaalsContact C-N 3.29Å; I919-F921 HydrophobicContact CG2-CB 3.9Å; I919-F921 PolarHBondContact O-N 3.12Å; I919-F922 HydrophobicContact CB-CB 4.47Å; I919-F922 PolarHBondContact O-N 2.85Å; I919-F922 VanDerWaalsContact O-N 3.11Å; I919-D923 PolarHBondContact O-N 3.32Å
920	Q	81.9	Confident	83.5	Confident	24 Å²	24	42 Å²	42	11%	0.112	24%	0.235	C	C	.	.	H	α-helix	trans	-63.6	-35.9	-180	-84.8	-179.9	3.4	0	0	111.8	R587 E591 F922 D923 R924	R587-Q920 VanDerWaalsContact CZ-NE2 3.32Å; R587-Q920 VanDerWaalsContact NH2-OE1 3.1Å; E591-Q920 WeakPolarHBondContact OE1-CB 3.33Å; E591-Q920 PolarHBondContact OE1-N 2.83Å; E591-Q920 WeakPolarHBondContact OE2-CB 3.2Å; Q920-F922 PolarHBondContact O-N 3.41Å; Q920-D923 CarbonylContact O-C 3.59Å; Q920-D923 PolarHBondContact O-N 3.05Å; Q920-D923 VanDerWaalsContact O-N 3.12Å; Q920-R924 WeakPolarHBondContact O-CB 3.25Å; Q920-R924 VanDerWaalsContact O-CG 3.24Å; Q920-R924 WeakPolarHBondContact O-CG 3.38Å; Q920-R924 PolarHBondContact O-N 3.16Å
921	F	86.4	Confident	83.2	Confident	3 Å²	3	44.8 Å²	44.8	1%	0.013	26%	0.255	C	S	.	.	H	α-helix	trans	-50	-44.1	172.2	174.3	-117.2	0	0	0	113	E591 A595 I919 R924 I925 Q956 L957 L960	E591-F921 HydrophobicContact CB-CB 4.17Å; E591-F921 PolarHBondContact OE2-N 3.47Å; A595-F921 HydrophobicContact CB-CD1 3.75Å; A595-F921 HydrophobicContact CB-CE1 4.1Å; I919-F921 VanDerWaalsContact C-N 3.29Å; I919-F921 HydrophobicContact CG2-CB 3.9Å; I919-F921 PolarHBondContact O-N 3.12Å; F921-R924 PolarHBondContact O-N 3.04Å; F921-I925 HydrophobicContact CD1-CD1 3.91Å; F921-I925 HydrophobicContact CD2-CD1 4.33Å; F921-I925 HydrophobicContact CD2-CG1 4.46Å; F921-I925 HydrophobicContact CE1-CD1 3.38Å; F921-I925 HydrophobicContact CE1-CG1 4.43Å; F921-I925 HydrophobicContact CE2-CD1 3.85Å; F921-I925 HydrophobicContact CE2-CG1 4.08Å; F921-I925 HydrophobicContact CG-CD1 4.38Å; F921-I925 HydrophobicContact CZ-CD1 3.38Å; F921-I925 HydrophobicContact CZ-CG1 4.09Å; F921-I925 WeakPolarHBondContact O-CG1 3.28Å; F921-I925 PolarHBondContact O-N 3.48Å; F921-Q956 HydrophobicContact CD2-CB 4.04Å; F921-Q956 HydrophobicContact CD2-CG 3.7Å; F921-Q956 HydrophobicContact CE2-CB 3.66Å; F921-Q956 HydrophobicContact CE2-CG 3.61Å; F921-Q956 HydrophobicContact CG-CG 4.38Å; F921-Q956 HydrophobicContact CZ-CB 4.46Å; F921-Q956 HydrophobicContact CZ-CG 4.22Å; F921-L957 HydrophobicContact CE2-CB 4.49Å; F921-L957 HydrophobicContact CZ-CB 4.23Å; F921-L957 HydrophobicContact CZ-CD1 4.17Å; F921-L960 HydrophobicContact CE1-CD1 3.87Å; F921-L960 HydrophobicContact CZ-CD1 4.47Å
922	F	86.3	Confident	82.7	Confident	65 Å²	65	48.4 Å²	48.4	29%	0.285	29%	0.285	S	S	.	.	H	α-helix	trans	-70.6	-37.2	179	-171.2	-114.7	0	0	0	112.2	L916 I919 Q920 R924 I925 K926	L916-F922 HydrophobicContact CB-CD1 4.26Å; L916-F922 HydrophobicContact CB-CE1 4.44Å; L916-F922 HydrophobicContact CB-CG 4.49Å; I919-F922 HydrophobicContact CB-CB 4.47Å; I919-F922 PolarHBondContact O-N 2.85Å; I919-F922 VanDerWaalsContact O-N 3.11Å; Q920-F922 PolarHBondContact O-N 3.41Å; F922-R924 VanDerWaalsContact C-N 3.31Å; F922-R924 PolarHBondContact O-N 3.5Å; F922-I925 WeakPolarHBondContact O-CB 3.37Å; F922-I925 PolarHBondContact O-N 3.23Å; F922-K926 VanDerWaalsContact CD1-CE 3.43Å; F922-K926 HydrophobicContact CE1-CD 4.42Å; F922-K926 WeakPolarHBondContact O-CG 3.45Å; F922-K926 PolarHBondContact O-N 3.2Å
923	D	83.4	Confident	82.3	Confident	52 Å²	52	58 Å²	58	28%	0.278	33%	0.327	S	S	.	.	H	α-helix	trans	-67.3	-33.7	174.1	-66.9	-28.7	0	0	0	111.8	I919 Q920 K926 L927	I919-D923 PolarHBondContact O-N 3.32Å; Q920-D923 CarbonylContact O-C 3.59Å; Q920-D923 PolarHBondContact O-N 3.05Å; Q920-D923 VanDerWaalsContact O-N 3.12Å; D923-K926 WeakPolarHBondContact O-CB 3.41Å; D923-K926 PolarHBondContact O-N 3.05Å; D923-K926 IonicContact OD1-NZ 3.21Å; D923-K926 PolarHBondContact OD1-NZ 3.23Å; D923-L927 WeakPolarHBondContact O-CG 3.18Å; D923-L927 PolarHBondContact O-N 2.88Å; D923-L927 VanDerWaalsContact O-N 3.14Å
924	R	86.5	Confident	81.6	Confident	2 Å²	2	62.3 Å²	62.3	1%	0.008	34%	0.344	C	S	.	.	H	α-helix	trans	-68.9	-34.6	170.9	-63.9	170.5	-151.1	-174.8	4	112.7	Q920 F921 F922 L927 Y940 T953 L1001	Q920-R924 WeakPolarHBondContact O-CB 3.25Å; Q920-R924 VanDerWaalsContact O-CG 3.24Å; Q920-R924 WeakPolarHBondContact O-CG 3.38Å; Q920-R924 PolarHBondContact O-N 3.16Å; F921-R924 PolarHBondContact O-N 3.04Å; F922-R924 VanDerWaalsContact C-N 3.31Å; F922-R924 PolarHBondContact O-N 3.5Å; R924-L927 WeakPolarHBondContact O-CB 3.18Å; R924-L927 PolarHBondContact O-N 2.88Å; R924-Y940 HydrophobicContact CG-CE2 4.4Å; R924-Y940 WeakPolarHBondContact CG-OH 3.33Å; R924-T953 HydrophobicContact CB-CG2 3.43Å; R924-T953 VanDerWaalsContact CB-CG2 3.43Å; R924-T953 HydrophobicContact CG-CG2 4.06Å; R924-L1001 PolarHBondContact NH2-O 3.24Å
925	I	87.1	Confident	80.9	Confident	54 Å²	54	62.6 Å²	62.6	28%	0.277	34%	0.341	S	S	.	.	H	α-helix	trans	-61.9	-45.2	170.6	-71.9	165.5	0	0	0	110.1	F921 F922 L927 F928 L957	F921-I925 HydrophobicContact CD1-CD1 3.91Å; F921-I925 HydrophobicContact CD2-CD1 4.33Å; F921-I925 HydrophobicContact CD2-CG1 4.46Å; F921-I925 HydrophobicContact CE1-CD1 3.38Å; F921-I925 HydrophobicContact CE1-CG1 4.43Å; F921-I925 HydrophobicContact CE2-CD1 3.85Å; F921-I925 HydrophobicContact CE2-CG1 4.08Å; F921-I925 HydrophobicContact CG-CD1 4.38Å; F921-I925 HydrophobicContact CZ-CD1 3.38Å; F921-I925 HydrophobicContact CZ-CG1 4.09Å; F921-I925 WeakPolarHBondContact O-CG1 3.28Å; F921-I925 PolarHBondContact O-N 3.48Å; F922-I925 WeakPolarHBondContact O-CB 3.37Å; F922-I925 PolarHBondContact O-N 3.23Å; I925-L927 PolarHBondContact O-N 2.84Å; I925-F928 WeakPolarHBondContact O-CB 3.42Å; I925-F928 PolarHBondContact O-N 3.43Å; I925-L957 HydrophobicContact CD1-CD1 4.47Å
926	K	85.2	Confident	80.3	Confident	96 Å²	96	65.1 Å²	65.1	42%	0.417	36%	0.357	S	S	.	.	H	α-helix	trans	-59.6	-33	177.2	-69.1	174.6	-165.4	150.8	0	112.7	F922 D923 F928 G929 M930	F922-K926 VanDerWaalsContact CD1-CE 3.43Å; F922-K926 HydrophobicContact CE1-CD 4.42Å; F922-K926 WeakPolarHBondContact O-CG 3.45Å; F922-K926 PolarHBondContact O-N 3.2Å; D923-K926 WeakPolarHBondContact O-CB 3.41Å; D923-K926 PolarHBondContact O-N 3.05Å; D923-K926 IonicContact OD1-NZ 3.21Å; D923-K926 PolarHBondContact OD1-NZ 3.23Å; K926-F928 PolarHBondContact O-N 3.47Å; K926-G929 PolarHBondContact O-N 3.08Å; K926-M930 PolarHBondContact O-N 3.45Å
927	L	83.6	Confident	79	Confident	12 Å²	12	72.5 Å²	72.5	6%	0.063	40%	0.397	C	S	.	.	H	α-helix	trans	-59.6	-26.6	176.1	-71.9	171.8	0	0	0	113	D923 R924 I925 G929 M930 Q935 L938 Y940 L941	D923-L927 WeakPolarHBondContact O-CG 3.18Å; D923-L927 PolarHBondContact O-N 2.88Å; D923-L927 VanDerWaalsContact O-N 3.14Å; R924-L927 WeakPolarHBondContact O-CB 3.18Å; R924-L927 PolarHBondContact O-N 2.88Å; I925-L927 PolarHBondContact O-N 2.84Å; L927-G929 VanDerWaalsContact C-N 3.28Å; L927-G929 PolarHBondContact O-N 2.78Å; L927-M930 PolarHBondContact O-N 3.11Å; L927-Q935 HydrophobicContact CD2-CG 3.81Å; L927-L938 HydrophobicContact CD1-CD1 4.21Å; L927-Y940 HydrophobicContact CD1-CE2 4.24Å; L927-L941 HydrophobicContact CD1-CD2 4.22Å
928	F	84.7	Confident	78.5	Confident	103 Å²	103	68.7 Å²	68.7	45%	0.452	38%	0.383	S	S	.	.	H	α-helix	trans	-65	-32.4	172.7	-81.2	-81.1	0	0	0	113.2	I925 K926 H950 T953	I925-F928 WeakPolarHBondContact O-CB 3.42Å; I925-F928 PolarHBondContact O-N 3.43Å; K926-F928 PolarHBondContact O-N 3.47Å; F928-H950 AromaticContact CD1-CE1 3.77Å; F928-H950 AromaticContact CD1-ND1 3.25Å; F928-H950 VanDerWaalsContact CD1-ND1 3.25Å; F928-H950 WeakPolarHBondContact CD1-ND1 3.42Å; F928-H950 AromaticContact CD2-ND1 3.82Å; F928-H950 HydrophobicContact CE1-CB 3.6Å; F928-H950 AromaticContact CE1-CG 3.54Å; F928-H950 AromaticContact CE1-ND1 3.09Å; F928-H950 WeakPolarHBondContact CE1-ND1 3.39Å; F928-H950 AromaticContact CE2-ND1 3.7Å; F928-H950 AromaticContact CG-CE1 4Å; F928-H950 AromaticContact CG-ND1 3.63Å; F928-H950 HydrophobicContact CZ-CB 3.65Å; F928-H950 AromaticContact CZ-CG 3.84Å; F928-H950 AromaticContact CZ-ND1 3.34Å; F928-H950 VanDerWaalsContact CZ-ND1 3.34Å; F928-H950 WeakPolarHBondContact CZ-ND1 3.25Å; F928-T953 WeakPolarHBondContact CE2-OG1 3.43Å; F928-T953 VanDerWaalsContact CZ-OG1 3.31Å; F928-T953 WeakPolarHBondContact CZ-OG1 3.34Å
929	G	82.9	Confident	77.9	Confident	74 Å²	74	69.4 Å²	69.4	76%	0.763	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93	-0.5	179.9	0	0	0	0	0	113.8	K926 L927	K926-G929 PolarHBondContact O-N 3.08Å; L927-G929 VanDerWaalsContact C-N 3.28Å; L927-G929 PolarHBondContact O-N 2.78Å
930	M	82.6	Confident	77.2	Confident	78 Å²	78	69.3 Å²	69.3	38%	0.384	37%	0.374	S	S	.	.	S	Bend	trans	-102.7	129.1	-173.7	-162.1	173.2	-156.2	0	0	110.8	K926 L927 H934 P936	K926-M930 PolarHBondContact O-N 3.45Å; L927-M930 PolarHBondContact O-N 3.11Å; M930-H934 HydrophobicContact CE-CB 3.77Å; M930-H934 WeakPolarHBondContact CE-O 3.36Å; M930-H934 HydrophobicContact CG-CB 4.41Å; M930-P936 VanDerWaalsContact SD-CD 3.51Å
931	P	82.3	Confident	76.4	Confident	80 Å²	80	69.9 Å²	69.9	52%	0.519	38%	0.377	S	S	.	.			trans	-67.8	144.1	174.7	28.2	-34.2	0	0	0	110.6	K933 H934	P931-K933 PolarHBondContact O-N 2.99Å; P931-H934 HydrophobicContact CG-CB 4.37Å; P931-H934 PolarHBondContact O-N 3.48Å
932	A	72.8	Confident	75.4	Confident	78 Å²	78	78.3 Å²	78.3	65%	0.645	41%	0.409	S	S	*	.	G	3₁₀ helix	trans	-53.6	-28.3	-175.9	0	0	0	0	0	114.2	H934 Q935	A932-H934 PolarHBondContact O-N 2.98Å; A932-Q935 WeakPolarHBondContact O-CB 3.4Å; A932-Q935 PolarHBondContact O-N 3.48Å
933	K	76.8	Confident	74.5	Confident	201 Å²	201	77.8 Å²	77.8	87%	0.874	41%	0.406	S	S	*	.	G	3₁₀ helix	trans	-67	-30.5	178.1	-67.6	-173.2	178.7	-175.5	0	114.4	P931	P931-K933 PolarHBondContact O-N 2.99Å
934	H	73.3	Confident	74.1	Confident	133 Å²	133	75.4 Å²	75.4	62%	0.616	39%	0.393	S	S	*	.	G	3₁₀ helix	trans	-99.2	6.7	-176.3	-66.1	81.9	0	0	0	112.2	M930 P931 A932	M930-H934 HydrophobicContact CE-CB 3.77Å; M930-H934 WeakPolarHBondContact CE-O 3.36Å; M930-H934 HydrophobicContact CG-CB 4.41Å; P931-H934 HydrophobicContact CG-CB 4.37Å; P931-H934 PolarHBondContact O-N 3.48Å; A932-H934 PolarHBondContact O-N 2.98Å
935	Q	69.3	Low	73.7	Confident	46 Å²	46	78.8 Å²	78.8	22%	0.215	42%	0.415	C	S	.	.			trans	-64.5	127.1	-171	-170.9	163.1	1.8	0	0	111.1	L927 A932 L941 L946	L927-Q935 HydrophobicContact CD2-CG 3.81Å; A932-Q935 WeakPolarHBondContact O-CB 3.4Å; A932-Q935 PolarHBondContact O-N 3.48Å; Q935-L941 HydrophobicContact CG-CD1 3.69Å; Q935-L946 VanDerWaalsContact NE2-CD2 3.26Å
936	P	67.6	Low	73.3	Confident	60 Å²	60	79.4 Å²	79.4	39%	0.39	42%	0.419	S	S	.	.			trans	-68.7	150.2	178.1	27.6	-35	0	0	0	111.2	M930 L938 L941	M930-P936 VanDerWaalsContact SD-CD 3.51Å; P936-L938 HydrophobicContact CB-CG 4.48Å; P936-L938 HydrophobicContact CG-CD1 3.8Å; P936-L938 HydrophobicContact CG-CG 4.18Å; P936-L938 PolarHBondContact O-N 3.36Å; P936-L941 WeakPolarHBondContact O-CD1 2.99Å
937	D	55.7	Low	73.2	Confident	171 Å²	171	84 Å²	84	91%	0.914	43%	0.434	S	S	*	.			trans	-69	64.4	178.5	-70.9	-30.3	0	0	0	113.2
938	L	66.3	Low	73.2	Confident	51 Å²	51	86.5 Å²	86.5	27%	0.267	44%	0.444	S	S	.	.			trans	-80.9	129.8	174.6	-60.4	155.2	0	0	0	109.3	L927 P936 Y940 L941	L927-L938 HydrophobicContact CD1-CD1 4.21Å; P936-L938 HydrophobicContact CB-CG 4.48Å; P936-L938 HydrophobicContact CG-CD1 3.8Å; P936-L938 HydrophobicContact CG-CG 4.18Å; P936-L938 PolarHBondContact O-N 3.36Å; L938-Y940 VanDerWaalsContact C-N 3.25Å; L938-Y940 HydrophobicContact CB-CD1 4.12Å; L938-Y940 HydrophobicContact CB-CE1 3.69Å; L938-Y940 HydrophobicContact CB-CE2 4.4Å; L938-Y940 HydrophobicContact CD1-CE1 4.27Å; L938-Y940 WeakPolarHBondContact CD1-OH 3.41Å; L938-Y940 HydrophobicContact CD2-CE1 4.29Å; L938-Y940 HydrophobicContact CG-CE1 4.3Å; L938-Y940 PolarHBondContact O-N 3.18Å; L938-Y940 VanDerWaalsContact O-N 3.15Å; L938-L941 HydrophobicContact CB-CD1 3.74Å; L938-L941 HydrophobicContact CB-CG 4.1Å; L938-L941 HydrophobicContact CD1-CD1 4.11Å; L938-L941 HydrophobicContact CG-CD1 4.35Å; L938-L941 VanDerWaalsContact O-CB 3.31Å; L938-L941 WeakPolarHBondContact O-CB 3.45Å; L938-L941 PolarHBondContact O-N 2.84Å
939	I	59.9	Low	73.2	Confident	61 Å²	61	81.7 Å²	81.7	31%	0.313	42%	0.423	S	S	.	.	H	α-helix	trans	-56.6	-37.4	-171.1	-63.3	160.8	0	0	0	112.3	L941 R942 Y943 W1000 E1007	I939-L941 VanDerWaalsContact C-N 3.27Å; I939-L941 PolarHBondContact O-N 2.88Å; I939-R942 WeakPolarHBondContact O-CB 3.46Å; I939-R942 PolarHBondContact O-N 3.39Å; I939-Y943 HydrophobicContact CG2-CD2 4.35Å; I939-Y943 HydrophobicContact CG2-CE2 4.03Å; I939-Y943 VanDerWaalsContact O-CD2 3.29Å; I939-Y943 WeakPolarHBondContact O-CD2 3.4Å; I939-W1000 HydrophobicContact CG2-CE3 4.35Å; I939-W1000 HydrophobicContact CG2-CZ3 3.81Å; I939-E1007 HydrophobicContact CD1-CB 4Å; I939-E1007 HydrophobicContact CD1-CG 4.31Å
940	Y	66.9	Low	73.4	Confident	11 Å²	11	80.3 Å²	80.3	4%	0.043	40%	0.396	C	S	.	.	H	α-helix	trans	-68.8	-22.9	-179.3	58.4	-98.8	0	0	0	113.7	R924 L927 L938 R942 Y943 V944 V949	R924-Y940 HydrophobicContact CG-CE2 4.4Å; R924-Y940 WeakPolarHBondContact CG-OH 3.33Å; L927-Y940 HydrophobicContact CD1-CE2 4.24Å; L938-Y940 VanDerWaalsContact C-N 3.25Å; L938-Y940 HydrophobicContact CB-CD1 4.12Å; L938-Y940 HydrophobicContact CB-CE1 3.69Å; L938-Y940 HydrophobicContact CB-CE2 4.4Å; L938-Y940 HydrophobicContact CD1-CE1 4.27Å; L938-Y940 WeakPolarHBondContact CD1-OH 3.41Å; L938-Y940 HydrophobicContact CD2-CE1 4.29Å; L938-Y940 HydrophobicContact CG-CE1 4.3Å; L938-Y940 PolarHBondContact O-N 3.18Å; L938-Y940 VanDerWaalsContact O-N 3.15Å; Y940-R942 PolarHBondContact O-N 2.98Å; Y940-Y943 PolarHBondContact O-N 3.5Å; Y940-V944 PolarHBondContact O-N 3.4Å; Y940-V949 HydrophobicContact CE2-CG1 4.29Å
941	L	66	Low	73.7	Confident	36 Å²	36	78.9 Å²	78.9	19%	0.188	39%	0.392	C	S	.	.	H	α-helix	trans	-71	-20.9	176.5	-64	169.4	0	0	0	112.7	L927 Q935 P936 L938 I939 L946	L927-L941 HydrophobicContact CD1-CD2 4.22Å; Q935-L941 HydrophobicContact CG-CD1 3.69Å; P936-L941 WeakPolarHBondContact O-CD1 2.99Å; L938-L941 HydrophobicContact CB-CD1 3.74Å; L938-L941 HydrophobicContact CB-CG 4.1Å; L938-L941 HydrophobicContact CD1-CD1 4.11Å; L938-L941 HydrophobicContact CG-CD1 4.35Å; L938-L941 VanDerWaalsContact O-CB 3.31Å; L938-L941 WeakPolarHBondContact O-CB 3.45Å; L938-L941 PolarHBondContact O-N 2.84Å; I939-L941 VanDerWaalsContact C-N 3.27Å; I939-L941 PolarHBondContact O-N 2.88Å; L941-L946 HydrophobicContact CD2-CD2 3.79Å
942	R	65.4	Low	74	Confident	180 Å²	180	75 Å²	75	68%	0.679	37%	0.367	S	S	*	.	H	α-helix	trans	-76.8	-27	176.6	-175.7	176.6	-80.5	-170	-6.8	112.5	I939 Y940	I939-R942 WeakPolarHBondContact O-CB 3.46Å; I939-R942 PolarHBondContact O-N 3.39Å; Y940-R942 PolarHBondContact O-N 2.98Å
943	Y	66.4	Low	74.8	Confident	54 Å²	54	71.4 Å²	71.4	21%	0.212	34%	0.337	C	S	.	.	H	α-helix	trans	-110.6	-21.9	-171.9	-64.1	-76.3	0	0	0	114	I939 Y940 W1000 D1014	I939-Y943 HydrophobicContact CG2-CD2 4.35Å; I939-Y943 HydrophobicContact CG2-CE2 4.03Å; I939-Y943 VanDerWaalsContact O-CD2 3.29Å; I939-Y943 WeakPolarHBondContact O-CD2 3.4Å; Y940-Y943 PolarHBondContact O-N 3.5Å; Y943-W1000 AromaticContact CD1-CZ2 3.99Å; Y943-W1000 HydrophobicContact CD1-CZ2 3.99Å; Y943-W1000 AromaticContact CD2-CD2 3.9Å; Y943-W1000 HydrophobicContact CD2-CD2 3.9Å; Y943-W1000 AromaticContact CD2-CE2 3.88Å; Y943-W1000 AromaticContact CD2-CE3 3.71Å; Y943-W1000 HydrophobicContact CD2-CE3 3.71Å; Y943-W1000 AromaticContact CD2-CH2 3.63Å; Y943-W1000 HydrophobicContact CD2-CH2 3.63Å; Y943-W1000 AromaticContact CD2-CZ2 3.78Å; Y943-W1000 HydrophobicContact CD2-CZ2 3.78Å; Y943-W1000 AromaticContact CD2-CZ3 3.58Å; Y943-W1000 HydrophobicContact CD2-CZ3 3.58Å; Y943-W1000 HydrophobicContact CE1-CH2 4.39Å; Y943-W1000 HydrophobicContact CE1-CZ2 4.12Å; Y943-W1000 HydrophobicContact CE2-CE3 4.3Å; Y943-W1000 AromaticContact CE2-CH2 3.52Å; Y943-W1000 HydrophobicContact CE2-CH2 3.52Å; Y943-W1000 AromaticContact CE2-CZ2 3.96Å; Y943-W1000 HydrophobicContact CE2-CZ2 3.96Å; Y943-W1000 AromaticContact CE2-CZ3 3.68Å; Y943-W1000 HydrophobicContact CE2-CZ3 3.68Å; Y943-W1000 HydrophobicContact CG-CD2 4.01Å; Y943-W1000 AromaticContact CG-CE2 3.7Å; Y943-W1000 HydrophobicContact CG-CE3 4.31Å; Y943-W1000 HydrophobicContact CG-CH2 4.16Å; Y943-W1000 AromaticContact CG-CZ2 3.81Å; Y943-W1000 HydrophobicContact CG-CZ2 3.81Å; Y943-W1000 HydrophobicContact CG-CZ3 4.37Å; Y943-W1000 AromaticContact CZ-CH2 3.91Å; Y943-D1014 WeakPolarHBondContact OH-CB 3.41Å; Y943-D1014 VanDerWaalsContact OH-CG 3.22Å; Y943-D1014 PolarHBondContact OH-OD2 2.91Å
944	V	74.3	Confident	75.5	Confident	2 Å²	2	66.5 Å²	66.5	1%	0.012	32%	0.32	C	S	.	.	S	Bend	trans	-120.5	128	-179.1	-174.3	0	0	0	0	109.1	Y940 K948 V949 E997 W1000	Y940-V944 PolarHBondContact O-N 3.4Å; V944-K948 HydrophobicContact CG1-CB 3.91Å; V944-V949 HydrophobicContact CB-CG2 4.15Å; V944-V949 HydrophobicContact CG1-CG2 3.88Å; V944-E997 HydrophobicContact CG2-CB 4.27Å; V944-E997 HydrophobicContact CG2-CG 4.34Å; V944-W1000 HydrophobicContact CG2-CB 3.85Å; V944-W1000 HydrophobicContact CG2-CG 4.35Å
945	P	78.6	Confident	76.3	Confident	73 Å²	73	62.1 Å²	62.1	47%	0.474	30%	0.303	S	S	.	.			trans	-63.1	142	178	26	-33.7	0	0	0	111	W947 K948 V949	P945-W947 VanDerWaalsContact C-N 3.31Å; P945-W947 PolarHBondContact O-N 3.36Å; P945-K948 HydrophobicContact CG-CB 4.17Å; P945-K948 HydrophobicContact CG-CD 3.84Å; P945-K948 HydrophobicContact CG-CG 3.95Å; P945-K948 WeakPolarHBondContact O-CB 3.36Å; P945-K948 PolarHBondContact O-N 3.09Å; P945-V949 PolarHBondContact O-N 3.11Å
946	L	78	Confident	77.3	Confident	67 Å²	67	60 Å²	60	35%	0.351	29%	0.292	S	S	.	.	H	α-helix	trans	-49.1	-45.2	-175.5	-90.3	169.2	0	0	0	114.1	Q935 L941 K948 V949 H950	Q935-L946 VanDerWaalsContact NE2-CD2 3.26Å; L941-L946 HydrophobicContact CD2-CD2 3.79Å; L946-K948 VanDerWaalsContact C-N 3.27Å; L946-K948 PolarHBondContact O-N 3.5Å; L946-V949 WeakPolarHBondContact O-CB 3.36Å; L946-V949 PolarHBondContact O-N 3.41Å; L946-V949 VanDerWaalsContact O-N 3.07Å; L946-H950 PolarHBondContact O-CD2 3.18Å; L946-H950 PolarHBondContact O-N 3.34Å
947	W	82.9	Confident	78.4	Confident	193 Å²	193	60.2 Å²	60.2	73%	0.731	29%	0.29	S	S	*	.	H	α-helix	trans	-61.2	-35.7	-178.8	-174.5	75.8	0	0	0	112.7	P945 H950 V951	P945-W947 VanDerWaalsContact C-N 3.31Å; P945-W947 PolarHBondContact O-N 3.36Å; W947-H950 PolarHBondContact O-N 2.96Å; W947-V951 HydrophobicContact CD2-CG2 4.19Å; W947-V951 HydrophobicContact CE3-CG2 4.4Å; W947-V951 HydrophobicContact CH2-CG2 4.26Å; W947-V951 HydrophobicContact CZ2-CG2 4.03Å; W947-V951 HydrophobicContact CZ3-CG2 4.43Å; W947-V951 WeakPolarHBondContact O-CG2 3.47Å; W947-V951 PolarHBondContact O-N 3.49Å
948	K	84.7	Confident	80	Confident	64 Å²	64	56.2 Å²	56.2	28%	0.278	27%	0.272	S	S	.	.	H	α-helix	trans	-69.6	-36.6	175	-75	-168.5	179.7	-174.1	0	112.2	V944 P945 L946 H950 V951 F952 F993 E997	V944-K948 HydrophobicContact CG1-CB 3.91Å; P945-K948 HydrophobicContact CG-CB 4.17Å; P945-K948 HydrophobicContact CG-CD 3.84Å; P945-K948 HydrophobicContact CG-CG 3.95Å; P945-K948 WeakPolarHBondContact O-CB 3.36Å; P945-K948 PolarHBondContact O-N 3.09Å; L946-K948 VanDerWaalsContact C-N 3.27Å; L946-K948 PolarHBondContact O-N 3.5Å; K948-H950 VanDerWaalsContact C-N 3.33Å; K948-V951 PolarHBondContact O-N 3.14Å; K948-F952 WeakPolarHBondContact O-CB 3.37Å; K948-F952 PolarHBondContact O-N 3.37Å; K948-F993 HydrophobicContact CB-CE1 4.09Å; K948-F993 HydrophobicContact CG-CE1 4.5Å; K948-E997 WeakPolarHBondContact CD-OE1 3.15Å; K948-E997 WeakPolarHBondContact CE-OE1 3.38Å; K948-E997 IonicContact NZ-OE1 3.89Å; K948-E997 PolarHBondContact NZ-OE1 3.4Å; K948-E997 IonicContact NZ-OE2 2.7Å; K948-E997 PolarHBondContact NZ-OE2 3.47Å
949	V	84.7	Confident	81.1	Confident	2 Å²	2	54.3 Å²	54.3	1%	0.012	26%	0.263	C	S	.	.	H	α-helix	trans	-61.8	-44.8	172.4	-176.9	0	0	0	0	109.8	Y940 V944 P945 L946 F952 T953 L1001	Y940-V949 HydrophobicContact CE2-CG1 4.29Å; V944-V949 HydrophobicContact CB-CG2 4.15Å; V944-V949 HydrophobicContact CG1-CG2 3.88Å; P945-V949 PolarHBondContact O-N 3.11Å; L946-V949 WeakPolarHBondContact O-CB 3.36Å; L946-V949 PolarHBondContact O-N 3.41Å; L946-V949 VanDerWaalsContact O-N 3.07Å; V949-F952 PolarHBondContact O-N 2.83Å; V949-T953 HydrophobicContact CG1-CG2 4.38Å; V949-T953 WeakPolarHBondContact O-CG2 3.48Å; V949-T953 PolarHBondContact O-N 3.35Å; V949-T953 PolarHBondContact O-OG1 2.96Å; V949-L1001 HydrophobicContact CG1-CD2 4.48Å; V949-L1001 HydrophobicContact CG2-CD2 4.37Å
950	H	87.5	Confident	82.4	Confident	45 Å²	45	51.9 Å²	51.9	21%	0.208	25%	0.25	C	S	.	.	H	α-helix	trans	-61.5	-46.5	176.7	-69.5	-55.7	0	0	0	112.4	F928 L946 W947 K948 F952 T953 L954	F928-H950 AromaticContact CD1-CE1 3.77Å; F928-H950 AromaticContact CD1-ND1 3.25Å; F928-H950 VanDerWaalsContact CD1-ND1 3.25Å; F928-H950 WeakPolarHBondContact CD1-ND1 3.42Å; F928-H950 AromaticContact CD2-ND1 3.82Å; F928-H950 HydrophobicContact CE1-CB 3.6Å; F928-H950 AromaticContact CE1-CG 3.54Å; F928-H950 AromaticContact CE1-ND1 3.09Å; F928-H950 WeakPolarHBondContact CE1-ND1 3.39Å; F928-H950 AromaticContact CE2-ND1 3.7Å; F928-H950 AromaticContact CG-CE1 4Å; F928-H950 AromaticContact CG-ND1 3.63Å; F928-H950 HydrophobicContact CZ-CB 3.65Å; F928-H950 AromaticContact CZ-CG 3.84Å; F928-H950 AromaticContact CZ-ND1 3.34Å; F928-H950 VanDerWaalsContact CZ-ND1 3.34Å; F928-H950 WeakPolarHBondContact CZ-ND1 3.25Å; L946-H950 PolarHBondContact O-CD2 3.18Å; L946-H950 PolarHBondContact O-N 3.34Å; W947-H950 PolarHBondContact O-N 2.96Å; K948-H950 VanDerWaalsContact C-N 3.33Å; H950-F952 VanDerWaalsContact C-N 3.35Å; H950-F952 PolarHBondContact O-N 3.48Å; H950-T953 VanDerWaalsContact CA-OG1 3.29Å; H950-T953 WeakPolarHBondContact CA-OG1 3.45Å; H950-T953 PolarHBondContact O-N 3.22Å; H950-T953 PolarHBondContact O-OG1 3.49Å; H950-L954 WeakPolarHBondContact O-CB 3.32Å; H950-L954 PolarHBondContact O-N 3.49Å
951	V	89	Confident	83.5	Confident	48 Å²	48	55.1 Å²	55.1	29%	0.291	27%	0.271	S	S	.	.	H	α-helix	trans	-58.7	-46.6	176	171.6	0	0	0	0	111.2	W947 K948 T953 L954 V955 F993	W947-V951 HydrophobicContact CD2-CG2 4.19Å; W947-V951 HydrophobicContact CE3-CG2 4.4Å; W947-V951 HydrophobicContact CH2-CG2 4.26Å; W947-V951 HydrophobicContact CZ2-CG2 4.03Å; W947-V951 HydrophobicContact CZ3-CG2 4.43Å; W947-V951 WeakPolarHBondContact O-CG2 3.47Å; W947-V951 PolarHBondContact O-N 3.49Å; K948-V951 PolarHBondContact O-N 3.14Å; V951-T953 VanDerWaalsContact C-N 3.33Å; V951-T953 PolarHBondContact O-N 3.21Å; V951-L954 PolarHBondContact O-N 3.31Å; V951-V955 WeakPolarHBondContact O-CG2 3.48Å; V951-V955 PolarHBondContact O-N 2.87Å; V951-F993 HydrophobicContact CG1-CZ 4.16Å
952	F	88.8	Confident	84.6	Confident	0 Å²	0	58 Å²	58	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-57.5	-46.8	177.4	-179.3	-86.3	0	0	0	111.8	F588 K948 V949 H950 L954 V955 Q956 L989 F993 L998 L1001	F588-F952 HydrophobicContact CB-CZ 4.29Å; F588-F952 AromaticContact CD2-CE1 3.68Å; F588-F952 HydrophobicContact CD2-CE1 3.68Å; F588-F952 HydrophobicContact CD2-CE2 4.04Å; F588-F952 AromaticContact CD2-CZ 3.35Å; F588-F952 HydrophobicContact CD2-CZ 3.35Å; F588-F952 HydrophobicContact CE2-CE1 4.16Å; F588-F952 HydrophobicContact CE2-CE2 4.43Å; F588-F952 HydrophobicContact CE2-CZ 4.02Å; F588-F952 HydrophobicContact CG-CZ 4.23Å; K948-F952 WeakPolarHBondContact O-CB 3.37Å; K948-F952 PolarHBondContact O-N 3.37Å; V949-F952 PolarHBondContact O-N 2.83Å; H950-F952 VanDerWaalsContact C-N 3.35Å; H950-F952 PolarHBondContact O-N 3.48Å; F952-L954 PolarHBondContact O-N 3.24Å; F952-V955 PolarHBondContact O-N 3.14Å; F952-Q956 PolarHBondContact O-N 2.71Å; F952-L989 HydrophobicContact CE2-CD1 4.49Å; F952-F993 HydrophobicContact CB-CE1 4.47Å; F952-F993 HydrophobicContact CB-CZ 4.06Å; F952-L998 HydrophobicContact CD2-CD1 4.2Å; F952-L998 HydrophobicContact CE2-CD1 3.86Å; F952-L1001 HydrophobicContact CB-CD1 4.13Å; F952-L1001 HydrophobicContact CD1-CD1 4.45Å; F952-L1001 HydrophobicContact CD2-CD1 3.86Å; F952-L1001 HydrophobicContact CE2-CB 4.32Å; F952-L1001 HydrophobicContact CE2-CD1 4.35Å; F952-L1001 HydrophobicContact CG-CD1 3.89Å; F952-L1001 HydrophobicContact CZ-CB 4.23Å
953	T	89.8	Confident	85.5	Confident	1 Å²	1	49.5 Å²	49.5	1%	0.006	25%	0.254	C	S	.	.	H	α-helix	trans	-69.6	-31.8	-179.4	54.5	0	0	0	0	113	R924 F928 V949 H950 V951 Q956 L957	R924-T953 HydrophobicContact CB-CG2 3.43Å; R924-T953 VanDerWaalsContact CB-CG2 3.43Å; R924-T953 HydrophobicContact CG-CG2 4.06Å; F928-T953 WeakPolarHBondContact CE2-OG1 3.43Å; F928-T953 VanDerWaalsContact CZ-OG1 3.31Å; F928-T953 WeakPolarHBondContact CZ-OG1 3.34Å; V949-T953 HydrophobicContact CG1-CG2 4.38Å; V949-T953 WeakPolarHBondContact O-CG2 3.48Å; V949-T953 PolarHBondContact O-N 3.35Å; V949-T953 PolarHBondContact O-OG1 2.96Å; H950-T953 VanDerWaalsContact CA-OG1 3.29Å; H950-T953 WeakPolarHBondContact CA-OG1 3.45Å; H950-T953 PolarHBondContact O-N 3.22Å; H950-T953 PolarHBondContact O-OG1 3.49Å; V951-T953 VanDerWaalsContact C-N 3.33Å; V951-T953 PolarHBondContact O-N 3.21Å; T953-Q956 PolarHBondContact O-N 2.7Å; T953-L957 VanDerWaalsContact O-CB 3.31Å; T953-L957 WeakPolarHBondContact O-CB 3.3Å; T953-L957 PolarHBondContact O-N 3.39Å
954	L	90.5	Very high	86.4	Confident	98 Å²	98	50.1 Å²	50.1	51%	0.513	26%	0.256	S	S	.	.	H	α-helix	trans	-67.3	-41.3	174.6	-173	72.6	0	0	0	111	H950 V951 F952 L957 T958	H950-L954 WeakPolarHBondContact O-CB 3.32Å; H950-L954 PolarHBondContact O-N 3.49Å; V951-L954 PolarHBondContact O-N 3.31Å; F952-L954 PolarHBondContact O-N 3.24Å; L954-L957 PolarHBondContact O-N 2.97Å; L954-T958 WeakPolarHBondContact O-CB 3.34Å; L954-T958 PolarHBondContact O-N 3.18Å; L954-T958 PolarHBondContact O-OG1 3.45Å
955	V	89.8	Confident	87.1	Confident	42 Å²	42	54.2 Å²	54.2	26%	0.255	28%	0.281	S	S	.	.	H	α-helix	trans	-61.7	-45.9	173.5	175	0	0	0	0	110.4	V951 F952 L957 T958 C959 L989	V951-V955 WeakPolarHBondContact O-CG2 3.48Å; V951-V955 PolarHBondContact O-N 2.87Å; F952-V955 PolarHBondContact O-N 3.14Å; V955-L957 PolarHBondContact O-N 2.65Å; V955-T958 PolarHBondContact O-N 3.42Å; V955-C959 PolarHBondContact O-N 3.22Å; V955-C959 PolarHBondContact O-SG 3.19Å; V955-L989 HydrophobicContact CG1-CD1 4.18Å; V955-L989 HydrophobicContact CG1-CD2 4.23Å; V955-L989 HydrophobicContact CG2-CD2 4.48Å
956	Q	90.1	Very high	87.3	Confident	0 Å²	0	53 Å²	53	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-60.8	-44.9	177	-163.1	171.2	-5	0	0	112.2	F588 A592 F921 F952 T953 C959 L960	F588-Q956 HydrophobicContact CD2-CB 4.18Å; F588-Q956 HydrophobicContact CD2-CG 3.91Å; F588-Q956 HydrophobicContact CE2-CB 3.44Å; F588-Q956 VanDerWaalsContact CE2-CB 3.44Å; F588-Q956 HydrophobicContact CE2-CG 3.55Å; F588-Q956 HydrophobicContact CZ-CB 3.99Å; F588-Q956 HydrophobicContact CZ-CG 4.01Å; F588-Q956 PolarHBondContact O-NE2 3.45Å; A592-Q956 HydrophobicContact CB-CG 4.12Å; F921-Q956 HydrophobicContact CD2-CB 4.04Å; F921-Q956 HydrophobicContact CD2-CG 3.7Å; F921-Q956 HydrophobicContact CE2-CB 3.66Å; F921-Q956 HydrophobicContact CE2-CG 3.61Å; F921-Q956 HydrophobicContact CG-CG 4.38Å; F921-Q956 HydrophobicContact CZ-CB 4.46Å; F921-Q956 HydrophobicContact CZ-CG 4.22Å; F952-Q956 PolarHBondContact O-N 2.71Å; T953-Q956 PolarHBondContact O-N 2.7Å; Q956-C959 WeakPolarHBondContact O-CB 3.41Å; Q956-C959 PolarHBondContact O-N 2.96Å; Q956-L960 PolarHBondContact O-N 3.06Å
957	L	91	Very high	87.4	Confident	66 Å²	66	53 Å²	53	35%	0.346	27%	0.267	S	S	.	.	H	α-helix	trans	-62.9	-43.5	177.7	-177.5	67.6	0	0	0	111.4	F921 I925 T953 L954 V955 C959 L960 V961	F921-L957 HydrophobicContact CE2-CB 4.49Å; F921-L957 HydrophobicContact CZ-CB 4.23Å; F921-L957 HydrophobicContact CZ-CD1 4.17Å; I925-L957 HydrophobicContact CD1-CD1 4.47Å; T953-L957 VanDerWaalsContact O-CB 3.31Å; T953-L957 WeakPolarHBondContact O-CB 3.3Å; T953-L957 PolarHBondContact O-N 3.39Å; L954-L957 PolarHBondContact O-N 2.97Å; V955-L957 PolarHBondContact O-N 2.65Å; L957-C959 VanDerWaalsContact C-N 3.32Å; L957-C959 PolarHBondContact O-N 3.3Å; L957-L960 WeakPolarHBondContact O-CB 3.48Å; L957-L960 PolarHBondContact O-N 3.19Å; L957-L960 VanDerWaalsContact O-N 3.1Å; L957-V961 WeakPolarHBondContact O-CG2 3.31Å; L957-V961 PolarHBondContact O-N 3.43Å
958	T	90.5	Very high	87.3	Confident	87 Å²	87	47.5 Å²	47.5	53%	0.534	26%	0.263	S	S	.	.	H	α-helix	trans	-61	-42.6	177.3	-55.1	0	0	0	0	111.1	L954 V955 L960 V961 L962	L954-T958 WeakPolarHBondContact O-CB 3.34Å; L954-T958 PolarHBondContact O-N 3.18Å; L954-T958 PolarHBondContact O-OG1 3.45Å; V955-T958 PolarHBondContact O-N 3.42Å; T958-L960 VanDerWaalsContact C-N 3.32Å; T958-L960 PolarHBondContact O-N 3.43Å; T958-V961 PolarHBondContact O-N 3.03Å; T958-L962 PolarHBondContact O-N 3.08Å
959	C	87.9	Confident	87.1	Confident	11 Å²	11	46.9 Å²	46.9	7%	0.074	27%	0.267	C	S	.	.	H	α-helix	trans	-62.4	-39.4	174.1	-65.1	0	0	0	0	112	V955 Q956 L957 L962 L963 L982	V955-C959 PolarHBondContact O-N 3.22Å; V955-C959 PolarHBondContact O-SG 3.19Å; Q956-C959 WeakPolarHBondContact O-CB 3.41Å; Q956-C959 PolarHBondContact O-N 2.96Å; L957-C959 VanDerWaalsContact C-N 3.32Å; L957-C959 PolarHBondContact O-N 3.3Å; C959-L962 PolarHBondContact O-N 3.46Å; C959-L963 WeakPolarHBondContact O-CD1 3.34Å; C959-L963 WeakPolarHBondContact O-CG 3.38Å; C959-L963 PolarHBondContact O-N 3.28Å; C959-L982 HydrophobicContact CB-CD2 3.63Å
960	L	88.4	Confident	86.6	Confident	10 Å²	10	51.3 Å²	51.3	5%	0.052	30%	0.304	C	S	.	.	H	α-helix	trans	-65.8	-41.7	176.8	-173.6	144	0	0	0	112.5	A595 L596 I599 F921 Q956 L957 T958 L962 L963 W964	A595-L960 HydrophobicContact CB-CD1 3.88Å; L596-L960 HydrophobicContact CB-CD1 4.26Å; L596-L960 HydrophobicContact CB-CG 4.44Å; L596-L960 HydrophobicContact CD1-CG 4.33Å; I599-L960 HydrophobicContact CD1-CD1 4.35Å; I599-L960 HydrophobicContact CD1-CD2 3.93Å; F921-L960 HydrophobicContact CE1-CD1 3.87Å; F921-L960 HydrophobicContact CZ-CD1 4.47Å; Q956-L960 PolarHBondContact O-N 3.06Å; L957-L960 WeakPolarHBondContact O-CB 3.48Å; L957-L960 PolarHBondContact O-N 3.19Å; L957-L960 VanDerWaalsContact O-N 3.1Å; T958-L960 VanDerWaalsContact C-N 3.32Å; T958-L960 PolarHBondContact O-N 3.43Å; L960-L962 VanDerWaalsContact C-N 3.33Å; L960-L963 PolarHBondContact O-N 3.43Å; L960-W964 PolarHBondContact O-N 2.92Å
961	V	90.3	Very high	86.1	Confident	78 Å²	78	51.5 Å²	51.5	47%	0.473	31%	0.313	S	S	.	.	H	α-helix	trans	-63.3	-41.7	174.6	175.9	0	0	0	0	110.7	L957 T958 L963 W964 V965	L957-V961 WeakPolarHBondContact O-CG2 3.31Å; L957-V961 PolarHBondContact O-N 3.43Å; T958-V961 PolarHBondContact O-N 3.03Å; V961-L963 PolarHBondContact O-N 3.43Å; V961-W964 WeakPolarHBondContact O-CB 3.31Å; V961-W964 PolarHBondContact O-N 2.84Å; V961-V965 HydrophobicContact CG1-CG2 4.42Å; V961-V965 WeakPolarHBondContact O-CG2 3.5Å; V961-V965 PolarHBondContact O-N 2.91Å
962	L	87.3	Confident	85.3	Confident	98 Å²	98	49.8 Å²	49.8	51%	0.513	30%	0.304	S	S	.	.	H	α-helix	trans	-59.8	-45.9	176.1	-169.5	79.7	0	0	0	111.5	T958 C959 L960 W964 V965 I966	T958-L962 PolarHBondContact O-N 3.08Å; C959-L962 PolarHBondContact O-N 3.46Å; L960-L962 VanDerWaalsContact C-N 3.33Å; L962-W964 VanDerWaalsContact C-N 3.3Å; L962-W964 PolarHBondContact O-N 2.71Å; L962-V965 PolarHBondContact O-N 3.44Å; L962-I966 HydrophobicContact CG-CD1 4.09Å; L962-I966 WeakPolarHBondContact O-CG1 3.41Å; L962-I966 PolarHBondContact O-N 3.07Å; L962-I966 VanDerWaalsContact O-N 3.12Å
963	L	84.7	Confident	84.5	Confident	1 Å²	1	51.3 Å²	51.3	1%	0.005	31%	0.313	C	S	.	.	H	α-helix	trans	-59.2	-41.5	175.1	-70.2	157.4	0	0	0	111.7	L596 C959 L960 V961 K967 F975 M978 V979 L982	L596-L963 HydrophobicContact CD1-CB 4.3Å; L596-L963 HydrophobicContact CD2-CB 3.7Å; L596-L963 HydrophobicContact CD2-CD1 4.13Å; L596-L963 HydrophobicContact CD2-CG 4.36Å; C959-L963 WeakPolarHBondContact O-CD1 3.34Å; C959-L963 WeakPolarHBondContact O-CG 3.38Å; C959-L963 PolarHBondContact O-N 3.28Å; L960-L963 PolarHBondContact O-N 3.43Å; V961-L963 PolarHBondContact O-N 3.43Å; L963-K967 VanDerWaalsContact O-CB 3.27Å; L963-K967 WeakPolarHBondContact O-CB 3.44Å; L963-K967 PolarHBondContact O-N 3.4Å; L963-F975 HydrophobicContact CD2-CE2 4.3Å; L963-M978 HydrophobicContact CB-SD 4.31Å; L963-M978 HydrophobicContact CD2-CB 4.25Å; L963-M978 HydrophobicContact CD2-CE 3.7Å; L963-M978 HydrophobicContact CD2-CG 3.6Å; L963-M978 HydrophobicContact CD2-SD 3.36Å; L963-M978 WeakPolarHBondContact CD2-SD 3.17Å; L963-M978 HydrophobicContact CG-SD 3.97Å; L963-V979 HydrophobicContact CD2-CG2 4.46Å; L963-L982 HydrophobicContact CD1-CD1 3.5Å; L963-L982 VanDerWaalsContact CD1-CD1 3.5Å; L963-L982 HydrophobicContact CD1-CD2 4.03Å; L963-L982 HydrophobicContact CD1-CG 4.26Å; L963-L982 HydrophobicContact CD2-CD1 4.12Å; L963-L982 HydrophobicContact CG-CD1 4.34Å; L963-L982 HydrophobicContact CG-CD2 4.49Å
964	W	86.8	Confident	84	Confident	66 Å²	66	55.1 Å²	55.1	25%	0.25	34%	0.336	C	S	.	.	H	α-helix	trans	-62.7	-49.2	178.7	-178.2	-89.5	0	0	0	112.5	L596 I599 I600 Y603 L960 V961 L962 I966 K967 A968	L596-W964 HydrophobicContact CD1-CB 4.31Å; L596-W964 HydrophobicContact CD1-CE3 3.95Å; I599-W964 HydrophobicContact CB-CZ3 4.29Å; I599-W964 HydrophobicContact CG2-CE3 4.12Å; I599-W964 HydrophobicContact CG2-CH2 4.13Å; I599-W964 HydrophobicContact CG2-CZ3 3.6Å; I600-W964 HydrophobicContact CB-CZ3 4.23Å; I600-W964 HydrophobicContact CG1-CE3 4.01Å; I600-W964 HydrophobicContact CG1-CH2 4.29Å; I600-W964 HydrophobicContact CG1-CZ3 3.44Å; I600-W964 VanDerWaalsContact CG1-CZ3 3.44Å; Y603-W964 HydrophobicContact CD1-CH2 4.05Å; Y603-W964 HydrophobicContact CD1-CZ2 4.21Å; Y603-W964 HydrophobicContact CD2-CH2 4.15Å; Y603-W964 AromaticContact CD2-CZ2 3.91Å; Y603-W964 HydrophobicContact CD2-CZ2 3.91Å; Y603-W964 HydrophobicContact CE2-CZ2 4.39Å; Y603-W964 AromaticContact CG-CH2 3.64Å; Y603-W964 HydrophobicContact CG-CH2 3.64Å; Y603-W964 AromaticContact CG-CZ2 3.82Å; Y603-W964 HydrophobicContact CG-CZ2 3.82Å; L960-W964 PolarHBondContact O-N 2.92Å; V961-W964 WeakPolarHBondContact O-CB 3.31Å; V961-W964 PolarHBondContact O-N 2.84Å; L962-W964 VanDerWaalsContact C-N 3.3Å; L962-W964 PolarHBondContact O-N 2.71Å; W964-I966 VanDerWaalsContact C-N 3.31Å; W964-I966 PolarHBondContact O-N 2.61Å; W964-K967 PolarHBondContact O-N 3.13Å; W964-A968 PolarHBondContact O-N 3.48Å
965	V	87.9	Confident	83.1	Confident	88 Å²	88	50.8 Å²	50.8	53%	0.533	31%	0.313	S	S	.	.	H	α-helix	trans	-59.7	-44	179.8	171.3	0	0	0	0	110.6	V961 L962 A968 S969	V961-V965 HydrophobicContact CG1-CG2 4.42Å; V961-V965 WeakPolarHBondContact O-CG2 3.5Å; V961-V965 PolarHBondContact O-N 2.91Å; L962-V965 PolarHBondContact O-N 3.44Å; V965-A968 PolarHBondContact O-N 3.35Å; V965-S969 PolarHBondContact O-N 2.96Å
966	I	83.4	Confident	82.3	Confident	48 Å²	48	49 Å²	49	25%	0.246	30%	0.302	C	S	.	.	H	α-helix	trans	-68.7	-38.8	179.4	-68	165.6	0	0	0	110.8	L962 W964 A968 S969 M978	L962-I966 HydrophobicContact CG-CD1 4.09Å; L962-I966 WeakPolarHBondContact O-CG1 3.41Å; L962-I966 PolarHBondContact O-N 3.07Å; L962-I966 VanDerWaalsContact O-N 3.12Å; W964-I966 VanDerWaalsContact C-N 3.31Å; W964-I966 PolarHBondContact O-N 2.61Å; I966-A968 VanDerWaalsContact C-N 3.29Å; I966-A968 PolarHBondContact O-N 3.48Å; I966-S969 WeakPolarHBondContact O-CB 3.48Å; I966-S969 PolarHBondContact O-N 3.12Å; I966-S969 VanDerWaalsContact O-N 3.09Å; I966-S969 PolarHBondContact O-OG 3.01Å; I966-M978 HydrophobicContact CB-CE 3.67Å; I966-M978 HydrophobicContact CB-SD 4.03Å; I966-M978 HydrophobicContact CD1-CE 4.07Å; I966-M978 HydrophobicContact CD1-SD 3.34Å; I966-M978 WeakPolarHBondContact CD1-SD 3.48Å; I966-M978 HydrophobicContact CG1-CE 4.47Å; I966-M978 HydrophobicContact CG1-SD 4.25Å; I966-M978 HydrophobicContact CG2-CE 3.41Å; I966-M978 VanDerWaalsContact CG2-CE 3.41Å; I966-M978 HydrophobicContact CG2-SD 4.23Å
967	K	79.6	Confident	81.8	Confident	66 Å²	66	53.3 Å²	53.3	29%	0.287	32%	0.324	S	S	.	.	H	α-helix	trans	-61.3	-35.8	174.4	177.2	-96.4	177.1	174.8	0	112.6	I600 L963 W964 S969	I600-K967 HydrophobicContact CD1-CD 4Å; I600-K967 HydrophobicContact CD1-CG 4.13Å; I600-K967 HydrophobicContact CG1-CD 4.23Å; L963-K967 VanDerWaalsContact O-CB 3.27Å; L963-K967 WeakPolarHBondContact O-CB 3.44Å; L963-K967 PolarHBondContact O-N 3.4Å; W964-K967 PolarHBondContact O-N 3.13Å; K967-S969 VanDerWaalsContact C-N 3.26Å; K967-S969 PolarHBondContact O-N 3.12Å
968	A	80.3	Confident	81.1	Confident	78 Å²	78	51.1 Å²	51.1	65%	0.645	31%	0.312	S	S	*	.	H	α-helix	trans	-72.9	-19.7	176.5	0	0	0	0	0	112.9	W964 V965 I966	W964-A968 PolarHBondContact O-N 3.48Å; V965-A968 PolarHBondContact O-N 3.35Å; I966-A968 VanDerWaalsContact C-N 3.29Å; I966-A968 PolarHBondContact O-N 3.48Å
969	S	81.8	Confident	80.4	Confident	51 Å²	51	47.2 Å²	47.2	36%	0.357	29%	0.288	S	S	.	.	S	Bend	trans	-86.7	165.8	-179.1	81.2	0	0	0	0	113.2	V965 I966 K967 A971 A972	V965-S969 PolarHBondContact O-N 2.96Å; I966-S969 WeakPolarHBondContact O-CB 3.48Å; I966-S969 PolarHBondContact O-N 3.12Å; I966-S969 VanDerWaalsContact O-N 3.09Å; I966-S969 PolarHBondContact O-OG 3.01Å; K967-S969 VanDerWaalsContact C-N 3.26Å; K967-S969 PolarHBondContact O-N 3.12Å; S969-A971 PolarHBondContact O-N 3.1Å; S969-A971 VanDerWaalsContact O-N 3.1Å; S969-A971 WeakPolarHBondContact OG-CB 3.39Å; S969-A971 PolarHBondContact OG-N 3.28Å; S969-A971 VanDerWaalsContact OG-N 3.15Å; S969-A972 WeakPolarHBondContact O-CB 3.39Å; S969-A972 PolarHBondContact O-N 3.4Å
970	A	73.5	Confident	80	Confident	96 Å²	96	50.3 Å²	50.3	79%	0.793	30%	0.303	S	S	*	.	G	3₁₀ helix	trans	-62.9	-12.9	171.1	0	0	0	0	0	113.7	A972	A970-A972 PolarHBondContact O-N 3.44Å
971	A	76.9	Confident	79.7	Confident	49 Å²	49	52 Å²	52	41%	0.405	32%	0.318	S	S	.	.	G	3₁₀ helix	trans	-80.4	7.6	176	0	0	0	0	0	113.7	S969 V973 V974	S969-A971 PolarHBondContact O-N 3.1Å; S969-A971 VanDerWaalsContact O-N 3.1Å; S969-A971 WeakPolarHBondContact OG-CB 3.39Å; S969-A971 PolarHBondContact OG-N 3.28Å; S969-A971 VanDerWaalsContact OG-N 3.15Å; A971-V973 PolarHBondContact O-N 2.99Å; A971-V974 PolarHBondContact O-N 2.85Å
972	A	72	Confident	79.1	Confident	11 Å²	11	48.4 Å²	48.4	9%	0.091	30%	0.297	C	S	.	.	G	3₁₀ helix	trans	-55.8	-17.8	178.5	0	0	0	0	0	114.6	V539 S969 A970 V974 F975	V539-A972 HydrophobicContact CG1-CB 4.15Å; S969-A972 WeakPolarHBondContact O-CB 3.39Å; S969-A972 PolarHBondContact O-N 3.4Å; A970-A972 PolarHBondContact O-N 3.44Å; A972-V974 PolarHBondContact O-N 3.39Å; A972-F975 WeakPolarHBondContact O-CB 3.36Å; A972-F975 PolarHBondContact O-N 3.18Å; A972-F975 VanDerWaalsContact O-N 3.17Å
973	V	72.4	Confident	78.8	Confident	33 Å²	33	45.4 Å²	45.4	20%	0.2	28%	0.282	C	S	.	.	G	3₁₀ helix	trans	-63.8	-28.6	172.7	-177.6	0	0	0	0	112.4	F540 I543 L789 A971 F975 P976	F540-V973 HydrophobicContact CD2-CG1 4.44Å; I543-V973 HydrophobicContact CD1-CG2 3.2Å; L789-V973 HydrophobicContact CD1-CG1 4.35Å; A971-V973 PolarHBondContact O-N 2.99Å; V973-F975 PolarHBondContact O-N 3.32Å; V973-P976 WeakPolarHBondContact O-CD 3.49Å
974	V	78.3	Confident	78.7	Confident	80 Å²	80	52.1 Å²	52.1	49%	0.485	31%	0.312	S	S	.	.	G	3₁₀ helix	trans	-81.8	-0.5	179.7	-170.2	0	0	0	0	111.7	A971 A972 P976 M977 M978	A971-V974 PolarHBondContact O-N 2.85Å; A972-V974 PolarHBondContact O-N 3.39Å; V974-P976 VanDerWaalsContact C-CD 3.44Å; V974-M977 HydrophobicContact CG1-CB 3.98Å; V974-M977 WeakPolarHBondContact O-CB 3.41Å; V974-M977 PolarHBondContact O-N 3.3Å; V974-M978 PolarHBondContact O-N 3.22Å
975	F	72.6	Confident	78.6	Confident	7 Å²	7	51.4 Å²	51.4	3%	0.031	31%	0.312	C	S	.	.	H	α-helix	trans	-49.1	-43.7	-176.5	179.2	-102.8	0	0	0	114.7	P536 F593 L596 L963 A972 V973 M977 M978 V979	P536-F975 HydrophobicContact CG-CD1 4.21Å; P536-F975 HydrophobicContact CG-CE1 4.37Å; F593-F975 HydrophobicContact CD2-CZ 4.4Å; F593-F975 AromaticContact CE2-CE1 3.79Å; F593-F975 HydrophobicContact CE2-CE1 3.79Å; F593-F975 AromaticContact CE2-CZ 3.86Å; F593-F975 HydrophobicContact CE2-CZ 3.86Å; L596-F975 HydrophobicContact CD2-CE2 3.68Å; L596-F975 HydrophobicContact CD2-CZ 3.8Å; L963-F975 HydrophobicContact CD2-CE2 4.3Å; A972-F975 WeakPolarHBondContact O-CB 3.36Å; A972-F975 PolarHBondContact O-N 3.18Å; A972-F975 VanDerWaalsContact O-N 3.17Å; V973-F975 PolarHBondContact O-N 3.32Å; F975-M977 PolarHBondContact O-N 2.94Å; F975-M978 HydrophobicContact CD2-CE 3.77Å; F975-M978 WeakPolarHBondContact O-CB 3.34Å; F975-M978 PolarHBondContact O-N 3.34Å; F975-V979 HydrophobicContact CE1-CG2 4.45Å; F975-V979 HydrophobicContact CZ-CG2 4.45Å; F975-V979 PolarHBondContact O-N 3.47Å
976	P	71.9	Confident	78.4	Confident	5 Å²	5	48.3 Å²	48.3	3%	0.032	29%	0.291	C	S	.	.	H	α-helix	trans	-65.9	-37.3	178.3	-22.2	35	0	0	0	114.3	I792 L793 M796 V973 V974 M978 V979 L980	I792-P976 HydrophobicContact CG2-CB 3.9Å; L793-P976 VanDerWaalsContact CA-CG 3.45Å; L793-P976 HydrophobicContact CB-CB 4.45Å; L793-P976 HydrophobicContact CB-CG 3.54Å; L793-P976 HydrophobicContact CD1-CG 3.93Å; L793-P976 HydrophobicContact CG-CG 3.65Å; M796-P976 HydrophobicContact CB-CB 4.41Å; M796-P976 HydrophobicContact CG-CB 4.21Å; V973-P976 WeakPolarHBondContact O-CD 3.49Å; V974-P976 VanDerWaalsContact C-CD 3.44Å; P976-M978 PolarHBondContact O-N 3.44Å; P976-V979 PolarHBondContact O-N 3.43Å; P976-L980 PolarHBondContact O-N 2.87Å
977	M	79.3	Confident	78.2	Confident	90 Å²	90	52.7 Å²	52.7	44%	0.443	31%	0.308	S	S	.	.	H	α-helix	trans	-65.3	-30.9	176.3	-69.3	-62.1	-65.3	0	0	111.5	I792 V974 F975 L980 A981	I792-M977 HydrophobicContact CD1-SD 4.04Å; I792-M977 HydrophobicContact CG2-SD 4.25Å; V974-M977 HydrophobicContact CG1-CB 3.98Å; V974-M977 WeakPolarHBondContact O-CB 3.41Å; V974-M977 PolarHBondContact O-N 3.3Å; F975-M977 PolarHBondContact O-N 2.94Å; M977-L980 WeakPolarHBondContact O-CB 3.35Å; M977-L980 PolarHBondContact O-N 3.45Å; M977-L980 HydrophobicContact SD-CD1 4.17Å; M977-A981 PolarHBondContact O-N 3.05Å; M977-A981 VanDerWaalsContact O-N 3.08Å
978	M	77.4	Confident	78.4	Confident	21 Å²	21	53.9 Å²	53.9	10%	0.103	32%	0.317	C	S	.	.	H	α-helix	trans	-72.5	-35.5	176.4	-171.6	-176.5	13	0	0	112.2	L963 I966 V974 F975 P976 L980 A981 L982	L963-M978 HydrophobicContact CB-SD 4.31Å; L963-M978 HydrophobicContact CD2-CB 4.25Å; L963-M978 HydrophobicContact CD2-CE 3.7Å; L963-M978 HydrophobicContact CD2-CG 3.6Å; L963-M978 HydrophobicContact CD2-SD 3.36Å; L963-M978 WeakPolarHBondContact CD2-SD 3.17Å; L963-M978 HydrophobicContact CG-SD 3.97Å; I966-M978 HydrophobicContact CB-CE 3.67Å; I966-M978 HydrophobicContact CB-SD 4.03Å; I966-M978 HydrophobicContact CD1-CE 4.07Å; I966-M978 HydrophobicContact CD1-SD 3.34Å; I966-M978 WeakPolarHBondContact CD1-SD 3.48Å; I966-M978 HydrophobicContact CG1-CE 4.47Å; I966-M978 HydrophobicContact CG1-SD 4.25Å; I966-M978 HydrophobicContact CG2-CE 3.41Å; I966-M978 VanDerWaalsContact CG2-CE 3.41Å; I966-M978 HydrophobicContact CG2-SD 4.23Å; V974-M978 PolarHBondContact O-N 3.22Å; F975-M978 HydrophobicContact CD2-CE 3.77Å; F975-M978 WeakPolarHBondContact O-CB 3.34Å; F975-M978 PolarHBondContact O-N 3.34Å; P976-M978 PolarHBondContact O-N 3.44Å; M978-L980 VanDerWaalsContact C-N 3.27Å; M978-L980 PolarHBondContact O-N 3.46Å; M978-A981 CarbonylContact O-C 3.57Å; M978-A981 WeakPolarHBondContact O-CA 3.4Å; M978-A981 VanDerWaalsContact O-CB 3.25Å; M978-A981 WeakPolarHBondContact O-CB 3.06Å; M978-A981 PolarHBondContact O-N 3.47Å; M978-L982 PolarHBondContact O-N 3.05Å
979	V	75.9	Confident	78.4	Confident	5 Å²	5	50.4 Å²	50.4	3%	0.03	29%	0.288	C	S	.	.	H	α-helix	trans	-63.4	-37.5	173.2	-178.9	0	0	0	0	110.6	F593 M796 I800 L963 F975 P976 A981 L982 V983	F593-V979 HydrophobicContact CD2-CG2 4.09Å; F593-V979 HydrophobicContact CE2-CG2 4.23Å; M796-V979 HydrophobicContact CE-CB 3.8Å; M796-V979 HydrophobicContact CE-CG1 3.58Å; I800-V979 HydrophobicContact CD1-CG1 3.7Å; L963-V979 HydrophobicContact CD2-CG2 4.46Å; F975-V979 HydrophobicContact CE1-CG2 4.45Å; F975-V979 HydrophobicContact CZ-CG2 4.45Å; F975-V979 PolarHBondContact O-N 3.47Å; P976-V979 PolarHBondContact O-N 3.43Å; V979-A981 VanDerWaalsContact C-N 3.29Å; V979-A981 PolarHBondContact O-N 3.03Å; V979-L982 HydrophobicContact CG1-CD1 4.4Å; V979-L982 VanDerWaalsContact O-CB 3.32Å; V979-L982 WeakPolarHBondContact O-CB 3.34Å; V979-L982 PolarHBondContact O-N 2.9Å; V979-L982 VanDerWaalsContact O-N 3.14Å; V979-V983 PolarHBondContact O-N 3.32Å
980	L	78.3	Confident	78.2	Confident	76 Å²	76	51.8 Å²	51.8	40%	0.398	29%	0.291	S	S	.	.	H	α-helix	trans	-61.6	-37.2	169.3	-69.1	172.8	0	0	0	112.2	M796 P976 M977 M978 L982 V983 F984	M796-L980 HydrophobicContact CE-CD2 3.62Å; M796-L980 HydrophobicContact CE-CG 3.72Å; M796-L980 HydrophobicContact SD-CD2 3.71Å; M796-L980 HydrophobicContact SD-CG 4.04Å; P976-L980 PolarHBondContact O-N 2.87Å; M977-L980 WeakPolarHBondContact O-CB 3.35Å; M977-L980 PolarHBondContact O-N 3.45Å; M977-L980 HydrophobicContact SD-CD1 4.17Å; M978-L980 VanDerWaalsContact C-N 3.27Å; M978-L980 PolarHBondContact O-N 3.46Å; L980-L982 VanDerWaalsContact C-N 3.26Å; L980-L982 PolarHBondContact O-N 3.49Å; L980-V983 WeakPolarHBondContact O-CB 3.44Å; L980-V983 PolarHBondContact O-N 3.07Å; L980-V983 VanDerWaalsContact O-N 3.12Å; L980-F984 PolarHBondContact O-N 3.06Å
981	A	82.3	Confident	78.4	Confident	44 Å²	44	54.2 Å²	54.2	36%	0.364	29%	0.29	S	S	.	.	H	α-helix	trans	-63	-30.4	174.4	0	0	0	0	0	112.6	M977 M978 V979 V983 F984 I985	M977-A981 PolarHBondContact O-N 3.05Å; M977-A981 VanDerWaalsContact O-N 3.08Å; M978-A981 CarbonylContact O-C 3.57Å; M978-A981 WeakPolarHBondContact O-CA 3.4Å; M978-A981 VanDerWaalsContact O-CB 3.25Å; M978-A981 WeakPolarHBondContact O-CB 3.06Å; M978-A981 PolarHBondContact O-N 3.47Å; V979-A981 VanDerWaalsContact C-N 3.29Å; V979-A981 PolarHBondContact O-N 3.03Å; A981-V983 VanDerWaalsContact C-N 3.3Å; A981-V983 PolarHBondContact O-N 3.36Å; A981-F984 WeakPolarHBondContact O-CB 3.41Å; A981-F984 PolarHBondContact O-N 3.46Å; A981-F984 VanDerWaalsContact O-N 3.13Å; A981-I985 WeakPolarHBondContact O-CG1 3.49Å; A981-I985 PolarHBondContact O-N 3Å
982	L	79.6	Confident	78.5	Confident	4 Å²	4	58.4 Å²	58.4	2%	0.021	31%	0.305	C	S	.	.	H	α-helix	trans	-63.5	-36	172.8	-59.6	170.1	0	0	0	112.3	T589 C959 L963 M978 V979 L980 F984 I985 R986	T589-L982 HydrophobicContact CG2-CB 3.89Å; C959-L982 HydrophobicContact CB-CD2 3.63Å; L963-L982 HydrophobicContact CD1-CD1 3.5Å; L963-L982 VanDerWaalsContact CD1-CD1 3.5Å; L963-L982 HydrophobicContact CD1-CD2 4.03Å; L963-L982 HydrophobicContact CD1-CG 4.26Å; L963-L982 HydrophobicContact CD2-CD1 4.12Å; L963-L982 HydrophobicContact CG-CD1 4.34Å; L963-L982 HydrophobicContact CG-CD2 4.49Å; M978-L982 PolarHBondContact O-N 3.05Å; V979-L982 HydrophobicContact CG1-CD1 4.4Å; V979-L982 VanDerWaalsContact O-CB 3.32Å; V979-L982 WeakPolarHBondContact O-CB 3.34Å; V979-L982 PolarHBondContact O-N 2.9Å; V979-L982 VanDerWaalsContact O-N 3.14Å; L980-L982 VanDerWaalsContact C-N 3.26Å; L980-L982 PolarHBondContact O-N 3.49Å; L982-F984 VanDerWaalsContact C-N 3.27Å; L982-F984 PolarHBondContact O-N 3.37Å; L982-I985 HydrophobicContact CD2-CD1 4.47Å; L982-I985 PolarHBondContact O-N 2.98Å; L982-R986 VanDerWaalsContact O-CB 3.27Å; L982-R986 WeakPolarHBondContact O-CB 3.24Å; L982-R986 PolarHBondContact O-N 3.24Å
983	V	79.7	Confident	78.8	Confident	34 Å²	34	58.7 Å²	58.7	21%	0.206	30%	0.304	C	S	.	.	H	α-helix	trans	-64.2	-38.5	174.3	-178.3	0	0	0	0	110	Y584 T589 V979 L980 A981 R986 K987	Y584-V983 WeakPolarHBondContact O-CG1 3.19Å; T589-V983 HydrophobicContact CG2-CG2 3.97Å; V979-V983 PolarHBondContact O-N 3.32Å; L980-V983 WeakPolarHBondContact O-CB 3.44Å; L980-V983 PolarHBondContact O-N 3.07Å; L980-V983 VanDerWaalsContact O-N 3.12Å; A981-V983 VanDerWaalsContact C-N 3.3Å; A981-V983 PolarHBondContact O-N 3.36Å; V983-R986 WeakPolarHBondContact O-CB 3.29Å; V983-R986 PolarHBondContact O-N 3.17Å; V983-K987 PolarHBondContact O-N 3.35Å
984	F	83.4	Confident	79	Confident	142 Å²	142	60.9 Å²	60.9	62%	0.623	32%	0.318	S	S	*	.	H	α-helix	trans	-68.3	-45.6	175.3	-172	-94.8	0	0	0	112.4	L980 A981 L982 R986 K987 L988	L980-F984 PolarHBondContact O-N 3.06Å; A981-F984 WeakPolarHBondContact O-CB 3.41Å; A981-F984 PolarHBondContact O-N 3.46Å; A981-F984 VanDerWaalsContact O-N 3.13Å; L982-F984 VanDerWaalsContact C-N 3.27Å; L982-F984 PolarHBondContact O-N 3.37Å; F984-R986 PolarHBondContact O-N 3.08Å; F984-K987 CarbonylContact O-C 3.55Å; F984-K987 WeakPolarHBondContact O-CA 3.42Å; F984-K987 WeakPolarHBondContact O-CB 3.4Å; F984-K987 PolarHBondContact O-N 3.25Å; F984-L988 PolarHBondContact O-N 3.25Å
985	I	84.3	Confident	78.6	Confident	52 Å²	52	66.1 Å²	66.1	27%	0.267	33%	0.334	S	S	.	.	H	α-helix	trans	-57.8	-40.1	173.8	-68	166	0	0	0	110	A981 L982 K987 L988 L989	A981-I985 WeakPolarHBondContact O-CG1 3.49Å; A981-I985 PolarHBondContact O-N 3Å; L982-I985 HydrophobicContact CD2-CD1 4.47Å; L982-I985 PolarHBondContact O-N 2.98Å; I985-K987 VanDerWaalsContact C-N 3.34Å; I985-K987 PolarHBondContact O-N 3.34Å; I985-L988 VanDerWaalsContact O-CB 3.3Å; I985-L988 WeakPolarHBondContact O-CB 3.5Å; I985-L988 PolarHBondContact O-N 3.15Å; I985-L988 VanDerWaalsContact O-N 3.16Å; I985-L989 PolarHBondContact O-N 2.95Å
986	R	83.4	Confident	78.4	Confident	23 Å²	23	73.9 Å²	73.9	9%	0.087	36%	0.363	C	S	.	.	H	α-helix	trans	-63.1	-40.5	175.3	177.4	56.4	-171.9	71	6.9	112.2	T586 F588 T589 L982 V983 F984 L988 L989 D990 D1002	T586-R986 HydrophobicContact CG2-CG 4.42Å; T586-R986 WeakPolarHBondContact OG1-CG 3.34Å; F588-R986 HydrophobicContact CB-CG 4.36Å; F588-R986 HydrophobicContact CD1-CB 3.91Å; F588-R986 HydrophobicContact CD1-CG 4.21Å; F588-R986 HydrophobicContact CE1-CB 4.34Å; T589-R986 HydrophobicContact CG2-CB 4.37Å; L982-R986 VanDerWaalsContact O-CB 3.27Å; L982-R986 WeakPolarHBondContact O-CB 3.24Å; L982-R986 PolarHBondContact O-N 3.24Å; V983-R986 WeakPolarHBondContact O-CB 3.29Å; V983-R986 PolarHBondContact O-N 3.17Å; F984-R986 PolarHBondContact O-N 3.08Å; R986-L988 VanDerWaalsContact C-N 3.29Å; R986-L988 PolarHBondContact O-N 2.8Å; R986-L989 WeakPolarHBondContact O-CB 3.37Å; R986-L989 PolarHBondContact O-N 2.95Å; R986-D990 IonicContact CZ-OD1 3.53Å; R986-D990 IonicContact NH1-OD1 3.87Å; R986-D990 PolarHBondContact NH1-OD1 3.3Å; R986-D1002 IonicContact CZ-OD2 3.32Å; R986-D1002 IonicContact NE-OD2 3Å; R986-D1002 PolarHBondContact NE-OD2 3.39Å; R986-D1002 IonicContact NH2-OD2 3.74Å; R986-D1002 PolarHBondContact NH2-OD2 3.14Å
987	K	79.7	Confident	78.6	Confident	140 Å²	140	74.8 Å²	74.8	61%	0.609	37%	0.367	S	S	*	.	H	α-helix	trans	-68	-30.9	174.4	-165.2	159.3	-177	171.3	0	112.3	V983 F984 I985 L989 D990	V983-K987 PolarHBondContact O-N 3.35Å; F984-K987 CarbonylContact O-C 3.55Å; F984-K987 WeakPolarHBondContact O-CA 3.42Å; F984-K987 WeakPolarHBondContact O-CB 3.4Å; F984-K987 PolarHBondContact O-N 3.25Å; I985-K987 VanDerWaalsContact C-N 3.34Å; I985-K987 PolarHBondContact O-N 3.34Å; K987-L989 VanDerWaalsContact C-N 3.29Å; K987-L989 PolarHBondContact O-N 3.3Å; K987-D990 VanDerWaalsContact O-CB 3.31Å; K987-D990 WeakPolarHBondContact O-CB 3.3Å; K987-D990 PolarHBondContact O-N 3.43Å
988	L	82.8	Confident	78.2	Confident	91 Å²	91	70.8 Å²	70.8	48%	0.476	35%	0.347	S	S	.	.	H	α-helix	trans	-66.1	-31.7	172.8	-158.1	83.3	0	0	0	112.1	F984 I985 R986 D990 L991	F984-L988 PolarHBondContact O-N 3.25Å; I985-L988 VanDerWaalsContact O-CB 3.3Å; I985-L988 WeakPolarHBondContact O-CB 3.5Å; I985-L988 PolarHBondContact O-N 3.15Å; I985-L988 VanDerWaalsContact O-N 3.16Å; R986-L988 VanDerWaalsContact C-N 3.29Å; R986-L988 PolarHBondContact O-N 2.8Å; L988-D990 PolarHBondContact O-N 2.91Å; L988-L991 HydrophobicContact CD1-CD1 4.03Å; L988-L991 HydrophobicContact CG-CD1 4.3Å; L988-L991 WeakPolarHBondContact O-CB 3.4Å; L988-L991 PolarHBondContact O-N 3.04Å
989	L	81.1	Confident	77.8	Confident	5 Å²	5	71.4 Å²	71.4	3%	0.026	35%	0.354	C	S	.	.	G	3₁₀ helix	trans	-63.6	-17.6	175	-76.5	166.5	0	0	0	113.4	F588 F952 V955 I985 R986 K987 L991 L992 F993	F588-L989 HydrophobicContact CE2-CD1 4.14Å; F588-L989 HydrophobicContact CZ-CD1 4.1Å; F952-L989 HydrophobicContact CE2-CD1 4.49Å; V955-L989 HydrophobicContact CG1-CD1 4.18Å; V955-L989 HydrophobicContact CG1-CD2 4.23Å; V955-L989 HydrophobicContact CG2-CD2 4.48Å; I985-L989 PolarHBondContact O-N 2.95Å; R986-L989 WeakPolarHBondContact O-CB 3.37Å; R986-L989 PolarHBondContact O-N 2.95Å; K987-L989 VanDerWaalsContact C-N 3.29Å; K987-L989 PolarHBondContact O-N 3.3Å; L989-L991 PolarHBondContact O-N 3.25Å; L989-L992 HydrophobicContact CD2-CD1 4.24Å; L989-L992 PolarHBondContact O-N 3.45Å; L989-L992 VanDerWaalsContact O-N 3.16Å; L989-F993 HydrophobicContact CD2-CD2 4.03Å; L989-F993 HydrophobicContact CD2-CE2 3.79Å; L989-F993 PolarHBondContact O-N 2.86Å; L989-F993 VanDerWaalsContact O-N 3.14Å
990	D	77	Confident	77.4	Confident	80 Å²	80	72.8 Å²	72.8	43%	0.428	36%	0.358	S	S	.	.	G	3₁₀ helix	trans	-65.2	-15.2	172.2	-62.4	-17.7	0	0	0	112.4	R986 K987 L988 L998	R986-D990 IonicContact CZ-OD1 3.53Å; R986-D990 IonicContact NH1-OD1 3.87Å; R986-D990 PolarHBondContact NH1-OD1 3.3Å; K987-D990 VanDerWaalsContact O-CB 3.31Å; K987-D990 WeakPolarHBondContact O-CB 3.3Å; K987-D990 PolarHBondContact O-N 3.43Å; L988-D990 PolarHBondContact O-N 2.91Å; D990-L998 WeakPolarHBondContact OD1-CD2 3.47Å
991	L	78.8	Confident	77.2	Confident	146 Å²	146	69.2 Å²	69.2	76%	0.764	34%	0.34	S	S	*	.	G	3₁₀ helix	trans	-82	-27.3	174.7	-62	172.5	0	0	0	113.1	L988 L989	L988-L991 HydrophobicContact CD1-CD1 4.03Å; L988-L991 HydrophobicContact CG-CD1 4.3Å; L988-L991 WeakPolarHBondContact O-CB 3.4Å; L988-L991 PolarHBondContact O-N 3.04Å; L989-L991 PolarHBondContact O-N 3.25Å
992	L	78	Confident	76.5	Confident	137 Å²	137	67.6 Å²	67.6	72%	0.717	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.7	-27.4	-174.6	-75	159.5	0	0	0	112.6	L989	L989-L992 HydrophobicContact CD2-CD1 4.24Å; L989-L992 PolarHBondContact O-N 3.45Å; L989-L992 VanDerWaalsContact O-N 3.16Å
993	F	79	Confident	75.4	Confident	18 Å²	18	70.7 Å²	70.7	8%	0.079	34%	0.341	C	S	.	.	S	Bend	trans	-118.2	146.9	-174.8	-70.5	-91.8	0	0	0	111.8	K948 V951 F952 L989 L998	K948-F993 HydrophobicContact CB-CE1 4.09Å; K948-F993 HydrophobicContact CG-CE1 4.5Å; V951-F993 HydrophobicContact CG1-CZ 4.16Å; F952-F993 HydrophobicContact CB-CE1 4.47Å; F952-F993 HydrophobicContact CB-CZ 4.06Å; L989-F993 HydrophobicContact CD2-CD2 4.03Å; L989-F993 HydrophobicContact CD2-CE2 3.79Å; L989-F993 PolarHBondContact O-N 2.86Å; L989-F993 VanDerWaalsContact O-N 3.14Å; F993-L998 HydrophobicContact CB-CD1 3.87Å; F993-L998 HydrophobicContact CD2-CD1 4.41Å; F993-L998 HydrophobicContact CG-CD1 4.1Å
994	T	75.6	Confident	74.1	Confident	78 Å²	78	72.5 Å²	72.5	48%	0.479	35%	0.35	S	S	.	.			trans	-70.8	145.9	172.3	58.9	0	0	0	0	110.6	R996 E997 L998	T994-R996 PolarHBondContact O-N 3.17Å; T994-E997 PolarHBondContact N-OE2 3.43Å; T994-E997 PolarHBondContact O-N 3.4Å; T994-E997 VanDerWaalsContact OG1-CD 3.24Å; T994-E997 WeakPolarHBondContact OG1-CG 3.26Å; T994-E997 PolarHBondContact OG1-N 2.61Å; T994-E997 PolarHBondContact OG1-OE2 3.38Å; T994-L998 PolarHBondContact O-N 3.11Å; T994-L998 VanDerWaalsContact O-N 3.11Å
995	K	69.9	Low	71.8	Confident	190 Å²	190	69.1 Å²	69.1	83%	0.826	34%	0.337	S	S	*	.	H	α-helix	trans	-52.4	-31.3	178.5	-69	-175	179.2	-179.2	0	113.1	S999	K995-S999 PolarHBondContact O-N 3.3Å; K995-S999 VanDerWaalsContact O-N 3.12Å
996	R	69.9	Low	69.7	Low	170 Å²	170	68.2 Å²	68.2	64%	0.642	33%	0.334	S	S	*	.	H	α-helix	trans	-71	-48.6	176.4	-178.6	176.9	166.8	158.9	-1.2	112.3	T994 L998 S999 W1000	T994-R996 PolarHBondContact O-N 3.17Å; R996-L998 PolarHBondContact O-N 2.95Å; R996-S999 PolarHBondContact O-N 2.87Å; R996-S999 PolarHBondContact O-OG 3.47Å; R996-W1000 PolarHBondContact O-N 3.43Å
997	E	74.5	Confident	67.6	Low	24 Å²	24	72.4 Å²	72.4	11%	0.112	36%	0.355	C	S	.	.	H	α-helix	trans	-62.2	-36.8	179	-71.5	170.2	152	0	0	111.5	V944 K948 T994 W1000 L1001	V944-E997 HydrophobicContact CG2-CB 4.27Å; V944-E997 HydrophobicContact CG2-CG 4.34Å; K948-E997 WeakPolarHBondContact CD-OE1 3.15Å; K948-E997 WeakPolarHBondContact CE-OE1 3.38Å; K948-E997 IonicContact NZ-OE1 3.89Å; K948-E997 PolarHBondContact NZ-OE1 3.4Å; K948-E997 IonicContact NZ-OE2 2.7Å; K948-E997 PolarHBondContact NZ-OE2 3.47Å; T994-E997 PolarHBondContact N-OE2 3.43Å; T994-E997 PolarHBondContact O-N 3.4Å; T994-E997 VanDerWaalsContact OG1-CD 3.24Å; T994-E997 WeakPolarHBondContact OG1-CG 3.26Å; T994-E997 PolarHBondContact OG1-N 2.61Å; T994-E997 PolarHBondContact OG1-OE2 3.38Å; E997-W1000 WeakPolarHBondContact O-CB 3.39Å; E997-W1000 PolarHBondContact O-N 2.94Å; E997-L1001 PolarHBondContact O-N 3.07Å
998	L	72.5	Confident	65.6	Low	6 Å²	6	69.6 Å²	69.6	3%	0.031	35%	0.353	C	S	.	.	H	α-helix	trans	-73.9	-32.1	-178.4	-146.4	64.6	0	0	0	112.4	F952 D990 F993 T994 R996 W1000 L1001 D1002	F952-L998 HydrophobicContact CD2-CD1 4.2Å; F952-L998 HydrophobicContact CE2-CD1 3.86Å; D990-L998 WeakPolarHBondContact OD1-CD2 3.47Å; F993-L998 HydrophobicContact CB-CD1 3.87Å; F993-L998 HydrophobicContact CD2-CD1 4.41Å; F993-L998 HydrophobicContact CG-CD1 4.1Å; T994-L998 PolarHBondContact O-N 3.11Å; T994-L998 VanDerWaalsContact O-N 3.11Å; R996-L998 PolarHBondContact O-N 2.95Å; L998-W1000 VanDerWaalsContact C-N 3.31Å; L998-W1000 PolarHBondContact O-N 3.27Å; L998-L1001 PolarHBondContact O-N 2.92Å; L998-D1002 WeakPolarHBondContact O-CB 3.39Å; L998-D1002 PolarHBondContact O-N 3.45Å
999	S	68.1	Low	63.6	Low	35 Å²	35	71.6 Å²	71.6	25%	0.245	36%	0.358	C	S	.	.	H	α-helix	trans	-67	-31.4	170.5	70.9	0	0	0	0	112.3	K995 R996 L1001 D1003 K1010	K995-S999 PolarHBondContact O-N 3.3Å; K995-S999 VanDerWaalsContact O-N 3.12Å; R996-S999 PolarHBondContact O-N 2.87Å; R996-S999 PolarHBondContact O-OG 3.47Å; S999-L1001 VanDerWaalsContact C-N 3.34Å; S999-D1003 WeakPolarHBondContact CB-OD2 3.41Å; S999-D1003 VanDerWaalsContact O-CB 3.25Å; S999-D1003 WeakPolarHBondContact O-CB 3.2Å; S999-D1003 PolarHBondContact O-N 3.43Å; S999-K1010 PolarHBondContact O-NZ 3.42Å
1000	W	68.6	Low	62.1	Low	33 Å²	33	72.5 Å²	72.5	13%	0.125	36%	0.362	C	S	.	.	H	α-helix	trans	-67.5	-34.6	172.1	-70.4	107.4	0	0	0	112.9	I939 Y943 V944 R996 E997 L998 D1014	I939-W1000 HydrophobicContact CG2-CE3 4.35Å; I939-W1000 HydrophobicContact CG2-CZ3 3.81Å; Y943-W1000 AromaticContact CD1-CZ2 3.99Å; Y943-W1000 HydrophobicContact CD1-CZ2 3.99Å; Y943-W1000 AromaticContact CD2-CD2 3.9Å; Y943-W1000 HydrophobicContact CD2-CD2 3.9Å; Y943-W1000 AromaticContact CD2-CE2 3.88Å; Y943-W1000 AromaticContact CD2-CE3 3.71Å; Y943-W1000 HydrophobicContact CD2-CE3 3.71Å; Y943-W1000 AromaticContact CD2-CH2 3.63Å; Y943-W1000 HydrophobicContact CD2-CH2 3.63Å; Y943-W1000 AromaticContact CD2-CZ2 3.78Å; Y943-W1000 HydrophobicContact CD2-CZ2 3.78Å; Y943-W1000 AromaticContact CD2-CZ3 3.58Å; Y943-W1000 HydrophobicContact CD2-CZ3 3.58Å; Y943-W1000 HydrophobicContact CE1-CH2 4.39Å; Y943-W1000 HydrophobicContact CE1-CZ2 4.12Å; Y943-W1000 HydrophobicContact CE2-CE3 4.3Å; Y943-W1000 AromaticContact CE2-CH2 3.52Å; Y943-W1000 HydrophobicContact CE2-CH2 3.52Å; Y943-W1000 AromaticContact CE2-CZ2 3.96Å; Y943-W1000 HydrophobicContact CE2-CZ2 3.96Å; Y943-W1000 AromaticContact CE2-CZ3 3.68Å; Y943-W1000 HydrophobicContact CE2-CZ3 3.68Å; Y943-W1000 HydrophobicContact CG-CD2 4.01Å; Y943-W1000 AromaticContact CG-CE2 3.7Å; Y943-W1000 HydrophobicContact CG-CE3 4.31Å; Y943-W1000 HydrophobicContact CG-CH2 4.16Å; Y943-W1000 AromaticContact CG-CZ2 3.81Å; Y943-W1000 HydrophobicContact CG-CZ2 3.81Å; Y943-W1000 HydrophobicContact CG-CZ3 4.37Å; Y943-W1000 AromaticContact CZ-CH2 3.91Å; V944-W1000 HydrophobicContact CG2-CB 3.85Å; V944-W1000 HydrophobicContact CG2-CG 4.35Å; R996-W1000 PolarHBondContact O-N 3.43Å; E997-W1000 WeakPolarHBondContact O-CB 3.39Å; E997-W1000 PolarHBondContact O-N 2.94Å; L998-W1000 VanDerWaalsContact C-N 3.31Å; L998-W1000 PolarHBondContact O-N 3.27Å; W1000-D1014 WeakPolarHBondContact CH2-OD1 3.5Å; W1000-D1014 WeakPolarHBondContact CH2-OD2 3.44Å
1001	L	72.9	Confident	60.5	Low	1 Å²	1	74.1 Å²	74.1	1%	0.005	37%	0.365	C	S	.	.	H	α-helix	trans	-86.7	-25.9	-178	-67.3	169	0	0	0	113.7	R924 V949 F952 E997 L998 S999	R924-L1001 PolarHBondContact NH2-O 3.24Å; V949-L1001 HydrophobicContact CG1-CD2 4.48Å; V949-L1001 HydrophobicContact CG2-CD2 4.37Å; F952-L1001 HydrophobicContact CB-CD1 4.13Å; F952-L1001 HydrophobicContact CD1-CD1 4.45Å; F952-L1001 HydrophobicContact CD2-CD1 3.86Å; F952-L1001 HydrophobicContact CE2-CB 4.32Å; F952-L1001 HydrophobicContact CE2-CD1 4.35Å; F952-L1001 HydrophobicContact CG-CD1 3.89Å; F952-L1001 HydrophobicContact CZ-CB 4.23Å; E997-L1001 PolarHBondContact O-N 3.07Å; L998-L1001 PolarHBondContact O-N 2.92Å; S999-L1001 VanDerWaalsContact C-N 3.34Å
1002	D	67.9	Low	58.8	Low	10 Å²	10	69.9 Å²	69.9	5%	0.053	35%	0.345	C	S	.	.	H	α-helix	trans	-125	-17.3	-171.5	-70.5	-44	0	0	0	117.3	R587 F588 R986 L998 L1004	R587-D1002 WeakPolarHBondContact CB-O 3.28Å; F588-D1002 WeakPolarHBondContact CB-OD1 3.23Å; F588-D1002 PolarHBondContact N-OD1 2.82Å; R986-D1002 IonicContact CZ-OD2 3.32Å; R986-D1002 IonicContact NE-OD2 3Å; R986-D1002 PolarHBondContact NE-OD2 3.39Å; R986-D1002 IonicContact NH2-OD2 3.74Å; R986-D1002 PolarHBondContact NH2-OD2 3.14Å; L998-D1002 WeakPolarHBondContact O-CB 3.39Å; L998-D1002 PolarHBondContact O-N 3.45Å; D1002-L1004 PolarHBondContact O-N 3.25Å
1003	D	57.1	Low	57.2	Low	69 Å²	69	67 Å²	67	37%	0.369	33%	0.328	S	S	.	.			trans	-73.4	135	-170.1	-105	-26.2	0	0	0	115.3	S999 M1005 K1010	S999-D1003 WeakPolarHBondContact CB-OD2 3.41Å; S999-D1003 VanDerWaalsContact O-CB 3.25Å; S999-D1003 WeakPolarHBondContact O-CB 3.2Å; S999-D1003 PolarHBondContact O-N 3.43Å; D1003-M1005 PolarHBondContact O-N 3.3Å; D1003-K1010 PolarHBondContact O-NZ 3.02Å; D1003-K1010 VanDerWaalsContact O-NZ 3.16Å
1004	L	51.3	Low	55.7	Low	72 Å²	72	67.1 Å²	67.1	38%	0.377	33%	0.329	S	S	.	.			trans	-72.7	59.6	166.9	-81.9	152.9	0	0	0	112.3	K808 D1002	K808-L1004 PolarHBondContact NZ-O 2.86Å; D1002-L1004 PolarHBondContact O-N 3.25Å
1005	M	36.3	Very low	54.5	Low	72 Å²	72	66.6 Å²	66.6	36%	0.355	32%	0.324	S	S	.	.			trans	-116.9	134.7	164.4	-83.9	-157.3	-77.8	0	0	110.7	D1003 E1007 K1010	D1003-M1005 PolarHBondContact O-N 3.3Å; M1005-E1007 PolarHBondContact O-N 3.19Å; M1005-K1010 HydrophobicContact CB-CD 3.66Å; M1005-K1010 HydrophobicContact CB-CG 3.76Å; M1005-K1010 HydrophobicContact CE-CD 4.37Å; M1005-K1010 HydrophobicContact CE-CG 3.83Å; M1005-K1010 HydrophobicContact SD-CG 4.32Å
1006	P	39.1	Very low	53.7	Low	33 Å²	33	63 Å²	63	21%	0.214	31%	0.308	C	S	.	.			trans	-59.3	129.9	176.7	24	-30.6	0	0	0	109.5	S1008 K1009 K1010	P1006-S1008 PolarHBondContact O-N 2.96Å; P1006-K1009 HydrophobicContact CG-CB 4.12Å; P1006-K1009 HydrophobicContact CG-CD 3.95Å; P1006-K1009 HydrophobicContact CG-CG 3.95Å; P1006-K1009 PolarHBondContact O-N 3.31Å; P1006-K1010 PolarHBondContact O-N 3.38Å
1007	E	40	Very low	53	Low	110 Å²	110	61.8 Å²	61.8	51%	0.514	31%	0.307	S	S	.	.	H	α-helix	trans	-48.7	-31.5	-177.9	-65.5	177.1	163.1	0	0	112.9	I939 M1005 K1011	I939-E1007 HydrophobicContact CD1-CB 4Å; I939-E1007 HydrophobicContact CD1-CG 4.31Å; M1005-E1007 PolarHBondContact O-N 3.19Å; E1007-K1011 WeakPolarHBondContact O-CB 3.43Å; E1007-K1011 PolarHBondContact O-N 2.98Å; E1007-K1011 VanDerWaalsContact O-N 3.11Å
1008	S	36.7	Very low	51.8	Low	82 Å²	82	65 Å²	65	57%	0.573	32%	0.321	S	S	*	.	H	α-helix	trans	-68.4	-35.5	177.2	63	0	0	0	0	114.2	P1006 T1012	P1006-S1008 PolarHBondContact O-N 2.96Å; S1008-T1012 PolarHBondContact O-N 2.93Å; S1008-T1012 PolarHBondContact O-OG1 2.96Å
1009	K	40.3	Very low	50.7	Low	133 Å²	133	70.9 Å²	70.9	58%	0.578	35%	0.346	S	S	*	.	H	α-helix	trans	-79.8	-40.7	179.4	-71.5	-170.1	177.7	-171.2	0	111.5	P1006 K1011 T1012 E1013	P1006-K1009 HydrophobicContact CG-CB 4.12Å; P1006-K1009 HydrophobicContact CG-CD 3.95Å; P1006-K1009 HydrophobicContact CG-CG 3.95Å; P1006-K1009 PolarHBondContact O-N 3.31Å; K1009-K1011 PolarHBondContact O-N 2.84Å; K1009-T1012 WeakPolarHBondContact O-CB 3.29Å; K1009-T1012 PolarHBondContact O-N 3.24Å; K1009-T1012 VanDerWaalsContact O-N 3.08Å; K1009-E1013 PolarHBondContact O-N 2.75Å
1010	K	49.8	Very low	50.1	Low	24 Å²	24	71.6 Å²	71.6	10%	0.104	35%	0.354	C	S	.	.	H	α-helix	trans	-56.3	-48.9	172.7	-86.8	171.4	157.2	173.9	0	111.3	S999 D1003 M1005 P1006 T1012 E1013 D1014	S999-K1010 PolarHBondContact O-NZ 3.42Å; D1003-K1010 PolarHBondContact O-NZ 3.02Å; D1003-K1010 VanDerWaalsContact O-NZ 3.16Å; M1005-K1010 HydrophobicContact CB-CD 3.66Å; M1005-K1010 HydrophobicContact CB-CG 3.76Å; M1005-K1010 HydrophobicContact CE-CD 4.37Å; M1005-K1010 HydrophobicContact CE-CG 3.83Å; M1005-K1010 HydrophobicContact SD-CG 4.32Å; P1006-K1010 PolarHBondContact O-N 3.38Å; K1010-T1012 VanDerWaalsContact C-N 3.29Å; K1010-T1012 PolarHBondContact O-N 3.5Å; K1010-E1013 PolarHBondContact O-N 3.17Å; K1010-D1014 VanDerWaalsContact O-CG 3.28Å; K1010-D1014 PolarHBondContact O-N 2.9Å; K1010-D1014 VanDerWaalsContact O-OD2 3.14Å
1011	K	44.8	Very low	49.4	Very low	114 Å²	114	75.6 Å²	75.6	50%	0.496	37%	0.374	S	S	.	.	H	α-helix	trans	-58.4	-39.2	174.2	-169	176.6	-178.5	-179.8	0	112.9	E1007 K1009 D1014 D1015	E1007-K1011 WeakPolarHBondContact O-CB 3.43Å; E1007-K1011 PolarHBondContact O-N 2.98Å; E1007-K1011 VanDerWaalsContact O-N 3.11Å; K1009-K1011 PolarHBondContact O-N 2.84Å; K1011-D1014 PolarHBondContact O-N 2.71Å; K1011-D1015 WeakPolarHBondContact O-CB 3.41Å; K1011-D1015 VanDerWaalsContact O-CG 3.23Å; K1011-D1015 PolarHBondContact O-N 2.88Å
1012	T	42.1	Very low	48.6	Very low	57 Å²	57	80.7 Å²	80.7	35%	0.35	40%	0.398	S	S	.	.	H	α-helix	trans	-70.7	-32.8	-179.8	-51.2	0	0	0	0	112.7	S1008 K1009 K1010 K1016	S1008-T1012 PolarHBondContact O-N 2.93Å; S1008-T1012 PolarHBondContact O-OG1 2.96Å; K1009-T1012 WeakPolarHBondContact O-CB 3.29Å; K1009-T1012 PolarHBondContact O-N 3.24Å; K1009-T1012 VanDerWaalsContact O-N 3.08Å; K1010-T1012 VanDerWaalsContact C-N 3.29Å; K1010-T1012 PolarHBondContact O-N 3.5Å; T1012-K1016 WeakPolarHBondContact O-CG 3.38Å; T1012-K1016 PolarHBondContact O-N 3.25Å
1013	E	44.8	Very low	48.2	Very low	76 Å²	76	86.6 Å²	86.6	36%	0.355	42%	0.423	S	S	.	.	H	α-helix	trans	-77.6	-36.1	174.5	-77.2	178.9	-163.8	0	0	112.4	K1009 K1010 K1016 K1017	K1009-E1013 PolarHBondContact O-N 2.75Å; K1010-E1013 PolarHBondContact O-N 3.17Å; E1013-K1016 WeakPolarHBondContact O-CB 3.42Å; E1013-K1016 PolarHBondContact O-N 3.4Å; E1013-K1016 VanDerWaalsContact O-N 3.15Å; E1013-K1017 PolarHBondContact O-N 3.35Å
1014	D	48.5	Very low	48.3	Very low	21 Å²	21	88.7 Å²	88.7	11%	0.112	43%	0.434	C	S	.	.	H	α-helix	trans	-65.7	-43.8	173.7	-70.2	-37.3	0	0	0	112.1	Y943 W1000 K1010 K1011 K1016 K1017 K1018	Y943-D1014 WeakPolarHBondContact OH-CB 3.41Å; Y943-D1014 VanDerWaalsContact OH-CG 3.22Å; Y943-D1014 PolarHBondContact OH-OD2 2.91Å; W1000-D1014 WeakPolarHBondContact CH2-OD1 3.5Å; W1000-D1014 WeakPolarHBondContact CH2-OD2 3.44Å; K1010-D1014 VanDerWaalsContact O-CG 3.28Å; K1010-D1014 PolarHBondContact O-N 2.9Å; K1010-D1014 VanDerWaalsContact O-OD2 3.14Å; K1011-D1014 PolarHBondContact O-N 2.71Å; D1014-K1016 PolarHBondContact O-N 2.93Å; D1014-K1017 PolarHBondContact O-N 3.43Å; D1014-K1017 VanDerWaalsContact O-N 3.12Å; D1014-K1018 WeakPolarHBondContact O-CB 3.45Å; D1014-K1018 PolarHBondContact O-N 3.2Å
1015	D	49.7	Very low	48.8	Very low	67 Å²	67	90.4 Å²	90.4	36%	0.358	44%	0.44	S	S	.	.	H	α-helix	trans	-63.3	-22.1	174.5	-71.1	-13.6	0	0	0	111.4	K1011 K1019	K1011-D1015 WeakPolarHBondContact O-CB 3.41Å; K1011-D1015 VanDerWaalsContact O-CG 3.23Å; K1011-D1015 PolarHBondContact O-N 2.88Å; D1015-K1019 WeakPolarHBondContact O-CB 3.37Å; D1015-K1019 WeakPolarHBondContact O-CD 3.32Å; D1015-K1019 WeakPolarHBondContact O-CG 3.33Å
1016	K	52.2	Low	49.8	Very low	115 Å²	115	93.1 Å²	93.1	50%	0.5	45%	0.452	S	S	.	.	H	α-helix	trans	-79.9	-45.2	170.5	-73	174.9	178.9	-175.9	0	111.7	K412 T1012 E1013 D1014 K1019 A1020	K412-K1016 VanDerWaalsContact CE-CE 3.5Å; T1012-K1016 WeakPolarHBondContact O-CG 3.38Å; T1012-K1016 PolarHBondContact O-N 3.25Å; E1013-K1016 WeakPolarHBondContact O-CB 3.42Å; E1013-K1016 PolarHBondContact O-N 3.4Å; E1013-K1016 VanDerWaalsContact O-N 3.15Å; D1014-K1016 PolarHBondContact O-N 2.93Å; K1016-K1019 PolarHBondContact O-N 3.5Å; K1016-A1020 WeakPolarHBondContact O-CB 3.34Å; K1016-A1020 PolarHBondContact O-N 2.85Å
1017	K	55.2	Low	51	Low	144 Å²	144	97 Å²	97	63%	0.626	47%	0.467	S	S	*	.	H	α-helix	trans	-68.5	-41.7	-178	-76.4	-179	178.9	173.6	0	112.4	E1013 D1014 A1020 Q1021	E1013-K1017 PolarHBondContact O-N 3.35Å; D1014-K1017 PolarHBondContact O-N 3.43Å; D1014-K1017 VanDerWaalsContact O-N 3.12Å; K1017-A1020 PolarHBondContact O-N 2.92Å; K1017-Q1021 WeakPolarHBondContact O-CB 3.42Å; K1017-Q1021 PolarHBondContact O-N 2.92Å
1018	K	50.4	Low	52	Low	91 Å²	91	94.1 Å²	94.1	40%	0.396	46%	0.459	S	S	.	.	H	α-helix	trans	-60.5	-48.4	173.1	-81.8	-168.2	167.5	-154.1	0	111.6	D1014 A1020 Q1021 E1022	D1014-K1018 WeakPolarHBondContact O-CB 3.45Å; D1014-K1018 PolarHBondContact O-N 3.2Å; K1018-A1020 VanDerWaalsContact C-N 3.26Å; K1018-A1020 PolarHBondContact O-N 3.45Å; K1018-Q1021 PolarHBondContact O-N 3.33Å; K1018-Q1021 VanDerWaalsContact O-N 3.11Å; K1018-E1022 WeakPolarHBondContact O-CB 3.32Å; K1018-E1022 WeakPolarHBondContact O-CG 3.5Å; K1018-E1022 PolarHBondContact O-N 3.36Å
1019	K	50	Low	53	Low	130 Å²	130	97.7 Å²	97.7	57%	0.565	46%	0.46	S	S	*	.	H	α-helix	trans	-62.6	-32.1	176.1	-73.1	-176.2	-178	-154.4	0	113.3	D1015 K1016 K1023	D1015-K1019 WeakPolarHBondContact O-CB 3.37Å; D1015-K1019 WeakPolarHBondContact O-CD 3.32Å; D1015-K1019 WeakPolarHBondContact O-CG 3.33Å; K1016-K1019 PolarHBondContact O-N 3.5Å; K1019-K1023 WeakPolarHBondContact O-CB 3.35Å; K1019-K1023 WeakPolarHBondContact O-CG 3.47Å; K1019-K1023 PolarHBondContact O-N 3.3Å
1020	A	55.4	Low	54.2	Low	50 Å²	50	96.2 Å²	96.2	41%	0.413	46%	0.458	S	S	.	.	H	α-helix	trans	-72.4	-38.4	174.3	0	0	0	0	0	111.7	K1016 K1017 K1018 L1024	K1016-A1020 WeakPolarHBondContact O-CB 3.34Å; K1016-A1020 PolarHBondContact O-N 2.85Å; K1017-A1020 PolarHBondContact O-N 2.92Å; K1018-A1020 VanDerWaalsContact C-N 3.26Å; K1018-A1020 PolarHBondContact O-N 3.45Å; A1020-L1024 WeakPolarHBondContact O-CB 3.48Å; A1020-L1024 PolarHBondContact O-N 3.46Å
1021	Q	52.5	Low	54.8	Low	117 Å²	117	101.7 Å²	101.7	55%	0.547	48%	0.484	S	S	.	.	H	α-helix	trans	-73	-40.7	179	-167.1	169.9	-15.6	0	0	112.1	K1017 K1018 K1023 L1024 E1025	K1017-Q1021 WeakPolarHBondContact O-CB 3.42Å; K1017-Q1021 PolarHBondContact O-N 2.92Å; K1018-Q1021 PolarHBondContact O-N 3.33Å; K1018-Q1021 VanDerWaalsContact O-N 3.11Å; Q1021-K1023 VanDerWaalsContact C-N 3.31Å; Q1021-K1023 PolarHBondContact O-N 3.13Å; Q1021-L1024 PolarHBondContact O-N 3.2Å; Q1021-E1025 WeakPolarHBondContact O-CB 3.24Å; Q1021-E1025 WeakPolarHBondContact O-CG 3.35Å; Q1021-E1025 PolarHBondContact O-N 2.95Å
1022	E	57.1	Low	55.7	Low	108 Å²	108	102.3 Å²	102.3	51%	0.505	49%	0.489	S	S	.	.	H	α-helix	trans	-60.9	-40.3	171.8	-74.2	164.2	-176.8	0	0	111.1	K1018 E1025 E1026	K1018-E1022 WeakPolarHBondContact O-CB 3.32Å; K1018-E1022 WeakPolarHBondContact O-CG 3.5Å; K1018-E1022 PolarHBondContact O-N 3.36Å; E1022-E1025 PolarHBondContact O-N 3.47Å; E1022-E1026 WeakPolarHBondContact O-CB 3.31Å; E1022-E1026 PolarHBondContact O-N 3.06Å
1023	K	58.4	Low	56.7	Low	133 Å²	133	104.7 Å²	104.7	58%	0.578	50%	0.496	S	S	*	.	H	α-helix	trans	-65.5	-41.3	173.3	-80	-177.7	174.6	-151.5	0	113.5	K1019 Q1021 E1025 E1026 E1027	K1019-K1023 WeakPolarHBondContact O-CB 3.35Å; K1019-K1023 WeakPolarHBondContact O-CG 3.47Å; K1019-K1023 PolarHBondContact O-N 3.3Å; Q1021-K1023 VanDerWaalsContact C-N 3.31Å; Q1021-K1023 PolarHBondContact O-N 3.13Å; K1023-E1025 VanDerWaalsContact C-N 3.33Å; K1023-E1026 PolarHBondContact O-N 2.78Å; K1023-E1027 WeakPolarHBondContact O-CB 3.42Å; K1023-E1027 WeakPolarHBondContact O-CG 3.45Å; K1023-E1027 PolarHBondContact O-N 2.91Å
1024	L	60.4	Low	57.3	Low	114 Å²	114	106.7 Å²	106.7	60%	0.597	51%	0.505	S	S	*	.	H	α-helix	trans	-65.2	-37.5	174.9	-94.4	150	0	0	0	111.8	A1020 Q1021 S1028	A1020-L1024 WeakPolarHBondContact O-CB 3.48Å; A1020-L1024 PolarHBondContact O-N 3.46Å; Q1021-L1024 PolarHBondContact O-N 3.2Å; L1024-S1028 WeakPolarHBondContact O-CB 3.37Å; L1024-S1028 PolarHBondContact O-N 3.17Å; L1024-S1028 PolarHBondContact O-OG 3.29Å
1025	E	60.7	Low	57.8	Low	107 Å²	107	110.6 Å²	110.6	50%	0.5	52%	0.523	S	S	.	.	H	α-helix	trans	-69.6	-40.8	175.2	-76.7	173.6	-165.5	0	0	111.4	Q1021 E1022 K1023 S1028 R1029	Q1021-E1025 WeakPolarHBondContact O-CB 3.24Å; Q1021-E1025 WeakPolarHBondContact O-CG 3.35Å; Q1021-E1025 PolarHBondContact O-N 2.95Å; E1022-E1025 PolarHBondContact O-N 3.47Å; K1023-E1025 VanDerWaalsContact C-N 3.33Å; E1025-S1028 WeakPolarHBondContact CA-OG 3.46Å; E1025-S1028 PolarHBondContact O-N 3.24Å; E1025-S1028 PolarHBondContact O-OG 3.44Å; E1025-R1029 WeakPolarHBondContact O-CG 3.47Å; E1025-R1029 PolarHBondContact O-N 3.24Å
1026	E	58.4	Low	58.1	Low	129 Å²	129	114.4 Å²	114.4	60%	0.603	54%	0.538	S	S	*	.	H	α-helix	trans	-63.5	-45.8	171.6	-86.1	-178.5	153.2	0	0	112.6	E1022 K1023 S1028 R1029 L1030	E1022-E1026 WeakPolarHBondContact O-CB 3.31Å; E1022-E1026 PolarHBondContact O-N 3.06Å; K1023-E1026 PolarHBondContact O-N 2.78Å; E1026-S1028 VanDerWaalsContact C-N 3.33Å; E1026-S1028 PolarHBondContact O-N 3.39Å; E1026-R1029 PolarHBondContact O-N 2.92Å; E1026-L1030 WeakPolarHBondContact O-CB 3.4Å; E1026-L1030 WeakPolarHBondContact O-CG 3.35Å; E1026-L1030 PolarHBondContact O-N 2.97Å
1027	E	63.6	Low	58.1	Low	115 Å²	115	115 Å²	115	54%	0.537	54%	0.543	S	S	.	.	H	α-helix	trans	-61.1	-42.1	175.5	-78.2	174	178.7	0	0	111	K1023 R1029 L1030 E1031	K1023-E1027 WeakPolarHBondContact O-CB 3.42Å; K1023-E1027 WeakPolarHBondContact O-CG 3.45Å; K1023-E1027 PolarHBondContact O-N 2.91Å; E1027-R1029 PolarHBondContact O-N 3.41Å; E1027-L1030 PolarHBondContact O-N 2.91Å; E1027-E1031 WeakPolarHBondContact O-CB 3.45Å; E1027-E1031 WeakPolarHBondContact O-CG 3.46Å; E1027-E1031 PolarHBondContact O-N 3.03Å
1028	S	60	Low	58	Low	50 Å²	50	116 Å²	116	35%	0.35	54%	0.543	S	S	.	.	H	α-helix	trans	-65.5	-36.4	176.1	70	0	0	0	0	113.1	L1024 E1025 E1026 E1031 E1032	L1024-S1028 WeakPolarHBondContact O-CB 3.37Å; L1024-S1028 PolarHBondContact O-N 3.17Å; L1024-S1028 PolarHBondContact O-OG 3.29Å; E1025-S1028 WeakPolarHBondContact CA-OG 3.46Å; E1025-S1028 PolarHBondContact O-N 3.24Å; E1025-S1028 PolarHBondContact O-OG 3.44Å; E1026-S1028 VanDerWaalsContact C-N 3.33Å; E1026-S1028 PolarHBondContact O-N 3.39Å; S1028-E1031 PolarHBondContact O-N 3.34Å; S1028-E1032 WeakPolarHBondContact O-CG 3.42Å; S1028-E1032 PolarHBondContact O-N 3.3Å
1029	R	59.7	Low	57.9	Low	157 Å²	157	117.7 Å²	117.7	59%	0.592	55%	0.55	S	S	*	.	H	α-helix	trans	-70.1	-38	175.7	-79.6	-175.7	69.1	-159.2	-4.5	111.9	E1025 E1026 E1027 E1032 E1033	E1025-R1029 WeakPolarHBondContact O-CG 3.47Å; E1025-R1029 PolarHBondContact O-N 3.24Å; E1026-R1029 PolarHBondContact O-N 2.92Å; E1027-R1029 PolarHBondContact O-N 3.41Å; R1029-E1032 PolarHBondContact O-N 2.86Å; R1029-E1033 WeakPolarHBondContact O-CB 3.23Å; R1029-E1033 WeakPolarHBondContact O-CG 3.31Å; R1029-E1033 PolarHBondContact O-N 3.31Å
1030	L	63.8	Low	57.8	Low	101 Å²	101	117.5 Å²	117.5	53%	0.529	55%	0.553	S	S	.	*	H	α-helix	trans	-67.7	-38.3	175.1	-72.3	167	0	0	0	111.5	E1026 E1027 E1033 E1034	E1026-L1030 WeakPolarHBondContact O-CB 3.4Å; E1026-L1030 WeakPolarHBondContact O-CG 3.35Å; E1026-L1030 PolarHBondContact O-N 2.97Å; E1027-L1030 PolarHBondContact O-N 2.91Å; L1030-E1033 PolarHBondContact O-N 3.21Å; L1030-E1034 WeakPolarHBondContact O-CB 3.48Å; L1030-E1034 WeakPolarHBondContact O-CG 3.35Å; L1030-E1034 PolarHBondContact O-N 3.08Å
1031	E	62.2	Low	57.2	Low	139 Å²	139	122.2 Å²	122.2	65%	0.65	56%	0.564	S	S	*	*	H	α-helix	trans	-65.3	-40.3	172.9	-75.6	-177.7	173.5	0	0	112.1	E1027 S1028 E1034 E1035	E1027-E1031 WeakPolarHBondContact O-CB 3.45Å; E1027-E1031 WeakPolarHBondContact O-CG 3.46Å; E1027-E1031 PolarHBondContact O-N 3.03Å; S1028-E1031 PolarHBondContact O-N 3.34Å; E1031-E1034 PolarHBondContact O-N 3.25Å; E1031-E1035 WeakPolarHBondContact O-CB 3.47Å; E1031-E1035 PolarHBondContact O-N 2.94Å
1032	E	65.7	Low	56.9	Low	128 Å²	128	121.5 Å²	121.5	60%	0.598	57%	0.567	S	S	*	*	H	α-helix	trans	-64.4	-41.9	173.9	-76.8	-179.6	174.9	0	0	112	S1028 R1029 E1035 E1036	S1028-E1032 WeakPolarHBondContact O-CG 3.42Å; S1028-E1032 PolarHBondContact O-N 3.3Å; R1029-E1032 PolarHBondContact O-N 2.86Å; E1032-E1035 PolarHBondContact O-N 2.93Å; E1032-E1036 PolarHBondContact O-N 3.06Å
1033	E	61.3	Low	55.9	Low	107 Å²	107	126.1 Å²	126.1	50%	0.5	58%	0.58	S	S	.	*	H	α-helix	trans	-65.9	-41.3	175.9	-75.9	177.1	-174.1	0	0	111.9	R1029 L1030 E1036 E1037	R1029-E1033 WeakPolarHBondContact O-CB 3.23Å; R1029-E1033 WeakPolarHBondContact O-CG 3.31Å; R1029-E1033 PolarHBondContact O-N 3.31Å; L1030-E1033 PolarHBondContact O-N 3.21Å; E1033-E1036 PolarHBondContact O-N 3.17Å; E1033-E1037 PolarHBondContact O-N 3.48Å
1034	E	58.6	Low	55.2	Low	118 Å²	118	127.4 Å²	127.4	55%	0.551	59%	0.586	S	S	*	*	H	α-helix	trans	-66.8	-34.7	173.5	-78.9	-165.6	175.6	0	0	112.7	L1030 E1031 R1038	L1030-E1034 WeakPolarHBondContact O-CB 3.48Å; L1030-E1034 WeakPolarHBondContact O-CG 3.35Å; L1030-E1034 PolarHBondContact O-N 3.08Å; E1031-E1034 PolarHBondContact O-N 3.25Å; E1034-R1038 VanDerWaalsContact O-CB 3.27Å; E1034-R1038 WeakPolarHBondContact O-CB 3.17Å; E1034-R1038 PolarHBondContact O-N 3.22Å
1035	E	58.1	Low	54.2	Low	103 Å²	103	130.8 Å²	130.8	48%	0.481	60%	0.599	S	S	.	*	H	α-helix	trans	-71.9	-36.5	176.6	-150.8	-165.1	150.8	0	0	111.6	E1031 E1032 R1038 K1039	E1031-E1035 WeakPolarHBondContact O-CB 3.47Å; E1031-E1035 PolarHBondContact O-N 2.94Å; E1032-E1035 PolarHBondContact O-N 2.93Å; E1035-R1038 PolarHBondContact O-N 3.16Å; E1035-K1039 VanDerWaalsContact CD-NZ 3.33Å; E1035-K1039 WeakPolarHBondContact O-CB 3.3Å; E1035-K1039 VanDerWaalsContact O-CG 3.31Å; E1035-K1039 WeakPolarHBondContact O-CG 3.2Å; E1035-K1039 PolarHBondContact O-N 2.79Å; E1035-K1039 VanDerWaalsContact OE1-CE 3.26Å; E1035-K1039 WeakPolarHBondContact OE1-CE 3.47Å; E1035-K1039 IonicContact OE1-NZ 3.68Å; E1035-K1039 PolarHBondContact OE1-NZ 2.88Å; E1035-K1039 IonicContact OE2-NZ 3.91Å
1036	E	56.5	Low	53.5	Low	147 Å²	147	129.1 Å²	129.1	69%	0.687	61%	0.61	S	S	*	*	H	α-helix	trans	-65.3	-44.5	170.6	-77.4	-138.8	144.4	0	0	112.1	E1032 E1033 R1038 K1039 M1040	E1032-E1036 PolarHBondContact O-N 3.06Å; E1033-E1036 PolarHBondContact O-N 3.17Å; E1036-R1038 VanDerWaalsContact C-N 3.3Å; E1036-R1038 PolarHBondContact O-N 2.97Å; E1036-K1039 PolarHBondContact O-N 3.35Å; E1036-M1040 WeakPolarHBondContact O-CB 3.34Å; E1036-M1040 PolarHBondContact O-N 3.48Å
1037	E	51.5	Low	52.5	Low	126 Å²	126	126.6 Å²	126.6	59%	0.589	61%	0.607	S	S	*	*	H	α-helix	trans	-61.7	-38.3	174.5	-81.6	-157.5	160.5	0	0	112.1	E1033 M1040 K1041	E1033-E1037 PolarHBondContact O-N 3.48Å; E1037-M1040 PolarHBondContact O-N 3.39Å; E1037-K1041 PolarHBondContact O-N 3.13Å
1038	R	53.4	Low	51.4	Low	166 Å²	166	129.3 Å²	129.3	63%	0.626	63%	0.625	S	S	*	*	H	α-helix	trans	-68.9	-40.6	177.2	-154.8	179.5	-60.2	-146.4	3.6	111.2	E1034 E1035 E1036 M1040 K1041 V1042	E1034-R1038 VanDerWaalsContact O-CB 3.27Å; E1034-R1038 WeakPolarHBondContact O-CB 3.17Å; E1034-R1038 PolarHBondContact O-N 3.22Å; E1035-R1038 PolarHBondContact O-N 3.16Å; E1036-R1038 VanDerWaalsContact C-N 3.3Å; E1036-R1038 PolarHBondContact O-N 2.97Å; R1038-M1040 VanDerWaalsContact C-N 3.31Å; R1038-M1040 PolarHBondContact O-N 3.41Å; R1038-K1041 PolarHBondContact O-N 3.3Å; R1038-V1042 WeakPolarHBondContact O-CB 3.43Å; R1038-V1042 VanDerWaalsContact O-CG2 3.22Å; R1038-V1042 WeakPolarHBondContact O-CG2 3.41Å; R1038-V1042 PolarHBondContact O-N 3.31Å
1039	K	49	Very low	50.7	Low	126 Å²	126	138.3 Å²	138.3	55%	0.548	65%	0.651	S	S	.	*	H	α-helix	trans	-64.1	-35.1	172	-77.5	168.6	-174.3	155.8	0	111.8	E1035 E1036 R1043	E1035-K1039 VanDerWaalsContact CD-NZ 3.33Å; E1035-K1039 WeakPolarHBondContact O-CB 3.3Å; E1035-K1039 VanDerWaalsContact O-CG 3.31Å; E1035-K1039 WeakPolarHBondContact O-CG 3.2Å; E1035-K1039 PolarHBondContact O-N 2.79Å; E1035-K1039 VanDerWaalsContact OE1-CE 3.26Å; E1035-K1039 WeakPolarHBondContact OE1-CE 3.47Å; E1035-K1039 IonicContact OE1-NZ 3.68Å; E1035-K1039 PolarHBondContact OE1-NZ 2.88Å; E1035-K1039 IonicContact OE2-NZ 3.91Å; E1036-K1039 PolarHBondContact O-N 3.35Å; K1039-R1043 WeakPolarHBondContact O-CB 3.36Å; K1039-R1043 PolarHBondContact O-N 2.63Å; K1039-R1043 VanDerWaalsContact O-N 3.16Å
1040	M	46.9	Very low	49.5	Very low	127 Å²	127	138.5 Å²	138.5	63%	0.626	66%	0.663	S	S	*	*	H	α-helix	trans	-72.1	-40.8	176.8	-162.5	156.9	-176	0	0	112	E1036 E1037 R1038 R1043 F1044	E1036-M1040 WeakPolarHBondContact O-CB 3.34Å; E1036-M1040 PolarHBondContact O-N 3.48Å; E1037-M1040 PolarHBondContact O-N 3.39Å; R1038-M1040 VanDerWaalsContact C-N 3.31Å; R1038-M1040 PolarHBondContact O-N 3.41Å; M1040-R1043 PolarHBondContact O-N 3.14Å; M1040-F1044 WeakPolarHBondContact O-CD2 3.44Å; M1040-F1044 PolarHBondContact O-N 3.44Å
1041	K	43.9	Very low	47.9	Very low	148 Å²	148	141.1 Å²	141.1	64%	0.643	68%	0.677	S	S	*	*	H	α-helix	trans	-64.3	-42.5	172.8	-86.6	172.7	177.7	159.8	0	112.9	E1037 R1038 R1043 F1044	E1037-K1041 PolarHBondContact O-N 3.13Å; R1038-K1041 PolarHBondContact O-N 3.3Å; K1041-R1043 PolarHBondContact O-N 2.95Å; K1041-F1044 PolarHBondContact O-N 3.19Å
1042	V	45.1	Very low	46.6	Very low	102 Å²	102	141.7 Å²	141.7	62%	0.618	68%	0.683	S	S	*	*	H	α-helix	trans	-65.6	-27.9	176.5	173	0	0	0	0	111.9	R1038	R1038-V1042 WeakPolarHBondContact O-CB 3.43Å; R1038-V1042 VanDerWaalsContact O-CG2 3.22Å; R1038-V1042 WeakPolarHBondContact O-CG2 3.41Å; R1038-V1042 PolarHBondContact O-N 3.31Å
1043	R	37.4	Very low	44.9	Very low	206 Å²	206	141.3 Å²	141.3	78%	0.777	69%	0.692	S	S	*	*	H	α-helix	trans	-74.8	-24.6	176.4	-158.5	173.8	-167.5	175	3.5	113.4	K1039 M1040 K1041	K1039-R1043 WeakPolarHBondContact O-CB 3.36Å; K1039-R1043 PolarHBondContact O-N 2.63Å; K1039-R1043 VanDerWaalsContact O-N 3.16Å; M1040-R1043 PolarHBondContact O-N 3.14Å; K1041-R1043 PolarHBondContact O-N 2.95Å
1044	F	42.8	Very low	43.7	Very low	160 Å²	160	141.8 Å²	141.8	70%	0.702	70%	0.702	S	S	*	*	H	α-helix	trans	-83.3	-23.7	-179.3	-97.8	-86.4	0	0	0	114.1	M1040 K1041 G1046	M1040-F1044 WeakPolarHBondContact O-CD2 3.44Å; M1040-F1044 PolarHBondContact O-N 3.44Å; K1041-F1044 PolarHBondContact O-N 3.19Å; F1044-G1046 VanDerWaalsContact C-N 3.28Å; F1044-G1046 PolarHBondContact O-N 3.27Å
1045	E	40.6	Very low	42.4	Very low	185 Å²	185	143.5 Å²	143.5	86%	0.864	72%	0.715	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.6	-10	176.8	-78.3	-175.6	150.4	0	0	114
1046	G	45	Very low	41	Very low	71 Å²	71	144.2 Å²	144.2	73%	0.732	73%	0.731	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.4	7.6	-170.9	0	0	0	0	0	117.7	F1044	F1044-G1046 VanDerWaalsContact C-N 3.28Å; F1044-G1046 PolarHBondContact O-N 3.27Å
1047	S	38.3	Very low	39.8	Very low	77 Å²	77	147.6 Å²	147.6	54%	0.538	74%	0.744	S	S	.	*			trans	-141.3	59.7	-171.8	48.7	0	0	0	0	115.5	R1049	S1047-R1049 VanDerWaalsContact C-N 3.33Å; S1047-R1049 PolarHBondContact O-N 3.03Å; S1047-R1049 VanDerWaalsContact O-N 3.11Å
1048	N	39.9	Very low	38.7	Very low	172 Å²	172	147.5 Å²	147.5	92%	0.92	76%	0.757	S	S	*	*			trans	-79	82.6	158.1	-103	-12.6	0	0	0	110.3
1049	R	44.3	Very low	37.4	Very low	239 Å²	239	142.9 Å²	142.9	90%	0.902	76%	0.762	S	S	*	*			trans	173.6	107	149.4	-98.2	167.7	-171.9	-149.9	2.7	109.3	S1047	S1047-R1049 VanDerWaalsContact C-N 3.33Å; S1047-R1049 PolarHBondContact O-N 3.03Å; S1047-R1049 VanDerWaalsContact O-N 3.11Å
1050	L	34.3	Very low	36.3	Very low	161 Å²	161	148.2 Å²	148.2	84%	0.843	78%	0.778	S	S	*	*			trans	-135.3	108.6	160.7	-104.8	143.9	0	0	0	108.9
1051	N	30.3	Very low	35.4	Very low	155 Å²	155	147.5 Å²	147.5	83%	0.829	79%	0.786	S	S	*	*			trans	-59.9	135.9	165.1	-84.9	-21	0	0	0	109.1	P1053	N1051-P1053 WeakPolarHBondContact O-CD 3.29Å
1052	I	34.9	Very low	34.7	Very low	151 Å²	151	151.4 Å²	151.4	77%	0.774	80%	0.798	S	S	*	*			trans	-74.8	133.8	170.7	-60.4	162.8	0	0	0	108.7	V1054	I1052-V1054 HydrophobicContact CG2-CG2 3.85Å
1053	P	31.3	Very low	33.8	Very low	121 Å²	121	158.1 Å²	158.1	79%	0.786	81%	0.812	S	S	*	*			trans	-117.4	116.1	143.4	32.5	-20.8	0	0	0	109.6	N1051	N1051-P1053 WeakPolarHBondContact O-CD 3.29Å
1054	V	36.6	Very low	33.4	Very low	117 Å²	117	156.2 Å²	156.2	71%	0.709	82%	0.816	S	S	*	*			trans	-70.4	124.4	160.1	176.9	0	0	0	0	106.8	I1052	I1052-V1054 HydrophobicContact CG2-CG2 3.85Å
1055	N	30.4	Very low	32.7	Very low	153 Å²	153	152.2 Å²	152.2	82%	0.818	82%	0.82	S	S	*	*			trans	-175.5	133.8	139.5	-91.5	-19.4	0	0	0	114.2
1056	S	28.1	Very low	32.1	Very low	118 Å²	118	149.2 Å²	149.2	83%	0.825	81%	0.814	S	S	*	*			trans	67.8	100.4	155.2	65.5	0	0	0	0	121.2
1057	F	31.6	Very low	31.2	Very low	218 Å²	218	152.1 Å²	152.1	96%	0.956	82%	0.817	S	S	*	*			trans	-65.7	131.4	143.5	-94.1	-97.2	0	0	0	110.6
1058	S	27.7	Very low	30.8	Very low	124 Å²	124	154.3 Å²	154.3	87%	0.867	83%	0.827	S	S	*	*			trans	-176.2	117.3	139.7	-170	0	0	0	0	112.9
1059	G	27.7	Very low	30.2	Very low	70 Å²	70	155 Å²	155	72%	0.722	83%	0.825	S	S	*	*			trans	56.1	121.1	140.9	0	0	0	0	0	122.7
1060	R	25.8	Very low	29.4	Very low	237 Å²	237	148.9 Å²	148.9	89%	0.894	82%	0.819	S	S	*	*				166.5	135.1	101.8	-107.5	176.7	169.7	169.2	-2.3	113.8
1061	S	27.2	Very low	29.2	Very low	112 Å²	112	149.7 Å²	149.7	78%	0.783	82%	0.823	S	S	*	*			trans	-1.3	132.5	147.1	-155.1	0	0	0	0	119.1
1062	Y	29	Very low	29.1	Very low	231 Å²	231	151.1 Å²	151.1	91%	0.906	83%	0.825	S	S	*	*			trans	-112.7	129	159.8	-84.5	-82.8	0	0	0	112.3
1063	R	26.6	Very low	28.8	Very low	242 Å²	242	155.9 Å²	155.9	91%	0.913	83%	0.833	S	S	*	*			trans	-84.9	151.7	173.4	-87.7	179.6	175.8	174.9	-2.7	110.8
1064	I	29.4	Very low	28.7	Very low	167 Å²	167	159.6 Å²	159.6	86%	0.856	84%	0.837	S	S	*	*			trans	-61.6	141.4	165.5	-63.4	162.7	0	0	0	110.8
1065	G	27	Very low	28.5	Very low	76 Å²	76	161.1 Å²	161.1	78%	0.784	84%	0.841	S	S	*	*			trans	-145	113.9	166.1	0	0	0	0	0	110.8
1066	V	28	Very low	28.6	Very low	122 Å²	122	169.1 Å²	169.1	74%	0.739	86%	0.86	S	S	*	*			trans	-85.2	134.1	170.2	171.2	0	0	0	0	108.5
1067	V	26.9	Very low	28.6	Very low	132 Å²	132	171.7 Å²	171.7	80%	0.8	86%	0.862	S	S	*	*			trans	-140.8	117.6	157.6	-179.2	0	0	0	0	109.4
1068	T	29.4	Very low	28.4	Very low	122 Å²	122	169.3 Å²	169.3	75%	0.748	86%	0.857	S	S	*	*			trans	-74.8	136.9	164.9	42.7	0	0	0	0	110.5
1069	E	27.5	Very low	28.5	Very low	187 Å²	187	171.8 Å²	171.8	87%	0.874	86%	0.856	S	S	*	*			trans	-153	136.9	154.9	-123.1	172.7	-166.4	0	0	113.8
1070	S	27.5	Very low	28.5	Very low	111 Å²	111	177.8 Å²	177.8	78%	0.776	86%	0.864	S	S	*	*			trans	-74.6	140.3	-175.2	46.8	0	0	0	0	114
1071	L	29.9	Very low	28.7	Very low	177 Å²	177	174.1 Å²	174.1	93%	0.927	86%	0.862	S	S	*	*			trans	-101.6	110.7	171	-99.5	150.7	0	0	0	111.7
1072	Q	27.9	Very low	28.8	Very low	186 Å²	186	178.2 Å²	178.2	87%	0.869	87%	0.868	S	S	*	*			trans	-71.4	142.3	169.2	-86.8	180	-50.6	0	0	112.3
1073	W	29.8	Very low	28.8	Very low	250 Å²	250	174.4 Å²	174.4	95%	0.947	87%	0.865	S	S	*	*			trans	-63.8	140.2	162.6	-84.7	50	0	0	0	112.7
1074	K	28.8	Very low	28.9	Very low	200 Å²	200	169.2 Å²	169.2	87%	0.87	86%	0.861	S	S	*	*			trans	-154.4	114.4	154	-141.9	170.2	-173.2	174.1	0	113.5
1075	N	31.7	Very low	28.9	Very low	148 Å²	148	169.4 Å²	169.4	79%	0.791	86%	0.862	S	S	*	*			trans	12.5	116.4	151.9	-67.4	-8.6	0	0	0	119.7
1076	R	32.6	Very low	29.1	Very low	322 Å²	322	177.9 Å²	177.9	100%	1.215	87%	0.869	S	S	*	*				-159	0	111.4	-115.1	-178.3	-170.7	-175.8	3.4	111.5

Retrieved 1,076 of 1,076 residues in 448.6 ms (Link to these results)

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