A0A2K5ZWF2_MANLE Loading...

Disheveled-associated activator of morphogenesis 1

Binds to disheveled (Dvl) and Rho, and mediates Wnt-induced Dvl-Rho complex formation. May play a role as a scaffolding protein to recruit Rho-GDP and Rho-GEF, thereby enhancing Rho-GTP formation. Can direct nucleation and elongation of new actin filaments. Involved in building functional cilia. Involved in the organization of the subapical actin network in multiciliated epithelial cells. Together with DAAM2, required for myocardial maturation and sarcomere assembly. During cell division, may regulate RHOA activation that signals spindle orientation and chromosomal segregation.

AlphaFold DB , UniProt , Accession A0A2K5ZWF2, Species MANLE (Mandrillus leucophaeus, Drill), Gene DAAM1, Length 1,078 aa.

						>A0A2K5ZWF2_MANLE|A0A2K5ZWF2|DAAM1
MAPRKRGGRGISFIFCCFRNNDHPEITYRLRNDSNFALQTMEPALPMPPVEELDVMFSELVDELDLTDKHREAMFALPAEKKWQIYCSKKKDQEENKGATSWPEFYIDQLNSMAARKSLLALEKEEEEERSKTIESLKTALRTKPMRFVTRFIDLDGLSCILNFLKTMDYETSESRIHTSLIGCIKALMNNSQGRAHVLAHSESINVIAQSLSTENIKTKVAVLEILGAVCLVPGGHKKVLQAMLHYQKYASERTRFQTLINDLDKSTGRYRDEVSLKTAIMSFINAVLSQGAGVESLDFRLHLRYEFLMLGIQPVIDKLREHENSTLDRHLDFFEMLRNEDELEFAKRFELVHIDTKSATQMFELTRKRLTHSEAYPHFMSILHHCLQMPYKRSGNTVQYWLLLDRIIQQIVIQNDKGQDPDSTPLENFNIKNVVRMLVNENEVKQWKEQAEKMRKEHNELQQKLEKKERECDAKTQEKEEMMQTLNKMKEKLEKETTEHKQVKQQVADLTAQLHELSRRAICASVPGGPSPGAPGGPFPSSVPGSLLPPPPPPPLLSGILPPPPPPLPPGGPPPPPGPPPLGAVMPPPGAPMGLALKKKSIPQPTNALKSFNWSKLPENKLEGTVWTEIDDTKVFKILDLEDLERTFSAYQRQQDFFVNSNSKQKEADAIDDTLSSKLKVKELSVIDGRRAQNCNILLSRLKLSNDEIKRAILTMDEQEDLPKDMLEQLLKFVPEKSDIDLLEEHKHELDRMAKADRFLFEMSRINHYQQRLQSLYFKKKFAERVAEVKPKVEAIRSGSEEVFRSSALKQLLEVVLAFGNYMNKGQRGNAYGFKISSLNKIADTKSSIDKNITLLHYLITIVENKYPSVLNLNEELQDIPQAAKVNMTELDKEISTLRSGLKAVETELEYQKSQPPQPGDKFVSVVSQFITVASFSFSDVEDLLAEAKDLFTKAVKHFGEEAGKIQPDEFFGIFDQFLQAVSEAKQENENMRKKKEEEERRARMEAQLKEQRERERKMRKAKENSEESGEFDDLVSALRSGEVFDKDLSKLKRNRKRITNQMTDSSRERPITKLNF
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	32.6	Very low	33.4	Very low	252 Å²	252	159.1 Å²	159.1	100%	1.241	85%	0.848	S	S	*	*				0	158.7	0	-73.3	166.6	164.2	0	0	109.4
2	A	31.8	Very low	32.6	Very low	95 Å²	95	152.3 Å²	152.3	79%	0.785	82%	0.822	S	S	*	*			trans	-115.3	-177.3	169.1	0	0	0	0	0	108.2
3	P	55.4	Low	32	Very low	111 Å²	111	154.2 Å²	154.2	72%	0.721	82%	0.819	S	S	*	*			cis	-118.5	-163	11.7	15.8	12	0	0	0	112.3
4	R	34.1	Very low	31.7	Very low	219 Å²	219	152.9 Å²	152.9	83%	0.826	81%	0.81	S	S	*	*			cis	-157.1	141.4	-20.6	-105.8	159.9	-166.4	-174.6	3.3	105.2
5	K	38.6	Very low	31.2	Very low	193 Å²	193	156.3 Å²	156.3	84%	0.839	82%	0.816	S	S	*	*				51.4	133.4	87.2	-60.5	-174.1	177.3	-179.6	0	115.1
6	R	37.5	Very low	30.8	Very low	236 Å²	236	153.3 Å²	153.3	89%	0.891	81%	0.811	S	S	*	*			cis	-163.7	167.1	4.1	-128.2	-169.6	175.2	176.1	-1	108.2
7	G	30.9	Very low	30.5	Very low	65 Å²	65	151.5 Å²	151.5	67%	0.67	81%	0.811	S	S	*	*			cis	101.9	122.7	-3.8	0	0	0	0	0	115.3
8	G	28.4	Very low	30.3	Very low	77 Å²	77	154.9 Å²	154.9	79%	0.794	82%	0.819	S	S	*	*			cis	148.3	130.5	-5.6	0	0	0	0	0	113.1
9	R	28.3	Very low	29.9	Very low	265 Å²	265	158.4 Å²	158.4	100%	1	82%	0.819	S	S	*	*			trans	-166.6	145	179.8	-91.1	168.6	-173.7	-165.1	0.1	110.7
10	G	24.1	Very low	29.6	Very low	67 Å²	67	157.4 Å²	157.4	69%	0.691	82%	0.815	S	S	*	*			cis	163.4	159.1	-16.2	0	0	0	0	0	115.8
11	I	26.2	Very low	30.1	Very low	170 Å²	170	156.9 Å²	156.9	87%	0.872	81%	0.814	S	S	*	*			trans	78	144.8	156	-56.4	171.4	0	0	0	117.8
12	S	23.9	Very low	29.8	Very low	77 Å²	77	152.5 Å²	152.5	54%	0.538	80%	0.795	S	S	.	*				163.9	163.4	-50.3	60.5	0	0	0	0	108.6
13	F	24	Very low	30.2	Very low	177 Å²	177	157.1 Å²	157.1	78%	0.776	80%	0.8	S	S	*	*			cis	-151.4	145.4	18.7	-85.8	-58.6	0	0	0	109.7
14	I	28.7	Very low	29.1	Very low	136 Å²	136	157.1 Å²	157.1	70%	0.697	80%	0.801	S	S	*	*				61.7	127.1	90.2	-62.6	-177.4	0	0	0	117.9
15	F	23.5	Very low	28.7	Very low	205 Å²	205	154.8 Å²	154.8	90%	0.899	80%	0.799	S	S	*	*				-166.4	167	122.4	-115.2	-78.1	0	0	0	113.9
16	C	24.6	Very low	28.2	Very low	108 Å²	108	153.5 Å²	153.5	73%	0.73	80%	0.799	S	S	*	*			trans	-157.9	162.4	-171.7	-159.8	0	0	0	0	113.7
17	C	26.8	Very low	27.6	Very low	122 Å²	122	147.1 Å²	147.1	82%	0.824	79%	0.787	S	S	*	*			trans	74.9	151.3	166.8	-68.5	0	0	0	0	121.1
18	F	26.6	Very low	27.5	Very low	214 Å²	214	154.7 Å²	154.7	94%	0.939	80%	0.797	S	S	*	*			trans	-92.4	157.6	-178.4	-75.2	-110.1	0	0	0	113
19	R	22.2	Very low	27.3	Very low	220 Å²	220	161.9 Å²	161.9	83%	0.83	80%	0.8	S	S	*	*				178.9	139.4	112.1	-175.5	165.6	-174	179.4	2.2	114.6
20	N	23.3	Very low	27.9	Very low	139 Å²	139	157 Å²	157	74%	0.743	79%	0.793	S	S	*	*			trans	66.2	144.8	163	-84.3	40.2	0	0	0	120.5
21	N	40.5	Very low	28	Very low	147 Å²	147	165.3 Å²	165.3	79%	0.786	80%	0.804	S	S	*	*			trans	-69.7	140.8	161.1	-63.3	-6.8	0	0	0	110.1
22	D	25.7	Very low	28.7	Very low	159 Å²	159	163.8 Å²	163.8	85%	0.85	80%	0.797	S	S	*	*				-160.9	146	111.7	-91.1	-33.9	0	0	0	109
23	H	40.5	Very low	29	Very low	192 Å²	192	166.8 Å²	166.8	89%	0.889	81%	0.807	S	S	*	*			trans	-88.4	145.4	176.8	-79.9	-79.4	0	0	0	111.1
24	P	32.3	Very low	29.9	Very low	112 Å²	112	163.2 Å²	163.2	73%	0.727	80%	0.804	S	S	*	*			trans	-136.1	132.7	132.9	25.8	-8.2	0	0	0	114.5
25	E	25.8	Very low	30.5	Very low	169 Å²	169	164.1 Å²	164.1	79%	0.79	81%	0.81	S	S	*	*			trans	41.5	115.2	135.6	-53.3	-172.5	143.4	0	0	120.9
26	I	27.7	Very low	30.9	Very low	166 Å²	166	164.2 Å²	164.2	85%	0.851	81%	0.811	S	S	*	*			trans	-92.3	109.8	146.7	-65.3	177.4	0	0	0	107.5	Y28	I26-Y28 PolarHBondContact O-N 2.85Å
27	T	25.5	Very low	31.2	Very low	102 Å²	102	163.9 Å²	163.9	63%	0.626	82%	0.816	S	S	*	*			trans	-79.6	113.9	-175.3	-26.9	0	0	0	0	111.8	R29	T27-R29 PolarHBondContact O-N 3.02Å
28	Y	28.4	Very low	31.4	Very low	225 Å²	225	165.6 Å²	165.6	88%	0.882	82%	0.816	S	S	*	*			trans	-75.6	102.7	163.7	-90	-87.4	0	0	0	110.3	I26	I26-Y28 PolarHBondContact O-N 2.85Å
29	R	25.8	Very low	31.5	Very low	227 Å²	227	164 Å²	164	86%	0.857	81%	0.812	S	S	*	*			trans	-106.1	123.4	159.5	-78.3	-172.9	174.1	-177.6	-0.1	109	T27 R31	T27-R29 PolarHBondContact O-N 3.02Å; R29-R31 PolarHBondContact O-N 3.22Å
30	L	40.2	Very low	32	Very low	164 Å²	164	159.2 Å²	159.2	86%	0.859	81%	0.807	S	S	*	*			trans	-65.3	131.5	167.5	-80.8	75.3	0	0	0	109.8
31	R	26.2	Very low	32.5	Very low	241 Å²	241	160.3 Å²	160.3	91%	0.909	81%	0.809	S	S	*	*			trans	-159.1	148.4	134.5	-110.2	174.5	-164.9	-153.7	2.1	111.1	R29	R29-R31 PolarHBondContact O-N 3.22Å
32	N	40.1	Very low	32.3	Very low	137 Å²	137	161.2 Å²	161.2	73%	0.733	81%	0.809	S	S	*	*			trans	-44	156.7	175.7	-37.1	0.9	0	0	0	112.7
33	D	30.6	Very low	32.9	Very low	140 Å²	140	156.5 Å²	156.5	75%	0.749	79%	0.787	S	S	*	*			cis	-152.2	158.5	40.9	-84.8	-63.7	0	0	0	115.4
34	S	42.2	Very low	33.4	Very low	102 Å²	102	152.5 Å²	152.5	71%	0.713	79%	0.787	S	S	*	*			trans	48.3	124.6	152.6	63.5	0	0	0	0	122.3
35	N	41.6	Very low	34.5	Very low	155 Å²	155	151.7 Å²	151.7	83%	0.829	78%	0.776	S	S	*	*			trans	64.4	63.3	146.4	-65.3	2.9	0	0	0	119.5
36	F	32	Very low	36.3	Very low	207 Å²	207	149.3 Å²	149.3	91%	0.908	78%	0.775	S	S	*	*			trans	-129.8	96.5	138.4	-119.8	-89.8	0	0	0	109.9	L38	F36-L38 PolarHBondContact O-N 3.47Å; F36-L38 VanDerWaalsContact O-N 3.12Å
37	A	30.6	Very low	38.2	Very low	101 Å²	101	145.2 Å²	145.2	84%	0.835	75%	0.753	S	S	*	*			trans	-77.4	93.7	172.3	0	0	0	0	0	108.9	Q39	A37-Q39 PolarHBondContact O-N 2.82Å
38	L	31.7	Very low	40.6	Very low	158 Å²	158	141.4 Å²	141.4	83%	0.827	73%	0.73	S	S	*	*			trans	-57.9	118.4	163.2	-94.7	164.4	0	0	0	107.9	F36 T40	F36-L38 PolarHBondContact O-N 3.47Å; F36-L38 VanDerWaalsContact O-N 3.12Å; L38-T40 PolarHBondContact O-N 3.17Å
39	Q	29.1	Very low	43	Very low	182 Å²	182	134.4 Å²	134.4	85%	0.85	71%	0.712	S	S	*	*			trans	-69.9	93.8	-177.5	-171.7	172.8	8	0	0	109.3	A37 M41	A37-Q39 PolarHBondContact O-N 2.82Å; Q39-M41 PolarHBondContact O-N 3.12Å
40	T	31.4	Very low	45.2	Very low	118 Å²	118	127.5 Å²	127.5	72%	0.724	70%	0.695	S	S	*	*			trans	-59.2	107.9	168.7	44.3	0	0	0	0	108.3	L38 E42	L38-T40 PolarHBondContact O-N 3.17Å; T40-E42 PolarHBondContact O-N 2.88Å
41	M	33.8	Very low	46.8	Very low	163 Å²	163	126.8 Å²	126.8	80%	0.803	69%	0.688	S	S	*	*			trans	-69.2	91.4	163.5	-71	-153	72.7	0	0	107.8	Q39	Q39-M41 PolarHBondContact O-N 3.12Å
42	E	36.4	Very low	49.2	Very low	165 Å²	165	120.5 Å²	120.5	77%	0.771	67%	0.669	S	S	*	*			trans	-55.3	128.6	161.1	-67	-174.2	126	0	0	107.9	T40 A44	T40-E42 PolarHBondContact O-N 2.88Å; E42-A44 PolarHBondContact O-N 3.18Å
43	P	40.3	Very low	51	Low	61 Å²	61	114 Å²	114	40%	0.396	63%	0.634	S	S	.	*			trans	-57.4	126.1	170	-23	34.1	0	0	0	108.8	L45	P43-L45 PolarHBondContact O-N 3.2Å
44	A	49.2	Very low	53.2	Low	107 Å²	107	109.9 Å²	109.9	88%	0.884	61%	0.612	S	S	*	*	S	Bend	trans	-68.5	9.7	-176.7	0	0	0	0	0	114.3	E42	E42-A44 PolarHBondContact O-N 3.18Å
45	L	57	Low	54.8	Low	95 Å²	95	109.6 Å²	109.6	50%	0.497	61%	0.606	S	S	.	*	S	Bend	trans	-139.2	135.7	176.2	-66.7	172	0	0	0	107.6	P43 W83	P43-L45 PolarHBondContact O-N 3.2Å; L45-W83 HydrophobicContact CB-CZ2 3.95Å
46	P	63.5	Low	56.3	Low	119 Å²	119	104.6 Å²	104.6	77%	0.773	58%	0.578	S	S	*	*	P	Polyproline II helix	trans	-60.5	144.2	174.2	27.5	-34.5	0	0	0	110.1	W83	P46-W83 WeakPolarHBondContact O-CZ2 3.4Å
47	M	66.1	Low	58.6	Low	80 Å²	80	94.8 Å²	94.8	39%	0.394	54%	0.535	S	S	.	.	P	Polyproline II helix	trans	-64.7	125.8	176.2	-171.5	168.1	71.5	0	0	109.4	L53 A79 W83	M47-L53 HydrophobicContact CG-CD2 4.03Å; M47-L53 HydrophobicContact SD-CD2 3.99Å; M47-A79 HydrophobicContact CE-CB 4.18Å; M47-A79 HydrophobicContact SD-CB 4.2Å; M47-W83 HydrophobicContact CB-CG 4.17Å; M47-W83 HydrophobicContact CG-CB 4.01Å; M47-W83 HydrophobicContact CG-CD2 4.22Å; M47-W83 HydrophobicContact CG-CG 3.77Å; M47-W83 HydrophobicContact SD-CB 3.81Å; M47-W83 HydrophobicContact SD-CG 4.13Å
48	P	76.8	Confident	60.7	Low	22 Å²	22	91.5 Å²	91.5	14%	0.143	51%	0.506	C	S	.	.	P	Polyproline II helix	trans	-68.2	166.6	179	26.2	-31.8	0	0	0	111.7	E52 L53 M56 W83	P48-E52 HydrophobicContact CB-CB 4.24Å; P48-E52 HydrophobicContact CB-CG 4.12Å; P48-L53 HydrophobicContact CG-CB 4.13Å; P48-L53 HydrophobicContact CG-CD1 4.34Å; P48-M56 HydrophobicContact CG-SD 4.06Å; P48-W83 HydrophobicContact CG-CE3 4.48Å; P48-W83 HydrophobicContact CG-CH2 4.28Å; P48-W83 HydrophobicContact CG-CZ3 4.06Å
49	P	78.3	Confident	62.5	Low	78 Å²	78	88.6 Å²	88.6	51%	0.506	49%	0.488	S	S	.	.	P	Polyproline II helix	trans	-49.1	150	171.4	-26.4	35.4	0	0	0	112.2	E51 E52 L53	P49-E51 VanDerWaalsContact C-N 3.27Å; P49-E51 PolarHBondContact O-N 2.9Å; P49-E52 WeakPolarHBondContact CD-OE2 3.45Å; P49-E52 PolarHBondContact O-N 3.49Å; P49-L53 WeakPolarHBondContact O-CB 3.46Å; P49-L53 PolarHBondContact O-N 3.3Å
50	V	73.2	Confident	64.6	Low	82 Å²	82	80.3 Å²	80.3	50%	0.497	45%	0.45	S	S	.	.	H	α-helix	trans	-61.2	-36.4	-170.5	-176.3	0	0	0	0	111.8	L53 D54	V50-L53 PolarHBondContact O-N 2.87Å; V50-D54 WeakPolarHBondContact O-CB 3.48Å; V50-D54 PolarHBondContact O-N 2.93Å
51	E	72.3	Confident	66.6	Low	149 Å²	149	74.8 Å²	74.8	70%	0.696	42%	0.415	S	S	*	.	H	α-helix	trans	-65.2	-39.6	175.5	-57.4	89.4	162.3	0	0	112.7	P49 V55	P49-E51 VanDerWaalsContact C-N 3.27Å; P49-E51 PolarHBondContact O-N 2.9Å; E51-V55 WeakPolarHBondContact O-CG2 3.48Å; E51-V55 PolarHBondContact O-N 3.21Å
52	E	76.6	Confident	68.3	Low	110 Å²	110	70.4 Å²	70.4	51%	0.514	40%	0.395	S	S	.	.	H	α-helix	trans	-74.1	-39.1	178	-176.1	171.4	-147.2	0	0	111	P48 P49 V55 M56	P48-E52 HydrophobicContact CB-CB 4.24Å; P48-E52 HydrophobicContact CB-CG 4.12Å; P49-E52 WeakPolarHBondContact CD-OE2 3.45Å; P49-E52 PolarHBondContact O-N 3.49Å; E52-V55 PolarHBondContact O-N 3.35Å; E52-M56 HydrophobicContact CG-SD 4.24Å; E52-M56 VanDerWaalsContact O-CG 3.31Å; E52-M56 WeakPolarHBondContact O-CG 3.42Å; E52-M56 PolarHBondContact O-N 3.35Å
53	L	78.5	Confident	69.7	Low	1 Å²	1	63.5 Å²	63.5	1%	0.005	36%	0.363	C	S	.	.	H	α-helix	trans	-60.6	-44.3	172.7	-179.9	61.5	0	0	0	111.8	M47 P48 P49 V50 V55 M56 F57 A79 K82 W83	M47-L53 HydrophobicContact CG-CD2 4.03Å; M47-L53 HydrophobicContact SD-CD2 3.99Å; P48-L53 HydrophobicContact CG-CB 4.13Å; P48-L53 HydrophobicContact CG-CD1 4.34Å; P49-L53 WeakPolarHBondContact O-CB 3.46Å; P49-L53 PolarHBondContact O-N 3.3Å; V50-L53 PolarHBondContact O-N 2.87Å; L53-V55 VanDerWaalsContact C-N 3.34Å; L53-M56 PolarHBondContact O-N 3.23Å; L53-F57 WeakPolarHBondContact O-CB 3.16Å; L53-F57 PolarHBondContact O-N 3.33Å; L53-A79 HydrophobicContact CD2-CB 3.75Å; L53-K82 HydrophobicContact CD2-CB 4.41Å; L53-W83 HydrophobicContact CD1-CB 4.09Å; L53-W83 HydrophobicContact CD1-CD2 4.26Å; L53-W83 HydrophobicContact CD1-CE3 3.57Å; L53-W83 HydrophobicContact CD1-CZ3 4.33Å; L53-W83 HydrophobicContact CD2-CB 4.43Å
54	D	77	Confident	71	Confident	53 Å²	53	64.4 Å²	64.4	28%	0.283	36%	0.364	S	S	.	.	H	α-helix	trans	-69.5	-30	179.3	-87.3	-22.8	0	0	0	112.5	V50 S58 K82	V50-D54 WeakPolarHBondContact O-CB 3.48Å; V50-D54 PolarHBondContact O-N 2.93Å; D54-S58 WeakPolarHBondContact O-CB 3.35Å; D54-S58 PolarHBondContact O-N 3.2Å; D54-K82 VanDerWaalsContact OD1-CD 3.26Å; D54-K82 WeakPolarHBondContact OD1-CD 3.45Å; D54-K82 VanDerWaalsContact OD1-CE 3.32Å; D54-K82 WeakPolarHBondContact OD1-CE 3.37Å; D54-K82 IonicContact OD1-NZ 3.54Å; D54-K82 PolarHBondContact OD1-NZ 3.01Å; D54-K82 IonicContact OD2-NZ 2.83Å
55	V	76.5	Confident	71.6	Confident	96 Å²	96	62.2 Å²	62.2	58%	0.582	34%	0.337	S	S	*	.	H	α-helix	trans	-67.4	-49.8	169	170.3	0	0	0	0	111.1	E51 E52 L53 F57 S58 E59	E51-V55 WeakPolarHBondContact O-CG2 3.48Å; E51-V55 PolarHBondContact O-N 3.21Å; E52-V55 PolarHBondContact O-N 3.35Å; L53-V55 VanDerWaalsContact C-N 3.34Å; V55-F57 VanDerWaalsContact C-N 3.26Å; V55-F57 PolarHBondContact O-N 2.93Å; V55-S58 WeakPolarHBondContact O-CB 3.35Å; V55-S58 PolarHBondContact O-N 3.02Å; V55-S58 VanDerWaalsContact O-N 3.12Å; V55-E59 PolarHBondContact O-N 2.79Å
56	M	72.3	Confident	72.2	Confident	50 Å²	50	59.9 Å²	59.9	25%	0.246	33%	0.325	C	S	.	.	H	α-helix	trans	-62.4	-33.6	177.7	-69.3	175.7	68.8	0	0	112.5	P48 E52 L53 W83 Y86	P48-M56 HydrophobicContact CG-SD 4.06Å; E52-M56 HydrophobicContact CG-SD 4.24Å; E52-M56 VanDerWaalsContact O-CG 3.31Å; E52-M56 WeakPolarHBondContact O-CG 3.42Å; E52-M56 PolarHBondContact O-N 3.35Å; L53-M56 PolarHBondContact O-N 3.23Å; M56-W83 HydrophobicContact CE-CZ3 4.16Å; M56-Y86 HydrophobicContact CB-CE2 4.09Å; M56-Y86 HydrophobicContact CE-CD1 4.49Å; M56-Y86 HydrophobicContact CE-CE1 3.62Å; M56-Y86 HydrophobicContact CE-CE2 4.31Å; M56-Y86 WeakPolarHBondContact CE-OH 3.31Å; M56-Y86 WeakPolarHBondContact O-CE2 3.38Å
57	F	80.2	Confident	72.1	Confident	0 Å²	0	57.7 Å²	57.7	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-78.2	-28.3	175.7	-165.7	-105	0	0	0	112.1	L53 V55 L60 V61 M74 F75 L77 K82 I85	L53-F57 WeakPolarHBondContact O-CB 3.16Å; L53-F57 PolarHBondContact O-N 3.33Å; V55-F57 VanDerWaalsContact C-N 3.26Å; V55-F57 PolarHBondContact O-N 2.93Å; F57-L60 HydrophobicContact CD2-CD2 4.04Å; F57-L60 HydrophobicContact CE2-CD2 4.04Å; F57-L60 WeakPolarHBondContact O-CB 3.37Å; F57-L60 PolarHBondContact O-N 3.42Å; F57-L60 VanDerWaalsContact O-N 3.17Å; F57-V61 HydrophobicContact CD1-CG2 3.67Å; F57-V61 HydrophobicContact CE1-CG2 3.43Å; F57-V61 VanDerWaalsContact CE1-CG2 3.43Å; F57-V61 HydrophobicContact CG-CG2 4.43Å; F57-V61 HydrophobicContact CZ-CG2 4.01Å; F57-V61 WeakPolarHBondContact O-CG2 3.47Å; F57-V61 PolarHBondContact O-N 3.44Å; F57-M74 HydrophobicContact CE1-CB 4.1Å; F57-M74 HydrophobicContact CE1-CE 4.39Å; F57-M74 WeakPolarHBondContact CE1-O 3.36Å; F57-M74 HydrophobicContact CE2-CE 4.49Å; F57-M74 HydrophobicContact CZ-CB 4.49Å; F57-M74 HydrophobicContact CZ-CE 3.73Å; F57-M74 HydrophobicContact CZ-SD 4.4Å; F57-F75 HydrophobicContact CD1-CD1 4.47Å; F57-F75 HydrophobicContact CD1-CE1 4.49Å; F57-L77 HydrophobicContact CZ-CD1 4.37Å; F57-K82 HydrophobicContact CD1-CB 4.25Å; F57-K82 HydrophobicContact CD1-CD 3.91Å; F57-K82 HydrophobicContact CD1-CG 3.83Å; F57-K82 HydrophobicContact CD2-CB 3.71Å; F57-K82 HydrophobicContact CD2-CG 4.15Å; F57-K82 WeakPolarHBondContact CD2-O 3.46Å; F57-K82 HydrophobicContact CE1-CB 4.38Å; F57-K82 HydrophobicContact CE1-CD 4.21Å; F57-K82 HydrophobicContact CE1-CG 3.76Å; F57-K82 HydrophobicContact CE2-CB 3.88Å; F57-K82 HydrophobicContact CE2-CG 4.1Å; F57-K82 HydrophobicContact CG-CB 3.91Å; F57-K82 HydrophobicContact CG-CD 4.23Å; F57-K82 HydrophobicContact CG-CG 4.03Å; F57-K82 HydrophobicContact CZ-CB 4.21Å; F57-K82 HydrophobicContact CZ-CG 3.89Å; F57-I85 HydrophobicContact CE2-CB 4.16Å; F57-I85 HydrophobicContact CE2-CG2 4.07Å
58	S	75.1	Confident	72.1	Confident	32 Å²	32	59.9 Å²	59.9	22%	0.224	32%	0.323	C	S	.	.	H	α-helix	trans	-61.3	-44	171.8	-168	0	0	0	0	111.7	D54 V55 L60 V61 D62	D54-S58 WeakPolarHBondContact O-CB 3.35Å; D54-S58 PolarHBondContact O-N 3.2Å; V55-S58 WeakPolarHBondContact O-CB 3.35Å; V55-S58 PolarHBondContact O-N 3.02Å; V55-S58 VanDerWaalsContact O-N 3.12Å; S58-L60 PolarHBondContact O-N 3.48Å; S58-V61 PolarHBondContact O-N 2.95Å; S58-D62 WeakPolarHBondContact O-CB 3.49Å; S58-D62 PolarHBondContact O-N 2.98Å
59	E	68.9	Low	71.6	Confident	97 Å²	97	66.5 Å²	66.5	45%	0.453	35%	0.35	S	S	.	.	H	α-helix	trans	-57.9	-38.3	174.2	-65.9	-165	174	0	0	112.2	V55 E63 R147	V55-E59 PolarHBondContact O-N 2.79Å; E59-E63 WeakPolarHBondContact O-CB 3.12Å; E59-E63 PolarHBondContact O-N 3.18Å; E59-R147 VanDerWaalsContact CD-NH2 3.33Å; E59-R147 IonicContact OE1-NH2 2.67Å; E59-R147 IonicContact OE2-CZ 3.87Å; E59-R147 IonicContact OE2-NH1 3.76Å; E59-R147 IonicContact OE2-NH2 2.67Å; E59-R147 PolarHBondContact OE2-NH2 3.38Å
60	L	73.8	Confident	71	Confident	9 Å²	9	67.9 Å²	67.9	5%	0.047	35%	0.349	C	S	.	.	H	α-helix	trans	-72.7	-37.3	179.7	-178.6	63.9	0	0	0	112.8	F57 S58 D62 E63 L64 I85 Y86 K89	F57-L60 HydrophobicContact CD2-CD2 4.04Å; F57-L60 HydrophobicContact CE2-CD2 4.04Å; F57-L60 WeakPolarHBondContact O-CB 3.37Å; F57-L60 PolarHBondContact O-N 3.42Å; F57-L60 VanDerWaalsContact O-N 3.17Å; S58-L60 PolarHBondContact O-N 3.48Å; L60-D62 VanDerWaalsContact C-N 3.35Å; L60-E63 WeakPolarHBondContact O-CB 3.33Å; L60-E63 PolarHBondContact O-N 3.04Å; L60-L64 WeakPolarHBondContact O-CD1 3.24Å; L60-L64 WeakPolarHBondContact O-CG 3.45Å; L60-I85 HydrophobicContact CD2-CG2 4.02Å; L60-Y86 HydrophobicContact CB-CD2 4.32Å; L60-Y86 HydrophobicContact CD2-CD2 4.03Å; L60-Y86 HydrophobicContact CD2-CG 4.48Å; L60-K89 HydrophobicContact CD1-CB 3.9Å; L60-K89 HydrophobicContact CD1-CG 3.9Å
61	V	72.6	Confident	71.1	Confident	1 Å²	1	68.4 Å²	68.4	1%	0.006	34%	0.342	C	S	.	.	H	α-helix	trans	-70.6	-35.6	176.1	172.1	0	0	0	0	110.7	F57 S58 L64 L66 R71 M74 F75	F57-V61 HydrophobicContact CD1-CG2 3.67Å; F57-V61 HydrophobicContact CE1-CG2 3.43Å; F57-V61 VanDerWaalsContact CE1-CG2 3.43Å; F57-V61 HydrophobicContact CG-CG2 4.43Å; F57-V61 HydrophobicContact CZ-CG2 4.01Å; F57-V61 WeakPolarHBondContact O-CG2 3.47Å; F57-V61 PolarHBondContact O-N 3.44Å; S58-V61 PolarHBondContact O-N 2.95Å; V61-L64 PolarHBondContact O-N 3.33Å; V61-L66 HydrophobicContact CG1-CD1 4.49Å; V61-R71 HydrophobicContact CG1-CB 4.27Å; V61-R71 HydrophobicContact CG1-CG 3.71Å; V61-M74 HydrophobicContact CG1-CB 4.39Å; V61-M74 HydrophobicContact CG2-CB 3.8Å; V61-M74 HydrophobicContact CG2-CE 4.09Å; V61-M74 HydrophobicContact CG2-CG 4.44Å; V61-F75 HydrophobicContact CB-CE2 4.38Å; V61-F75 HydrophobicContact CB-CZ 4.41Å; V61-F75 HydrophobicContact CG1-CE2 4.01Å
62	D	69.3	Low	71.1	Confident	71 Å²	71	67.8 Å²	67.8	38%	0.38	34%	0.339	S	S	.	.	H	α-helix	trans	-76.4	-24.8	176.2	-62.6	-14.8	0	0	0	111.8	S58 L60 L64 R71	S58-D62 WeakPolarHBondContact O-CB 3.49Å; S58-D62 PolarHBondContact O-N 2.98Å; L60-D62 VanDerWaalsContact C-N 3.35Å; D62-L64 PolarHBondContact O-N 2.66Å; D62-R71 IonicContact OD1-CZ 2.66Å; D62-R71 IonicContact OD1-NE 3.56Å; D62-R71 PolarHBondContact OD1-NE 3.12Å; D62-R71 IonicContact OD1-NH2 2.7Å; D62-R71 PolarHBondContact OD1-NH2 3.34Å; D62-R71 IonicContact OD2-NH2 3.6Å; D62-R71 PolarHBondContact OD2-NH2 3.27Å
63	E	65.5	Low	71	Confident	20 Å²	20	65.2 Å²	65.2	9%	0.093	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-16	167.3	-101.8	-170.1	-145.9	0	0	114.2	E59 L60 Q93 M146 R147	E59-E63 WeakPolarHBondContact O-CB 3.12Å; E59-E63 PolarHBondContact O-N 3.18Å; L60-E63 WeakPolarHBondContact O-CB 3.33Å; L60-E63 PolarHBondContact O-N 3.04Å; E63-Q93 PolarHBondContact OE1-NE2 3.04Å; E63-Q93 PolarHBondContact OE2-NE2 2.78Å; E63-Q93 VanDerWaalsContact OE2-NE2 3.1Å; E63-M146 VanDerWaalsContact O-CB 3.25Å; E63-M146 WeakPolarHBondContact O-CB 3.42Å; E63-R147 HydrophobicContact CG-CG 4.09Å; E63-R147 VanDerWaalsContact OE1-CD 3.3Å; E63-R147 WeakPolarHBondContact OE1-CD 3.31Å; E63-R147 IonicContact OE1-CZ 2.96Å; E63-R147 IonicContact OE1-NE 2.62Å; E63-R147 IonicContact OE1-NH1 2.69Å; E63-R147 PolarHBondContact OE1-NH1 2.8Å
64	L	68.6	Low	70.7	Confident	81 Å²	81	66.9 Å²	66.9	42%	0.424	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.6	-0.6	-171.8	-68.6	167.8	0	0	0	115	L60 V61 D62 L66 M74	L60-L64 WeakPolarHBondContact O-CD1 3.24Å; L60-L64 WeakPolarHBondContact O-CG 3.45Å; V61-L64 PolarHBondContact O-N 3.33Å; D62-L64 PolarHBondContact O-N 2.66Å; L64-L66 HydrophobicContact CB-CD1 4.05Å; L64-L66 HydrophobicContact CB-CD2 4.31Å; L64-L66 HydrophobicContact CB-CG 3.74Å; L64-L66 HydrophobicContact CD1-CD1 4.26Å; L64-L66 PolarHBondContact O-N 3.42Å; L64-M74 HydrophobicContact CD1-CE 3.93Å
65	D	61.5	Low	70.8	Confident	60 Å²	60	67.4 Å²	67.4	32%	0.321	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.8	33.9	178.7	-152	18.6	0	0	0	114.4	M146 N191 S192	D65-M146 HydrophobicContact CB-CE 3.61Å; D65-M146 VanDerWaalsContact CG-CE 3.49Å; D65-N191 PolarHBondContact OD2-ND2 3.25Å; D65-S192 VanDerWaalsContact CG-OG 3.25Å; D65-S192 WeakPolarHBondContact OD1-CB 3.46Å; D65-S192 PolarHBondContact OD1-OG 3.41Å; D65-S192 VanDerWaalsContact OD2-CB 3.32Å; D65-S192 WeakPolarHBondContact OD2-CB 3.2Å; D65-S192 PolarHBondContact OD2-N 2.94Å; D65-S192 PolarHBondContact OD2-OG 3.12Å; D65-S192 VanDerWaalsContact OD2-OG 3.1Å
66	L	69.2	Low	70.9	Confident	46 Å²	46	66.9 Å²	66.9	24%	0.241	35%	0.35	C	S	.	.			trans	-76.6	131.9	-172.7	-64.6	178	0	0	0	112.6	V61 L64 H70 M74	V61-L66 HydrophobicContact CG1-CD1 4.49Å; L64-L66 HydrophobicContact CB-CD1 4.05Å; L64-L66 HydrophobicContact CB-CD2 4.31Å; L64-L66 HydrophobicContact CB-CG 3.74Å; L64-L66 HydrophobicContact CD1-CD1 4.26Å; L64-L66 PolarHBondContact O-N 3.42Å; L66-H70 HydrophobicContact CB-CB 4.14Å; L66-H70 HydrophobicContact CD2-CB 4.43Å; L66-M74 HydrophobicContact CD1-CG 3.78Å
67	T	62.4	Low	71.3	Confident	73 Å²	73	66.7 Å²	66.7	45%	0.448	35%	0.35	S	S	.	.			trans	-53.6	147.8	169.3	52.9	0	0	0	0	112.1	K69 H70 R71	T67-K69 PolarHBondContact O-N 2.84Å; T67-H70 WeakPolarHBondContact O-CA 3.32Å; T67-H70 PolarHBondContact O-N 3.3Å; T67-H70 PolarHBondContact OG1-ND1 3.46Å; T67-R71 PolarHBondContact O-N 2.97Å
68	D	66.6	Low	71.3	Confident	126 Å²	126	70 Å²	70	67%	0.674	37%	0.372	S	S	*	.	H	α-helix	trans	-47.6	-38.9	-168.2	-59.3	-59	0	0	0	114.8	R71 E72	D68-R71 WeakPolarHBondContact O-CB 3.26Å; D68-R71 PolarHBondContact O-N 3.41Å; D68-E72 WeakPolarHBondContact O-CB 3.49Å; D68-E72 WeakPolarHBondContact O-CG 3.36Å; D68-E72 PolarHBondContact O-N 2.88Å
69	K	64.6	Low	71.4	Confident	161 Å²	161	69.3 Å²	69.3	70%	0.7	37%	0.368	S	S	*	.	H	α-helix	trans	-69.2	-33	178.6	-69.1	-177.8	178.1	173.8	0	114.1	T67 A73	T67-K69 PolarHBondContact O-N 2.84Å; K69-A73 VanDerWaalsContact O-CB 3.32Å; K69-A73 WeakPolarHBondContact O-CB 3.34Å; K69-A73 PolarHBondContact O-N 2.7Å
70	H	66.9	Low	71.7	Confident	108 Å²	108	70.1 Å²	70.1	50%	0.5	37%	0.372	S	S	.	.	H	α-helix	trans	-80.3	-31.7	175.7	-63.6	98.1	0	0	0	110.4	L66 T67 A73 M74	L66-H70 HydrophobicContact CB-CB 4.14Å; L66-H70 HydrophobicContact CD2-CB 4.43Å; T67-H70 WeakPolarHBondContact O-CA 3.32Å; T67-H70 PolarHBondContact O-N 3.3Å; T67-H70 PolarHBondContact OG1-ND1 3.46Å; H70-A73 PolarHBondContact O-N 2.93Å; H70-M74 WeakPolarHBondContact O-CB 3.44Å; H70-M74 VanDerWaalsContact O-CG 3.25Å; H70-M74 WeakPolarHBondContact O-CG 3.39Å; H70-M74 PolarHBondContact O-N 3.48Å
71	R	74.4	Confident	71.8	Confident	92 Å²	92	75.2 Å²	75.2	35%	0.347	39%	0.394	S	S	.	.	H	α-helix	trans	-59	-52.4	166.3	-169	160.4	-167.7	-119.3	2.8	110.9	V61 D62 T67 D68 A73 M74 F75	V61-R71 HydrophobicContact CG1-CB 4.27Å; V61-R71 HydrophobicContact CG1-CG 3.71Å; D62-R71 IonicContact OD1-CZ 2.66Å; D62-R71 IonicContact OD1-NE 3.56Å; D62-R71 PolarHBondContact OD1-NE 3.12Å; D62-R71 IonicContact OD1-NH2 2.7Å; D62-R71 PolarHBondContact OD1-NH2 3.34Å; D62-R71 IonicContact OD2-NH2 3.6Å; D62-R71 PolarHBondContact OD2-NH2 3.27Å; T67-R71 PolarHBondContact O-N 2.97Å; D68-R71 WeakPolarHBondContact O-CB 3.26Å; D68-R71 PolarHBondContact O-N 3.41Å; R71-A73 PolarHBondContact O-N 3.35Å; R71-M74 PolarHBondContact O-N 3.39Å; R71-F75 HydrophobicContact CG-CD2 4.08Å; R71-F75 HydrophobicContact CG-CE2 3.82Å; R71-F75 WeakPolarHBondContact O-CD2 3.38Å; R71-F75 PolarHBondContact O-N 2.87Å
72	E	73.6	Confident	72	Confident	137 Å²	137	75.8 Å²	75.8	64%	0.64	40%	0.396	S	S	*	.	H	α-helix	trans	-54.5	-47	171.6	-76.1	178.2	159.1	0	0	112.3	D68 M74 F75 A76	D68-E72 WeakPolarHBondContact O-CB 3.49Å; D68-E72 WeakPolarHBondContact O-CG 3.36Å; D68-E72 PolarHBondContact O-N 2.88Å; E72-M74 VanDerWaalsContact C-N 3.34Å; E72-M74 PolarHBondContact O-N 3.13Å; E72-F75 PolarHBondContact O-N 3.28Å; E72-A76 WeakPolarHBondContact O-CB 3.15Å; E72-A76 PolarHBondContact O-N 3.43Å
73	A	74.3	Confident	72.6	Confident	56 Å²	56	73.1 Å²	73.1	46%	0.463	38%	0.381	S	S	.	.	H	α-helix	trans	-64.6	-34.8	-179.9	0	0	0	0	0	113.3	K69 H70 R71 A76	K69-A73 VanDerWaalsContact O-CB 3.32Å; K69-A73 WeakPolarHBondContact O-CB 3.34Å; K69-A73 PolarHBondContact O-N 2.7Å; H70-A73 PolarHBondContact O-N 2.93Å; R71-A73 PolarHBondContact O-N 3.35Å; A73-A76 PolarHBondContact O-N 3.02Å
74	M	71.9	Confident	73.1	Confident	36 Å²	36	78.2 Å²	78.2	18%	0.177	41%	0.405	C	S	.	.	H	α-helix	trans	-69.1	-44.5	173.9	-74.7	-75.4	-84.6	0	0	111.4	F57 V61 L64 L66 H70 R71 E72 A76 L77	F57-M74 HydrophobicContact CE1-CB 4.1Å; F57-M74 HydrophobicContact CE1-CE 4.39Å; F57-M74 WeakPolarHBondContact CE1-O 3.36Å; F57-M74 HydrophobicContact CE2-CE 4.49Å; F57-M74 HydrophobicContact CZ-CB 4.49Å; F57-M74 HydrophobicContact CZ-CE 3.73Å; F57-M74 HydrophobicContact CZ-SD 4.4Å; V61-M74 HydrophobicContact CG1-CB 4.39Å; V61-M74 HydrophobicContact CG2-CB 3.8Å; V61-M74 HydrophobicContact CG2-CE 4.09Å; V61-M74 HydrophobicContact CG2-CG 4.44Å; L64-M74 HydrophobicContact CD1-CE 3.93Å; L66-M74 HydrophobicContact CD1-CG 3.78Å; H70-M74 WeakPolarHBondContact O-CB 3.44Å; H70-M74 VanDerWaalsContact O-CG 3.25Å; H70-M74 WeakPolarHBondContact O-CG 3.39Å; H70-M74 PolarHBondContact O-N 3.48Å; R71-M74 PolarHBondContact O-N 3.39Å; E72-M74 VanDerWaalsContact C-N 3.34Å; E72-M74 PolarHBondContact O-N 3.13Å; M74-A76 PolarHBondContact O-N 3.25Å; M74-L77 WeakPolarHBondContact O-CB 3.38Å; M74-L77 WeakPolarHBondContact O-CG 3.21Å; M74-L77 PolarHBondContact O-N 2.9Å; M74-L77 HydrophobicContact SD-CD1 3.95Å
75	F	79.1	Confident	73.3	Confident	64 Å²	64	77.3 Å²	77.3	28%	0.281	40%	0.399	S	S	.	.	H	α-helix	trans	-67.4	-23.1	175	-76.4	-67.9	0	0	0	113.5	F57 V61 R71 E72 L77 K82	F57-F75 HydrophobicContact CD1-CD1 4.47Å; F57-F75 HydrophobicContact CD1-CE1 4.49Å; V61-F75 HydrophobicContact CB-CE2 4.38Å; V61-F75 HydrophobicContact CB-CZ 4.41Å; V61-F75 HydrophobicContact CG1-CE2 4.01Å; R71-F75 HydrophobicContact CG-CD2 4.08Å; R71-F75 HydrophobicContact CG-CE2 3.82Å; R71-F75 WeakPolarHBondContact O-CD2 3.38Å; R71-F75 PolarHBondContact O-N 2.87Å; E72-F75 PolarHBondContact O-N 3.28Å; F75-L77 PolarHBondContact O-N 3Å; F75-K82 WeakPolarHBondContact O-CE 3.41Å; F75-K82 PolarHBondContact O-NZ 3.31Å
76	A	78.9	Confident	73.9	Confident	84 Å²	84	76.6 Å²	76.6	69%	0.694	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.7	-0.8	173.4	0	0	0	0	0	114.6	E72 A73 M74	E72-A76 WeakPolarHBondContact O-CB 3.15Å; E72-A76 PolarHBondContact O-N 3.43Å; A73-A76 PolarHBondContact O-N 3.02Å; M74-A76 PolarHBondContact O-N 3.25Å
77	L	79.8	Confident	74.1	Confident	46 Å²	46	76.3 Å²	76.3	24%	0.241	39%	0.394	C	S	.	.	S	Bend	trans	-73.4	146.5	176.3	-66.5	174	0	0	0	112.4	F57 M74 F75 K81 K82 I85	F57-L77 HydrophobicContact CZ-CD1 4.37Å; M74-L77 WeakPolarHBondContact O-CB 3.38Å; M74-L77 WeakPolarHBondContact O-CG 3.21Å; M74-L77 PolarHBondContact O-N 2.9Å; M74-L77 HydrophobicContact SD-CD1 3.95Å; F75-L77 PolarHBondContact O-N 3Å; L77-K81 HydrophobicContact CB-CB 4.45Å; L77-K81 HydrophobicContact CD2-CD 4.48Å; L77-K82 HydrophobicContact CB-CG 4.03Å; L77-K82 WeakPolarHBondContact O-CE 3.35Å; L77-K82 PolarHBondContact O-NZ 2.91Å; L77-I85 HydrophobicContact CD1-CD1 3.7Å
78	P	80.6	Confident	74.4	Confident	69 Å²	69	76.4 Å²	76.4	45%	0.448	40%	0.398	S	S	.	.			trans	-57.4	148.3	168.2	-24.2	34.3	0	0	0	112.6	E80 K81 K82	P78-E80 WeakPolarHBondContact CB-OE2 3.46Å; P78-E80 PolarHBondContact O-N 3.44Å; P78-K81 WeakPolarHBondContact O-CB 3.48Å; P78-K81 PolarHBondContact O-N 3.18Å; P78-K82 PolarHBondContact O-N 3.36Å
79	A	76.7	Confident	74.4	Confident	19 Å²	19	74.4 Å²	74.4	16%	0.157	38%	0.383	C	S	.	.	H	α-helix	trans	-53.2	-41.1	-177.4	0	0	0	0	0	112.7	M47 L53 K81 K82 W83	M47-A79 HydrophobicContact CE-CB 4.18Å; M47-A79 HydrophobicContact SD-CB 4.2Å; L53-A79 HydrophobicContact CD2-CB 3.75Å; A79-K81 VanDerWaalsContact C-N 3.27Å; A79-K81 PolarHBondContact O-N 2.88Å; A79-K82 WeakPolarHBondContact O-CB 3.43Å; A79-K82 PolarHBondContact O-N 3.26Å; A79-W83 WeakPolarHBondContact O-CB 3.34Å; A79-W83 PolarHBondContact O-N 3.17Å
80	E	75.7	Confident	74.5	Confident	114 Å²	114	70.3 Å²	70.3	53%	0.533	37%	0.365	S	S	.	.	H	α-helix	trans	-63.2	-34.8	-179.5	-54.1	73.2	-160.1	0	0	111.5	P78 Q84	P78-E80 WeakPolarHBondContact CB-OE2 3.46Å; P78-E80 PolarHBondContact O-N 3.44Å; E80-Q84 WeakPolarHBondContact O-CB 3.3Å; E80-Q84 VanDerWaalsContact O-CG 3.31Å; E80-Q84 WeakPolarHBondContact O-CG 3.44Å; E80-Q84 PolarHBondContact O-N 3.31Å
81	K	74.8	Confident	74.1	Confident	116 Å²	116	70.9 Å²	70.9	50%	0.504	37%	0.366	S	S	.	.	H	α-helix	trans	-75.9	-41.1	174.8	-71.6	-166.1	175.8	-173.7	0	111.9	L77 P78 A79 W83 Q84 I85	L77-K81 HydrophobicContact CB-CB 4.45Å; L77-K81 HydrophobicContact CD2-CD 4.48Å; P78-K81 WeakPolarHBondContact O-CB 3.48Å; P78-K81 PolarHBondContact O-N 3.18Å; A79-K81 VanDerWaalsContact C-N 3.27Å; A79-K81 PolarHBondContact O-N 2.88Å; K81-W83 VanDerWaalsContact C-N 3.29Å; K81-W83 PolarHBondContact O-N 3.43Å; K81-Q84 PolarHBondContact O-N 3.22Å; K81-I85 WeakPolarHBondContact O-CB 3.46Å; K81-I85 WeakPolarHBondContact O-CD1 3.45Å; K81-I85 VanDerWaalsContact O-CG1 3.24Å; K81-I85 WeakPolarHBondContact O-CG1 3.32Å; K81-I85 PolarHBondContact O-N 3.09Å
82	K	78.3	Confident	73.1	Confident	12 Å²	12	70.1 Å²	70.1	5%	0.052	37%	0.369	C	S	.	.	H	α-helix	trans	-55.9	-47.2	173.4	-67.8	178.6	172.1	164.2	0	110.6	L53 D54 F57 F75 L77 P78 A79 I85 Y86	L53-K82 HydrophobicContact CD2-CB 4.41Å; D54-K82 VanDerWaalsContact OD1-CD 3.26Å; D54-K82 WeakPolarHBondContact OD1-CD 3.45Å; D54-K82 VanDerWaalsContact OD1-CE 3.32Å; D54-K82 WeakPolarHBondContact OD1-CE 3.37Å; D54-K82 IonicContact OD1-NZ 3.54Å; D54-K82 PolarHBondContact OD1-NZ 3.01Å; D54-K82 IonicContact OD2-NZ 2.83Å; F57-K82 HydrophobicContact CD1-CB 4.25Å; F57-K82 HydrophobicContact CD1-CD 3.91Å; F57-K82 HydrophobicContact CD1-CG 3.83Å; F57-K82 HydrophobicContact CD2-CB 3.71Å; F57-K82 HydrophobicContact CD2-CG 4.15Å; F57-K82 WeakPolarHBondContact CD2-O 3.46Å; F57-K82 HydrophobicContact CE1-CB 4.38Å; F57-K82 HydrophobicContact CE1-CD 4.21Å; F57-K82 HydrophobicContact CE1-CG 3.76Å; F57-K82 HydrophobicContact CE2-CB 3.88Å; F57-K82 HydrophobicContact CE2-CG 4.1Å; F57-K82 HydrophobicContact CG-CB 3.91Å; F57-K82 HydrophobicContact CG-CD 4.23Å; F57-K82 HydrophobicContact CG-CG 4.03Å; F57-K82 HydrophobicContact CZ-CB 4.21Å; F57-K82 HydrophobicContact CZ-CG 3.89Å; F75-K82 WeakPolarHBondContact O-CE 3.41Å; F75-K82 PolarHBondContact O-NZ 3.31Å; L77-K82 HydrophobicContact CB-CG 4.03Å; L77-K82 WeakPolarHBondContact O-CE 3.35Å; L77-K82 PolarHBondContact O-NZ 2.91Å; P78-K82 PolarHBondContact O-N 3.36Å; A79-K82 WeakPolarHBondContact O-CB 3.43Å; A79-K82 PolarHBondContact O-N 3.26Å; K82-I85 PolarHBondContact O-N 3.18Å; K82-Y86 WeakPolarHBondContact O-CB 3.46Å; K82-Y86 PolarHBondContact O-N 3.26Å
83	W	80.6	Confident	72.2	Confident	15 Å²	15	67.4 Å²	67.4	6%	0.057	36%	0.357	C	S	.	.	H	α-helix	trans	-65.6	-43.6	177.8	-169.3	-131.2	0	0	0	112.9	L45 P46 M47 P48 L53 M56 A79 K81 I85 Y86 C87	L45-W83 HydrophobicContact CB-CZ2 3.95Å; P46-W83 WeakPolarHBondContact O-CZ2 3.4Å; M47-W83 HydrophobicContact CB-CG 4.17Å; M47-W83 HydrophobicContact CG-CB 4.01Å; M47-W83 HydrophobicContact CG-CD2 4.22Å; M47-W83 HydrophobicContact CG-CG 3.77Å; M47-W83 HydrophobicContact SD-CB 3.81Å; M47-W83 HydrophobicContact SD-CG 4.13Å; P48-W83 HydrophobicContact CG-CE3 4.48Å; P48-W83 HydrophobicContact CG-CH2 4.28Å; P48-W83 HydrophobicContact CG-CZ3 4.06Å; L53-W83 HydrophobicContact CD1-CB 4.09Å; L53-W83 HydrophobicContact CD1-CD2 4.26Å; L53-W83 HydrophobicContact CD1-CE3 3.57Å; L53-W83 HydrophobicContact CD1-CZ3 4.33Å; L53-W83 HydrophobicContact CD2-CB 4.43Å; M56-W83 HydrophobicContact CE-CZ3 4.16Å; A79-W83 WeakPolarHBondContact O-CB 3.34Å; A79-W83 PolarHBondContact O-N 3.17Å; K81-W83 VanDerWaalsContact C-N 3.29Å; K81-W83 PolarHBondContact O-N 3.43Å; W83-I85 PolarHBondContact O-N 3.3Å; W83-Y86 AromaticContact CE3-CD1 3.94Å; W83-Y86 HydrophobicContact CE3-CD1 3.94Å; W83-Y86 HydrophobicContact CE3-CG 4.43Å; W83-Y86 AromaticContact CZ3-CD1 3.62Å; W83-Y86 HydrophobicContact CZ3-CD1 3.62Å; W83-Y86 HydrophobicContact CZ3-CE1 4.01Å; W83-Y86 HydrophobicContact CZ3-CG 4.45Å; W83-Y86 PolarHBondContact O-N 3.41Å; W83-C87 WeakPolarHBondContact O-CB 3.34Å; W83-C87 PolarHBondContact O-N 3.03Å; W83-C87 PolarHBondContact O-SG 3.45Å; W83-C87 VanDerWaalsContact O-SG 3.35Å
84	Q	75.8	Confident	71.1	Confident	127 Å²	127	69.9 Å²	69.9	59%	0.593	36%	0.358	S	S	*	.	H	α-helix	trans	-59.9	-44.2	174.4	-80.3	180	-12.6	0	0	112.9	E80 K81 S88	E80-Q84 WeakPolarHBondContact O-CB 3.3Å; E80-Q84 VanDerWaalsContact O-CG 3.31Å; E80-Q84 WeakPolarHBondContact O-CG 3.44Å; E80-Q84 PolarHBondContact O-N 3.31Å; K81-Q84 PolarHBondContact O-N 3.22Å; Q84-S88 WeakPolarHBondContact O-CB 3.42Å; Q84-S88 PolarHBondContact O-N 2.71Å
85	I	72.8	Confident	70.1	Confident	62 Å²	62	75.3 Å²	75.3	32%	0.318	38%	0.383	S	S	.	.	H	α-helix	trans	-63.9	-43.8	177.6	-67.3	164.4	0	0	0	110.2	F57 L60 L77 K81 K82 W83 S88 K89	F57-I85 HydrophobicContact CE2-CB 4.16Å; F57-I85 HydrophobicContact CE2-CG2 4.07Å; L60-I85 HydrophobicContact CD2-CG2 4.02Å; L77-I85 HydrophobicContact CD1-CD1 3.7Å; K81-I85 WeakPolarHBondContact O-CB 3.46Å; K81-I85 WeakPolarHBondContact O-CD1 3.45Å; K81-I85 VanDerWaalsContact O-CG1 3.24Å; K81-I85 WeakPolarHBondContact O-CG1 3.32Å; K81-I85 PolarHBondContact O-N 3.09Å; K82-I85 PolarHBondContact O-N 3.18Å; W83-I85 PolarHBondContact O-N 3.3Å; I85-S88 PolarHBondContact O-N 3.27Å; I85-K89 PolarHBondContact O-N 2.7Å
86	Y	75.6	Confident	68.6	Low	45 Å²	45	76.4 Å²	76.4	18%	0.176	39%	0.392	C	S	.	.	H	α-helix	trans	-62	-49.9	176.4	-175.5	-86.9	0	0	0	112.8	M56 L60 K82 W83 S88 K89 K90	M56-Y86 HydrophobicContact CB-CE2 4.09Å; M56-Y86 HydrophobicContact CE-CD1 4.49Å; M56-Y86 HydrophobicContact CE-CE1 3.62Å; M56-Y86 HydrophobicContact CE-CE2 4.31Å; M56-Y86 WeakPolarHBondContact CE-OH 3.31Å; M56-Y86 WeakPolarHBondContact O-CE2 3.38Å; L60-Y86 HydrophobicContact CB-CD2 4.32Å; L60-Y86 HydrophobicContact CD2-CD2 4.03Å; L60-Y86 HydrophobicContact CD2-CG 4.48Å; K82-Y86 WeakPolarHBondContact O-CB 3.46Å; K82-Y86 PolarHBondContact O-N 3.26Å; W83-Y86 AromaticContact CE3-CD1 3.94Å; W83-Y86 HydrophobicContact CE3-CD1 3.94Å; W83-Y86 HydrophobicContact CE3-CG 4.43Å; W83-Y86 AromaticContact CZ3-CD1 3.62Å; W83-Y86 HydrophobicContact CZ3-CD1 3.62Å; W83-Y86 HydrophobicContact CZ3-CE1 4.01Å; W83-Y86 HydrophobicContact CZ3-CG 4.45Å; W83-Y86 PolarHBondContact O-N 3.41Å; Y86-S88 VanDerWaalsContact C-N 3.31Å; Y86-S88 PolarHBondContact O-N 3.47Å; Y86-K89 PolarHBondContact O-N 2.93Å; Y86-K90 HydrophobicContact CE1-CD 4.18Å; Y86-K90 WeakPolarHBondContact O-CB 3.32Å; Y86-K90 PolarHBondContact O-N 3.1Å
87	C	73.1	Confident	67.4	Low	40 Å²	40	80.1 Å²	80.1	27%	0.27	39%	0.392	S	S	.	.	H	α-helix	trans	-61.3	-38.9	177	-69.7	0	0	0	0	112.4	W83 K91	W83-C87 WeakPolarHBondContact O-CB 3.34Å; W83-C87 PolarHBondContact O-N 3.03Å; W83-C87 PolarHBondContact O-SG 3.45Å; W83-C87 VanDerWaalsContact O-SG 3.35Å; C87-K91 PolarHBondContact O-N 3.34Å; C87-K91 VanDerWaalsContact O-N 3.13Å
88	S	69.4	Low	66.5	Low	75 Å²	75	79.5 Å²	79.5	52%	0.524	40%	0.398	S	S	.	.	H	α-helix	trans	-61.8	-49	175.4	-165	0	0	0	0	111.2	Q84 I85 Y86 K91 D92	Q84-S88 WeakPolarHBondContact O-CB 3.42Å; Q84-S88 PolarHBondContact O-N 2.71Å; I85-S88 PolarHBondContact O-N 3.27Å; Y86-S88 VanDerWaalsContact C-N 3.31Å; Y86-S88 PolarHBondContact O-N 3.47Å; S88-K91 WeakPolarHBondContact O-CB 3.25Å; S88-K91 PolarHBondContact O-N 3.35Å; S88-D92 PolarHBondContact O-N 2.94Å
89	K	66.1	Low	65.5	Low	85 Å²	85	79.6 Å²	79.6	37%	0.37	40%	0.404	S	S	.	.	H	α-helix	trans	-70.4	-34.2	-178.8	-149.5	74.8	-156.8	155.3	0	113.5	L60 I85 Y86 K91 D92 Q93	L60-K89 HydrophobicContact CD1-CB 3.9Å; L60-K89 HydrophobicContact CD1-CG 3.9Å; I85-K89 PolarHBondContact O-N 2.7Å; Y86-K89 PolarHBondContact O-N 2.93Å; K89-K91 VanDerWaalsContact C-N 3.29Å; K89-K91 PolarHBondContact O-N 2.82Å; K89-D92 WeakPolarHBondContact CE-OD2 3.47Å; K89-D92 IonicContact NZ-OD2 3.88Å; K89-D92 PolarHBondContact NZ-OD2 3.41Å; K89-D92 WeakPolarHBondContact O-CB 3.49Å; K89-D92 PolarHBondContact O-N 2.8Å; K89-Q93 WeakPolarHBondContact O-CG 3.41Å; K89-Q93 PolarHBondContact O-N 2.98Å; K89-Q93 VanDerWaalsContact O-N 3.09Å
90	K	65.8	Low	65.2	Low	74 Å²	74	81.7 Å²	81.7	32%	0.322	42%	0.415	S	S	.	.	H	α-helix	trans	-62.1	-37.2	172.3	-175.5	171.7	177.7	176.3	0	111.8	Y86 Q93 E94	Y86-K90 HydrophobicContact CE1-CD 4.18Å; Y86-K90 WeakPolarHBondContact O-CB 3.32Å; Y86-K90 PolarHBondContact O-N 3.1Å; K90-Q93 PolarHBondContact O-N 3.27Å; K90-E94 WeakPolarHBondContact CE-OE1 3.25Å; K90-E94 PolarHBondContact O-N 3.1Å
91	K	57.9	Low	64.8	Low	121 Å²	121	77.5 Å²	77.5	53%	0.526	40%	0.398	S	S	.	.	H	α-helix	trans	-65	-44.9	174.9	-165.6	-175.1	174.7	-165.3	0	112	C87 S88 K89 Q93 E94 E95	C87-K91 PolarHBondContact O-N 3.34Å; C87-K91 VanDerWaalsContact O-N 3.13Å; S88-K91 WeakPolarHBondContact O-CB 3.25Å; S88-K91 PolarHBondContact O-N 3.35Å; K89-K91 VanDerWaalsContact C-N 3.29Å; K89-K91 PolarHBondContact O-N 2.82Å; K91-Q93 PolarHBondContact O-N 3.36Å; K91-E94 PolarHBondContact O-N 3.01Å; K91-E95 WeakPolarHBondContact CE-OE1 3.08Å; K91-E95 PolarHBondContact O-N 2.8Å
92	D	54.6	Low	65	Low	76 Å²	76	79.5 Å²	79.5	41%	0.406	40%	0.403	S	S	.	.	H	α-helix	trans	-56.5	-35.1	173.1	-69.8	-10	0	0	0	112.7	S88 K89	S88-D92 PolarHBondContact O-N 2.94Å; K89-D92 WeakPolarHBondContact CE-OD2 3.47Å; K89-D92 IonicContact NZ-OD2 3.88Å; K89-D92 PolarHBondContact NZ-OD2 3.41Å; K89-D92 WeakPolarHBondContact O-CB 3.49Å; K89-D92 PolarHBondContact O-N 2.8Å
93	Q	54.5	Low	65.4	Low	80 Å²	80	79 Å²	79	37%	0.374	40%	0.401	S	S	.	.	H	α-helix	trans	-73.5	-39.3	177.7	-72	-178.6	-3.5	0	0	112.2	E63 K89 K90 K91 E95 N96	E63-Q93 PolarHBondContact OE1-NE2 3.04Å; E63-Q93 PolarHBondContact OE2-NE2 2.78Å; E63-Q93 VanDerWaalsContact OE2-NE2 3.1Å; K89-Q93 WeakPolarHBondContact O-CG 3.41Å; K89-Q93 PolarHBondContact O-N 2.98Å; K89-Q93 VanDerWaalsContact O-N 3.09Å; K90-Q93 PolarHBondContact O-N 3.27Å; K91-Q93 PolarHBondContact O-N 3.36Å; Q93-E95 PolarHBondContact O-N 3.27Å; Q93-N96 PolarHBondContact O-N 2.7Å
94	E	51.6	Low	65.6	Low	107 Å²	107	80.9 Å²	80.9	50%	0.5	41%	0.41	S	S	.	.	H	α-helix	trans	-69.9	-28.6	-176.4	-77.7	-177.7	-168.6	0	0	114	K90 K91 N96 K97	K90-E94 WeakPolarHBondContact CE-OE1 3.25Å; K90-E94 PolarHBondContact O-N 3.1Å; K91-E94 PolarHBondContact O-N 3.01Å; E94-N96 VanDerWaalsContact C-N 3.32Å; E94-N96 PolarHBondContact O-N 3.04Å; E94-K97 WeakPolarHBondContact O-CE 3.46Å
95	E	51.1	Low	66.2	Low	151 Å²	151	78 Å²	78	71%	0.706	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.9	-10	177	-67.2	-177.8	-171.2	0	0	113.9	K91 Q93	K91-E95 WeakPolarHBondContact CE-OE1 3.08Å; K91-E95 PolarHBondContact O-N 2.8Å; Q93-E95 PolarHBondContact O-N 3.27Å
96	N	47.8	Very low	66.9	Low	86 Å²	86	75.3 Å²	75.3	46%	0.46	38%	0.382	S	S	.	.			trans	-101.7	19.5	-163.7	-138.8	-51.6	0	0	0	115.8	Q93 E94 G98 S101 K144	Q93-N96 PolarHBondContact O-N 2.7Å; E94-N96 VanDerWaalsContact C-N 3.32Å; E94-N96 PolarHBondContact O-N 3.04Å; N96-G98 VanDerWaalsContact C-N 3.26Å; N96-G98 PolarHBondContact O-N 3.07Å; N96-S101 WeakPolarHBondContact O-CB 3.32Å; N96-K144 PolarHBondContact OD1-NZ 2.87Å
97	K	52.1	Low	67.5	Low	162 Å²	162	73.9 Å²	73.9	70%	0.704	38%	0.377	S	S	*	.			trans	-77.9	42.8	-165.5	-64.4	175.9	-177.5	166.6	0	116.2	E94	E94-K97 WeakPolarHBondContact O-CE 3.46Å
98	G	60.8	Low	68.1	Low	34 Å²	34	77.1 Å²	77.1	35%	0.351	39%	0.392	S	S	.	.	S	Bend	trans	-86.2	160.6	172.6	0	0	0	0	0	113.3	N96 T100 S101	N96-G98 VanDerWaalsContact C-N 3.26Å; N96-G98 PolarHBondContact O-N 3.07Å; G98-T100 PolarHBondContact O-N 2.59Å; G98-S101 VanDerWaalsContact O-CB 3.27Å; G98-S101 WeakPolarHBondContact O-CB 3.27Å; G98-S101 PolarHBondContact O-N 2.89Å; G98-S101 PolarHBondContact O-OG 2.72Å
99	A	61.2	Low	68.9	Low	70 Å²	70	77 Å²	77	58%	0.579	38%	0.383	S	S	*	.	G	3₁₀ helix	trans	-57.8	-33.3	177.1	0	0	0	0	0	112.9	S101 W102	A99-S101 PolarHBondContact O-N 3.19Å; A99-S101 VanDerWaalsContact O-N 3.08Å; A99-W102 PolarHBondContact O-N 2.85Å
100	T	69.1	Low	69.9	Low	64 Å²	64	73 Å²	73	39%	0.393	37%	0.366	S	S	.	.	G	3₁₀ helix	trans	-70.1	6.6	174	50.8	0	0	0	0	115.1	G98 F105 Y106	G98-T100 PolarHBondContact O-N 2.59Å; T100-F105 HydrophobicContact CG2-CD1 4.25Å; T100-F105 HydrophobicContact CG2-CE1 3.91Å; T100-Y106 WeakPolarHBondContact CB-OH 3.4Å; T100-Y106 PolarHBondContact O-OH 2.96Å
101	S	68.9	Low	70.8	Confident	26 Å²	26	72.4 Å²	72.4	18%	0.182	37%	0.366	C	S	.	.	G	3₁₀ helix	trans	-87.8	-10.7	168.7	66.2	0	0	0	0	114	N96 G98 A99 F148	N96-S101 WeakPolarHBondContact O-CB 3.32Å; G98-S101 VanDerWaalsContact O-CB 3.27Å; G98-S101 WeakPolarHBondContact O-CB 3.27Å; G98-S101 PolarHBondContact O-N 2.89Å; G98-S101 PolarHBondContact O-OG 2.72Å; A99-S101 PolarHBondContact O-N 3.19Å; A99-S101 VanDerWaalsContact O-N 3.08Å; S101-F148 VanDerWaalsContact O-CD2 3.32Å; S101-F148 WeakPolarHBondContact O-CD2 3.44Å
102	W	78.6	Confident	72	Confident	157 Å²	157	69 Å²	69	60%	0.595	36%	0.358	S	S	*	.	S	Bend	trans	-108.6	133.6	-177.6	-64.2	100.9	0	0	0	112.1	A99 E104	A99-W102 PolarHBondContact O-N 2.85Å; W102-E104 VanDerWaalsContact C-N 3.27Å; W102-E104 PolarHBondContact O-N 2.91Å
103	P	85.3	Confident	73.3	Confident	3 Å²	3	66.2 Å²	66.2	2%	0.019	34%	0.342	C	S	.	.	H	α-helix	trans	-55.7	-38.5	173.9	-31.6	40.2	0	0	0	114.2	F105 Y106 I107 F148 R151 F152 L155	P103-F105 VanDerWaalsContact C-N 3.3Å; P103-F105 PolarHBondContact O-N 2.92Å; P103-Y106 PolarHBondContact O-N 3.18Å; P103-I107 HydrophobicContact CB-CD1 4.48Å; P103-I107 PolarHBondContact O-N 3.1Å; P103-I107 VanDerWaalsContact O-N 3.1Å; P103-F148 HydrophobicContact CB-CE2 4.46Å; P103-F148 HydrophobicContact CG-CD1 4.37Å; P103-F148 HydrophobicContact CG-CD2 3.65Å; P103-F148 HydrophobicContact CG-CE1 4.45Å; P103-F148 HydrophobicContact CG-CE2 3.76Å; P103-F148 HydrophobicContact CG-CG 3.97Å; P103-F148 HydrophobicContact CG-CZ 4.16Å; P103-F148 VanDerWaalsContact CG-O 3.29Å; P103-F148 WeakPolarHBondContact CG-O 3.28Å; P103-R151 HydrophobicContact CB-CG 4.41Å; P103-R151 HydrophobicContact CG-CB 4.02Å; P103-R151 HydrophobicContact CG-CG 3.87Å; P103-F152 HydrophobicContact CB-CB 3.93Å; P103-F152 HydrophobicContact CB-CD2 4.11Å; P103-F152 HydrophobicContact CG-CB 4.22Å; P103-L155 HydrophobicContact CB-CD1 4.39Å
104	E	86.2	Confident	74.4	Confident	54 Å²	54	63.3 Å²	63.3	25%	0.252	33%	0.332	S	S	.	.	H	α-helix	trans	-49.7	-47.7	-177.8	-70.8	81.3	169.9	0	0	111.9	W102 Y106 I107 D108 R151 L155	W102-E104 VanDerWaalsContact C-N 3.27Å; W102-E104 PolarHBondContact O-N 2.91Å; E104-Y106 VanDerWaalsContact C-N 3.3Å; E104-Y106 PolarHBondContact O-N 2.62Å; E104-I107 PolarHBondContact O-N 2.74Å; E104-I107 VanDerWaalsContact O-N 3.15Å; E104-D108 PolarHBondContact O-N 2.97Å; E104-R151 IonicContact OE1-CZ 3.13Å; E104-R151 IonicContact OE1-NE 2.71Å; E104-R151 PolarHBondContact OE1-NE 3.4Å; E104-R151 IonicContact OE1-NH2 3.01Å; E104-R151 PolarHBondContact OE1-NH2 2.82Å; E104-L155 HydrophobicContact CG-CD1 3.72Å; E104-L155 WeakPolarHBondContact OE1-CD1 3.49Å
105	F	87.6	Confident	75.4	Confident	66 Å²	66	62 Å²	62	29%	0.289	34%	0.339	S	S	.	.	H	α-helix	trans	-55.1	-43.5	178.3	168.5	-96.7	0	0	0	112.6	T100 P103 Q109	T100-F105 HydrophobicContact CG2-CD1 4.25Å; T100-F105 HydrophobicContact CG2-CE1 3.91Å; P103-F105 VanDerWaalsContact C-N 3.3Å; P103-F105 PolarHBondContact O-N 2.92Å; F105-Q109 HydrophobicContact CE1-CG 4.37Å; F105-Q109 HydrophobicContact CE2-CG 4.23Å; F105-Q109 HydrophobicContact CZ-CG 4.1Å; F105-Q109 VanDerWaalsContact O-CG 3.23Å; F105-Q109 WeakPolarHBondContact O-CG 3.14Å; F105-Q109 PolarHBondContact O-N 3.22Å
106	Y	88.4	Confident	76.2	Confident	6 Å²	6	61.8 Å²	61.8	2%	0.024	33%	0.332	C	S	.	.	H	α-helix	trans	-75.4	-32.9	-178.7	-65.4	-76.2	0	0	0	112.3	T100 P103 E104 Q109 L110 S136 L137 A140 F148	T100-Y106 WeakPolarHBondContact CB-OH 3.4Å; T100-Y106 PolarHBondContact O-OH 2.96Å; P103-Y106 PolarHBondContact O-N 3.18Å; E104-Y106 VanDerWaalsContact C-N 3.3Å; E104-Y106 PolarHBondContact O-N 2.62Å; Y106-Q109 PolarHBondContact O-N 2.89Å; Y106-L110 WeakPolarHBondContact O-CB 3.42Å; Y106-L110 VanDerWaalsContact O-CG 3.27Å; Y106-L110 WeakPolarHBondContact O-CG 3.32Å; Y106-L110 PolarHBondContact O-N 2.83Å; Y106-S136 PolarHBondContact OH-OG 3.43Å; Y106-L137 HydrophobicContact CD1-CB 3.65Å; Y106-L137 HydrophobicContact CD1-CD1 4.24Å; Y106-L137 HydrophobicContact CD1-CG 4.43Å; Y106-L137 HydrophobicContact CD2-CD1 4.09Å; Y106-L137 HydrophobicContact CE1-CB 4Å; Y106-L137 HydrophobicContact CG-CB 4.11Å; Y106-L137 HydrophobicContact CG-CD1 3.8Å; Y106-L137 HydrophobicContact CG-CG 4.42Å; Y106-A140 HydrophobicContact CE2-CB 4.18Å; Y106-F148 HydrophobicContact CD2-CE2 4.4Å; Y106-F148 AromaticContact CD2-CZ 3.9Å; Y106-F148 HydrophobicContact CD2-CZ 3.9Å; Y106-F148 HydrophobicContact CE2-CE2 4.24Å; Y106-F148 AromaticContact CE2-CZ 3.88Å; Y106-F148 HydrophobicContact CE2-CZ 3.88Å
107	I	88.1	Confident	76.5	Confident	14 Å²	14	67.2 Å²	67.2	7%	0.072	35%	0.352	C	S	.	.	H	α-helix	trans	-66.7	-45	176.6	-68	171.9	0	0	0	110.1	P103 E104 Q109 L110 N111 F152 L155	P103-I107 HydrophobicContact CB-CD1 4.48Å; P103-I107 PolarHBondContact O-N 3.1Å; P103-I107 VanDerWaalsContact O-N 3.1Å; E104-I107 PolarHBondContact O-N 2.74Å; E104-I107 VanDerWaalsContact O-N 3.15Å; I107-Q109 VanDerWaalsContact C-N 3.34Å; I107-Q109 PolarHBondContact O-N 3.26Å; I107-L110 PolarHBondContact O-N 2.91Å; I107-N111 WeakPolarHBondContact O-CB 3.33Å; I107-N111 PolarHBondContact O-N 2.99Å; I107-N111 PolarHBondContact O-ND2 3.02Å; I107-N111 VanDerWaalsContact O-ND2 3.13Å; I107-F152 HydrophobicContact CD1-CD2 3.93Å; I107-F152 HydrophobicContact CD1-CE2 4.17Å; I107-F152 HydrophobicContact CG1-CD2 3.95Å; I107-F152 HydrophobicContact CG1-CE2 3.72Å; I107-L155 HydrophobicContact CD1-CB 3.51Å; I107-L155 HydrophobicContact CD1-CD1 4.11Å
108	D	85.3	Confident	76.4	Confident	109 Å²	109	64.3 Å²	64.3	58%	0.583	35%	0.351	S	S	*	.	H	α-helix	trans	-60.3	-42.3	174.4	-74.4	-22.4	0	0	0	112	E104 N111 S112	E104-D108 PolarHBondContact O-N 2.97Å; D108-N111 PolarHBondContact O-N 3.03Å; D108-S112 WeakPolarHBondContact O-CB 3.49Å; D108-S112 PolarHBondContact O-N 3.3Å
109	Q	85.9	Confident	75.5	Confident	71 Å²	71	70 Å²	70	33%	0.332	37%	0.373	S	S	.	.	H	α-helix	trans	-66.6	-42.5	176.3	-68	-66	-9	0	0	112.4	F105 Y106 I107 N111 S112 M113 T133	F105-Q109 HydrophobicContact CE1-CG 4.37Å; F105-Q109 HydrophobicContact CE2-CG 4.23Å; F105-Q109 HydrophobicContact CZ-CG 4.1Å; F105-Q109 VanDerWaalsContact O-CG 3.23Å; F105-Q109 WeakPolarHBondContact O-CG 3.14Å; F105-Q109 PolarHBondContact O-N 3.22Å; Y106-Q109 PolarHBondContact O-N 2.89Å; I107-Q109 VanDerWaalsContact C-N 3.34Å; I107-Q109 PolarHBondContact O-N 3.26Å; Q109-N111 VanDerWaalsContact C-N 3.35Å; Q109-N111 PolarHBondContact O-N 3.37Å; Q109-S112 PolarHBondContact O-N 3.09Å; Q109-M113 HydrophobicContact CB-CE 4.18Å; Q109-M113 WeakPolarHBondContact O-CB 3.46Å; Q109-M113 VanDerWaalsContact O-CE 3.26Å; Q109-M113 WeakPolarHBondContact O-CE 3.37Å; Q109-M113 WeakPolarHBondContact O-CG 3.47Å; Q109-M113 PolarHBondContact O-N 3.12Å; Q109-T133 HydrophobicContact CB-CG2 4.12Å; Q109-T133 HydrophobicContact CG-CG2 4.27Å
110	L	86.4	Confident	74.7	Confident	2 Å²	2	73.6 Å²	73.6	1%	0.01	38%	0.382	C	S	.	.	H	α-helix	trans	-58.6	-45.7	174.3	-76	170.5	0	0	0	111.6	Y106 I107 M113 A114 I134 L137 C160 I161 F164 L181	Y106-L110 WeakPolarHBondContact O-CB 3.42Å; Y106-L110 VanDerWaalsContact O-CG 3.27Å; Y106-L110 WeakPolarHBondContact O-CG 3.32Å; Y106-L110 PolarHBondContact O-N 2.83Å; I107-L110 PolarHBondContact O-N 2.91Å; L110-M113 HydrophobicContact CD2-CE 4.49Å; L110-M113 PolarHBondContact O-N 3.29Å; L110-A114 WeakPolarHBondContact O-CB 3.42Å; L110-A114 PolarHBondContact O-N 2.85Å; L110-I134 HydrophobicContact CD2-CG1 4.47Å; L110-L137 HydrophobicContact CD1-CD2 3.69Å; L110-L137 HydrophobicContact CD2-CD2 4.48Å; L110-L137 HydrophobicContact CG-CD2 4.28Å; L110-C160 HydrophobicContact CB-CB 4.47Å; L110-C160 HydrophobicContact CD1-CB 4.4Å; L110-I161 HydrophobicContact CD1-CG1 3.68Å; L110-F164 HydrophobicContact CD2-CD1 3.89Å; L110-F164 HydrophobicContact CD2-CE1 4.41Å; L110-L181 HydrophobicContact CD2-CD2 3.69Å
111	N	86.1	Confident	73.8	Confident	62 Å²	62	75.5 Å²	75.5	33%	0.332	40%	0.404	S	S	.	.	H	α-helix	trans	-66.9	-41.1	178	-69.8	-35.6	0	0	0	111.9	I107 D108 Q109 M113 A114 A115 C160	I107-N111 WeakPolarHBondContact O-CB 3.33Å; I107-N111 PolarHBondContact O-N 2.99Å; I107-N111 PolarHBondContact O-ND2 3.02Å; I107-N111 VanDerWaalsContact O-ND2 3.13Å; D108-N111 PolarHBondContact O-N 3.03Å; Q109-N111 VanDerWaalsContact C-N 3.35Å; Q109-N111 PolarHBondContact O-N 3.37Å; N111-M113 VanDerWaalsContact C-N 3.32Å; N111-M113 PolarHBondContact O-N 3.26Å; N111-A114 PolarHBondContact O-N 3.24Å; N111-A115 VanDerWaalsContact O-CB 3.26Å; N111-A115 WeakPolarHBondContact O-CB 3.3Å; N111-A115 PolarHBondContact O-N 3.08Å; N111-C160 PolarHBondContact ND2-SG 2.92Å; N111-C160 PolarHBondContact OD1-SG 3.24Å
112	S	82.7	Confident	72.5	Confident	50 Å²	50	79.9 Å²	79.9	35%	0.35	43%	0.425	S	S	.	.	H	α-helix	trans	-63.2	-33.8	175.2	-177.1	0	0	0	0	113	D108 Q109 R116	D108-S112 WeakPolarHBondContact O-CB 3.49Å; D108-S112 PolarHBondContact O-N 3.3Å; Q109-S112 PolarHBondContact O-N 3.09Å; S112-R116 PolarHBondContact O-NH1 3.1Å; S112-R116 PolarHBondContact OG-NH1 3.01Å
113	M	81.8	Confident	71.4	Confident	16 Å²	16	79.4 Å²	79.4	8%	0.079	43%	0.429	C	S	.	.	H	α-helix	trans	-75	-49.2	172.9	-72.7	-177.4	-78.4	0	0	111.6	Q109 L110 N111 A115 R116 R130 I134 F164	Q109-M113 HydrophobicContact CB-CE 4.18Å; Q109-M113 WeakPolarHBondContact O-CB 3.46Å; Q109-M113 VanDerWaalsContact O-CE 3.26Å; Q109-M113 WeakPolarHBondContact O-CE 3.37Å; Q109-M113 WeakPolarHBondContact O-CG 3.47Å; Q109-M113 PolarHBondContact O-N 3.12Å; L110-M113 HydrophobicContact CD2-CE 4.49Å; L110-M113 PolarHBondContact O-N 3.29Å; N111-M113 VanDerWaalsContact C-N 3.32Å; N111-M113 PolarHBondContact O-N 3.26Å; M113-A115 PolarHBondContact O-N 3.15Å; M113-R116 PolarHBondContact O-N 3.28Å; M113-R116 VanDerWaalsContact O-N 3.15Å; M113-R130 HydrophobicContact CG-CG 4.28Å; M113-R130 HydrophobicContact SD-CB 3.75Å; M113-R130 HydrophobicContact SD-CG 3.77Å; M113-I134 HydrophobicContact CE-CD1 3.85Å; M113-I134 HydrophobicContact CE-CG1 3.8Å; M113-I134 HydrophobicContact SD-CD1 3.99Å; M113-I134 HydrophobicContact SD-CG1 4.43Å; M113-F164 HydrophobicContact CB-CD1 4.45Å; M113-F164 HydrophobicContact CB-CE1 3.61Å; M113-F164 HydrophobicContact CB-CZ 3.67Å; M113-F164 HydrophobicContact CE-CE1 4.37Å; M113-F164 HydrophobicContact SD-CE1 4.26Å
114	A	77.1	Confident	70.1	Confident	19 Å²	19	87.8 Å²	87.8	16%	0.157	47%	0.465	C	S	.	.	H	α-helix	trans	-63.2	-27.2	-179.5	0	0	0	0	0	113.8	L110 N111 F164	L110-A114 WeakPolarHBondContact O-CB 3.42Å; L110-A114 PolarHBondContact O-N 2.85Å; N111-A114 PolarHBondContact O-N 3.24Å; A114-F164 HydrophobicContact CB-CB 3.93Å; A114-F164 HydrophobicContact CB-CD2 3.98Å; A114-F164 HydrophobicContact CB-CG 3.92Å
115	A	72.9	Confident	68.6	Low	79 Å²	79	92.9 Å²	92.9	65%	0.653	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.1	-17.4	177.3	0	0	0	0	0	114.4	N111 M113 K117	N111-A115 VanDerWaalsContact O-CB 3.26Å; N111-A115 WeakPolarHBondContact O-CB 3.3Å; N111-A115 PolarHBondContact O-N 3.08Å; M113-A115 PolarHBondContact O-N 3.15Å; A115-K117 PolarHBondContact O-N 2.61Å
116	R	68.1	Low	67.8	Low	148 Å²	148	93.4 Å²	93.4	56%	0.558	49%	0.493	S	S	*	.			trans	-76.6	87.7	179.5	-80.4	177.9	171.5	78.2	-12.1	111.4	S112 M113 S118	S112-R116 PolarHBondContact O-NH1 3.1Å; S112-R116 PolarHBondContact OG-NH1 3.01Å; M113-R116 PolarHBondContact O-N 3.28Å; M113-R116 VanDerWaalsContact O-N 3.15Å; R116-S118 PolarHBondContact O-N 2.95Å
117	K	54.4	Low	66.9	Low	200 Å²	200	97 Å²	97	87%	0.87	51%	0.51	S	S	*	.			trans	-68.1	115.5	160.6	-73.2	-174.5	175.6	-179.5	0	109.1	A115 L119	A115-K117 PolarHBondContact O-N 2.61Å; K117-L119 PolarHBondContact O-N 3.15Å
118	S	50.5	Low	66.4	Low	100 Å²	100	101.9 Å²	101.9	70%	0.699	53%	0.532	S	S	*	.			trans	-57.2	132.1	-171.2	-175.9	0	0	0	0	113.4	R116	R116-S118 PolarHBondContact O-N 2.95Å
119	L	41.4	Very low	66.1	Low	154 Å²	154	103 Å²	103	81%	0.806	53%	0.534	S	S	*	.			trans	-153.9	123.4	163.8	-144.7	148.6	0	0	0	108.8	K117	K117-L119 PolarHBondContact O-N 3.15Å
120	L	44.8	Very low	65.9	Low	145 Å²	145	103 Å²	103	76%	0.759	53%	0.531	S	S	*	.	S	Bend	trans	73	135.2	-166.6	-54.9	175	0	0	0	115.2	L122	L120-L122 PolarHBondContact O-N 3.49Å
121	A	48.5	Very low	65.8	Low	105 Å²	105	103.9 Å²	103.9	87%	0.868	54%	0.537	S	S	*	.			trans	-80	114.8	176.4	0	0	0	0	0	110.1
122	L	43.1	Very low	65.9	Low	117 Å²	117	106.7 Å²	106.7	61%	0.613	55%	0.546	S	S	*	.			trans	-118.2	119.6	172.3	-74.1	170.3	0	0	0	110.1	L120	L120-L122 PolarHBondContact O-N 3.49Å
123	E	55.3	Low	66.1	Low	148 Å²	148	105.8 Å²	105.8	69%	0.692	54%	0.539	S	S	*	.			trans	23.3	122.6	156.5	-66.8	168.5	168.1	0	0	119.1	E125 E126	E123-E125 PolarHBondContact O-N 2.83Å; E123-E126 PolarHBondContact O-N 3.13Å
124	K	58.1	Low	66.5	Low	178 Å²	178	105.1 Å²	105.1	77%	0.774	54%	0.536	S	S	*	.	H	α-helix	trans	-56.5	-19.2	178.6	-69.3	-179.4	174.9	178.8	0	114.8	E127 E128	K124-E127 PolarHBondContact O-N 3.01Å; K124-E128 PolarHBondContact O-N 2.88Å; K124-E128 VanDerWaalsContact O-N 3.09Å
125	E	54.4	Low	67	Low	162 Å²	162	107.7 Å²	107.7	76%	0.757	54%	0.544	S	S	*	.	H	α-helix	trans	-64.9	-37.4	175.3	-69.4	-170.9	109.8	0	0	111.9	E123 E127 E128 E129	E123-E125 PolarHBondContact O-N 2.83Å; E125-E127 PolarHBondContact O-N 2.86Å; E125-E128 PolarHBondContact O-N 2.67Å; E125-E129 PolarHBondContact O-N 3.46Å
126	E	70.1	Confident	67.8	Low	77 Å²	77	106.1 Å²	106.1	36%	0.36	53%	0.528	S	S	.	.	H	α-helix	trans	-64.3	-40.5	173.4	-76.6	-157.1	178.3	0	0	111.6	E123 E128 E129 R130	E123-E126 PolarHBondContact O-N 3.13Å; E126-E128 VanDerWaalsContact C-N 3.31Å; E126-E128 PolarHBondContact O-N 3.11Å; E126-E129 PolarHBondContact O-N 3.37Å; E126-R130 WeakPolarHBondContact O-CB 3.44Å; E126-R130 WeakPolarHBondContact O-CG 3.34Å; E126-R130 PolarHBondContact O-N 2.98Å; E126-R130 PolarHBondContact O-NE 2.98Å; E126-R130 IonicContact OE2-CZ 2.7Å; E126-R130 IonicContact OE2-NE 2.72Å; E126-R130 IonicContact OE2-NH2 3.22Å; E126-R130 PolarHBondContact OE2-NH2 3.07Å
127	E	70.1	Confident	68.9	Low	81 Å²	81	99.1 Å²	99.1	38%	0.379	50%	0.502	S	S	.	.	H	α-helix	trans	-63.4	-39.5	178.3	-162.7	-157.6	148.6	0	0	111.1	K124 E125 S131 S175 I177	K124-E127 PolarHBondContact O-N 3.01Å; E125-E127 PolarHBondContact O-N 2.86Å; E127-S131 WeakPolarHBondContact O-CB 3.31Å; E127-S131 PolarHBondContact O-N 3.06Å; E127-S175 WeakPolarHBondContact OE1-CB 3.44Å; E127-I177 HydrophobicContact CG-CD1 4.27Å
128	E	76.7	Confident	70.6	Confident	117 Å²	117	92.1 Å²	92.1	55%	0.547	47%	0.472	S	S	.	.	H	α-helix	trans	-69.8	-34.8	177	-153.4	-176.6	118.3	0	0	112.2	K124 E125 E126 S131 K132	K124-E128 PolarHBondContact O-N 2.88Å; K124-E128 VanDerWaalsContact O-N 3.09Å; E125-E128 PolarHBondContact O-N 2.67Å; E126-E128 VanDerWaalsContact C-N 3.31Å; E126-E128 PolarHBondContact O-N 3.11Å; E128-S131 PolarHBondContact O-N 3.05Å; E128-K132 WeakPolarHBondContact O-CB 3.29Å; E128-K132 WeakPolarHBondContact O-CD 3.43Å; E128-K132 WeakPolarHBondContact O-CG 3.24Å; E128-K132 PolarHBondContact O-N 3.47Å; E128-K132 WeakPolarHBondContact OE1-CE 3.44Å; E128-K132 IonicContact OE1-NZ 3.26Å; E128-K132 PolarHBondContact OE1-NZ 2.92Å
129	E	79.4	Confident	72.5	Confident	133 Å²	133	90.1 Å²	90.1	62%	0.621	46%	0.455	S	S	*	.	H	α-helix	trans	-69.6	-42.7	173.5	-173.6	167.1	-137.6	0	0	112.6	E125 E126 S131 K132 T133	E125-E129 PolarHBondContact O-N 3.46Å; E126-E129 PolarHBondContact O-N 3.37Å; E129-S131 VanDerWaalsContact C-N 3.32Å; E129-S131 PolarHBondContact O-N 3.35Å; E129-K132 PolarHBondContact O-N 3.23Å; E129-T133 PolarHBondContact O-N 3.1Å; E129-T133 PolarHBondContact O-OG1 3.41Å
130	R	81.6	Confident	74.6	Confident	70 Å²	70	83 Å²	83	26%	0.264	42%	0.418	S	S	.	.	H	α-helix	trans	-56.6	-46.4	170.1	-70.4	177.1	-126.3	139.3	-5.3	110.7	M113 E126 T133 I134 I177	M113-R130 HydrophobicContact CG-CG 4.28Å; M113-R130 HydrophobicContact SD-CB 3.75Å; M113-R130 HydrophobicContact SD-CG 3.77Å; E126-R130 WeakPolarHBondContact O-CB 3.44Å; E126-R130 WeakPolarHBondContact O-CG 3.34Å; E126-R130 PolarHBondContact O-N 2.98Å; E126-R130 PolarHBondContact O-NE 2.98Å; E126-R130 IonicContact OE2-CZ 2.7Å; E126-R130 IonicContact OE2-NE 2.72Å; E126-R130 IonicContact OE2-NH2 3.22Å; E126-R130 PolarHBondContact OE2-NH2 3.07Å; R130-T133 PolarHBondContact O-N 3.19Å; R130-I134 WeakPolarHBondContact O-CG1 3.25Å; R130-I134 PolarHBondContact O-N 3.5Å; R130-I177 HydrophobicContact CB-CD1 4.03Å
131	S	85.1	Confident	76.7	Confident	20 Å²	20	76.3 Å²	76.3	14%	0.14	38%	0.383	C	S	.	.	H	α-helix	trans	-64	-40.5	176.7	-173.3	0	0	0	0	112.9	E127 E128 E129 T133 I134 E135	E127-S131 WeakPolarHBondContact O-CB 3.31Å; E127-S131 PolarHBondContact O-N 3.06Å; E128-S131 PolarHBondContact O-N 3.05Å; E129-S131 VanDerWaalsContact C-N 3.32Å; E129-S131 PolarHBondContact O-N 3.35Å; S131-T133 VanDerWaalsContact C-N 3.35Å; S131-I134 PolarHBondContact O-N 2.89Å; S131-E135 WeakPolarHBondContact O-CB 3.26Å; S131-E135 PolarHBondContact O-N 3.48Å
132	K	87	Confident	78.4	Confident	121 Å²	121	78.6 Å²	78.6	53%	0.526	37%	0.37	S	S	.	.	H	α-helix	trans	-63.2	-40.1	174.9	-76.5	160.3	-174.5	156.2	0	111.7	E128 E129 I134 E135 S136	E128-K132 WeakPolarHBondContact O-CB 3.29Å; E128-K132 WeakPolarHBondContact O-CD 3.43Å; E128-K132 WeakPolarHBondContact O-CG 3.24Å; E128-K132 PolarHBondContact O-N 3.47Å; E128-K132 WeakPolarHBondContact OE1-CE 3.44Å; E128-K132 IonicContact OE1-NZ 3.26Å; E128-K132 PolarHBondContact OE1-NZ 2.92Å; E129-K132 PolarHBondContact O-N 3.23Å; K132-I134 PolarHBondContact O-N 3.42Å; K132-E135 PolarHBondContact O-N 2.87Å; K132-S136 WeakPolarHBondContact O-CB 3.43Å; K132-S136 PolarHBondContact O-N 2.87Å
133	T	88.1	Confident	80.3	Confident	32 Å²	32	77.4 Å²	77.4	20%	0.196	37%	0.367	C	S	.	.	H	α-helix	trans	-62.7	-43.1	179.2	-58.7	0	0	0	0	111.7	Q109 E129 R130 S131 S136 L137	Q109-T133 HydrophobicContact CB-CG2 4.12Å; Q109-T133 HydrophobicContact CG-CG2 4.27Å; E129-T133 PolarHBondContact O-N 3.1Å; E129-T133 PolarHBondContact O-OG1 3.41Å; R130-T133 PolarHBondContact O-N 3.19Å; S131-T133 VanDerWaalsContact C-N 3.35Å; T133-S136 WeakPolarHBondContact O-CB 3.44Å; T133-S136 PolarHBondContact O-N 3.12Å; T133-L137 PolarHBondContact O-N 3.23Å
134	I	89.2	Confident	81.5	Confident	2 Å²	2	72.4 Å²	72.4	1%	0.01	34%	0.344	C	S	.	.	H	α-helix	trans	-75.1	-35.3	179.2	-61	169.3	0	0	0	111.5	L110 M113 R130 S131 K132 S136 L137 K138 F164 I177 L181	L110-I134 HydrophobicContact CD2-CG1 4.47Å; M113-I134 HydrophobicContact CE-CD1 3.85Å; M113-I134 HydrophobicContact CE-CG1 3.8Å; M113-I134 HydrophobicContact SD-CD1 3.99Å; M113-I134 HydrophobicContact SD-CG1 4.43Å; R130-I134 WeakPolarHBondContact O-CG1 3.25Å; R130-I134 PolarHBondContact O-N 3.5Å; S131-I134 PolarHBondContact O-N 2.89Å; K132-I134 PolarHBondContact O-N 3.42Å; I134-S136 VanDerWaalsContact C-N 3.29Å; I134-S136 PolarHBondContact O-N 2.82Å; I134-L137 WeakPolarHBondContact O-CB 3.36Å; I134-L137 PolarHBondContact O-N 2.95Å; I134-K138 PolarHBondContact O-N 3.36Å; I134-F164 HydrophobicContact CD1-CE1 3.95Å; I134-I177 HydrophobicContact CD1-CB 4.41Å; I134-I177 HydrophobicContact CD1-CG1 4.35Å; I134-I177 HydrophobicContact CD1-CG2 3.54Å; I134-L181 HydrophobicContact CD1-CD2 4.19Å; I134-L181 HydrophobicContact CD1-CG 4.38Å; I134-L181 HydrophobicContact CG2-CD2 3.84Å; I134-L181 HydrophobicContact CG2-CG 4.06Å
135	E	88.6	Confident	82.4	Confident	72 Å²	72	66.4 Å²	66.4	34%	0.336	32%	0.322	S	S	.	.	H	α-helix	trans	-66.2	-32.7	172.2	-168.9	68.2	-177	0	0	112	S131 K132 K138 T139 S180	S131-E135 WeakPolarHBondContact O-CB 3.26Å; S131-E135 PolarHBondContact O-N 3.48Å; K132-E135 PolarHBondContact O-N 2.87Å; E135-K138 WeakPolarHBondContact OE1-CE 3.16Å; E135-K138 IonicContact OE1-NZ 3.41Å; E135-K138 PolarHBondContact OE1-NZ 3.04Å; E135-K138 WeakPolarHBondContact OE2-CE 3.26Å; E135-K138 IonicContact OE2-NZ 2.8Å; E135-K138 PolarHBondContact OE2-NZ 3.16Å; E135-T139 WeakPolarHBondContact O-CB 3.41Å; E135-T139 PolarHBondContact O-N 2.93Å; E135-T139 PolarHBondContact O-OG1 3.03Å; E135-S180 PolarHBondContact OE2-OG 3.07Å
136	S	89.3	Confident	83.5	Confident	46 Å²	46	59.8 Å²	59.8	32%	0.322	29%	0.292	S	S	.	.	H	α-helix	trans	-66.2	-43.1	169.8	-170.8	0	0	0	0	111.6	Y106 K132 T133 I134 T139 A140	Y106-S136 PolarHBondContact OH-OG 3.43Å; K132-S136 WeakPolarHBondContact O-CB 3.43Å; K132-S136 PolarHBondContact O-N 2.87Å; T133-S136 WeakPolarHBondContact O-CB 3.44Å; T133-S136 PolarHBondContact O-N 3.12Å; I134-S136 VanDerWaalsContact C-N 3.29Å; I134-S136 PolarHBondContact O-N 2.82Å; S136-T139 PolarHBondContact O-N 3.27Å; S136-A140 WeakPolarHBondContact O-CB 3.26Å; S136-A140 PolarHBondContact O-N 2.9Å
137	L	91.1	Very high	84	Confident	1 Å²	1	62.2 Å²	62.2	1%	0.005	30%	0.298	C	S	.	.	H	α-helix	trans	-59.4	-48.3	172.8	174.4	59	0	0	0	111.5	Y106 L110 T133 I134 T139 A140 L141 F152 I161	Y106-L137 HydrophobicContact CD1-CB 3.65Å; Y106-L137 HydrophobicContact CD1-CD1 4.24Å; Y106-L137 HydrophobicContact CD1-CG 4.43Å; Y106-L137 HydrophobicContact CD2-CD1 4.09Å; Y106-L137 HydrophobicContact CE1-CB 4Å; Y106-L137 HydrophobicContact CG-CB 4.11Å; Y106-L137 HydrophobicContact CG-CD1 3.8Å; Y106-L137 HydrophobicContact CG-CG 4.42Å; L110-L137 HydrophobicContact CD1-CD2 3.69Å; L110-L137 HydrophobicContact CD2-CD2 4.48Å; L110-L137 HydrophobicContact CG-CD2 4.28Å; T133-L137 PolarHBondContact O-N 3.23Å; I134-L137 WeakPolarHBondContact O-CB 3.36Å; I134-L137 PolarHBondContact O-N 2.95Å; L137-T139 PolarHBondContact O-N 2.87Å; L137-A140 PolarHBondContact O-N 3.44Å; L137-A140 VanDerWaalsContact O-N 3.12Å; L137-L141 HydrophobicContact CD1-CD1 3.81Å; L137-L141 HydrophobicContact CD1-CD2 4.39Å; L137-L141 HydrophobicContact CD1-CG 3.78Å; L137-L141 HydrophobicContact CG-CD1 3.86Å; L137-L141 HydrophobicContact CG-CG 4.29Å; L137-L141 WeakPolarHBondContact O-CG 3.43Å; L137-L141 PolarHBondContact O-N 3.17Å; L137-F152 HydrophobicContact CD1-CD2 4.38Å; L137-F152 HydrophobicContact CD1-CE2 3.92Å; L137-F152 HydrophobicContact CD1-CZ 4.45Å; L137-F152 HydrophobicContact CD2-CE2 4.3Å; L137-F152 HydrophobicContact CD2-CZ 4.36Å; L137-I161 HydrophobicContact CD2-CD1 4.42Å
138	K	91.3	Very high	84.8	Confident	54 Å²	54	59 Å²	59	24%	0.235	28%	0.283	C	S	.	.	H	α-helix	trans	-55.8	-40.7	176.5	-173.5	-177.7	77	-162.9	0	111.8	I134 E135 G183 A187	I134-K138 PolarHBondContact O-N 3.36Å; E135-K138 WeakPolarHBondContact OE1-CE 3.16Å; E135-K138 IonicContact OE1-NZ 3.41Å; E135-K138 PolarHBondContact OE1-NZ 3.04Å; E135-K138 WeakPolarHBondContact OE2-CE 3.26Å; E135-K138 IonicContact OE2-NZ 2.8Å; E135-K138 PolarHBondContact OE2-NZ 3.16Å; K138-G183 WeakPolarHBondContact CG-O 3.12Å; K138-A187 HydrophobicContact CG-CB 4.33Å
139	T	88.9	Confident	85.2	Confident	57 Å²	57	53.7 Å²	53.7	35%	0.35	26%	0.258	S	S	.	.	H	α-helix	trans	-67.4	-47.4	177.1	-56.6	0	0	0	0	110.5	E135 S136 L137 L141 R142 T143	E135-T139 WeakPolarHBondContact O-CB 3.41Å; E135-T139 PolarHBondContact O-N 2.93Å; E135-T139 PolarHBondContact O-OG1 3.03Å; S136-T139 PolarHBondContact O-N 3.27Å; L137-T139 PolarHBondContact O-N 2.87Å; T139-L141 PolarHBondContact O-N 2.84Å; T139-R142 PolarHBondContact O-N 2.58Å; T139-T143 HydrophobicContact CG2-CG2 4.41Å; T139-T143 PolarHBondContact O-N 3.18Å; T139-T143 PolarHBondContact O-OG1 3.43Å; T139-T143 VanDerWaalsContact O-OG1 3.05Å
140	A	86.3	Confident	85.4	Confident	4 Å²	4	49.1 Å²	49.1	3%	0.033	24%	0.239	C	C	.	.	H	α-helix	trans	-60.1	-45.3	179.7	0	0	0	0	0	112.7	Y106 S136 L137 R142 T143 K144 F148	Y106-A140 HydrophobicContact CE2-CB 4.18Å; S136-A140 WeakPolarHBondContact O-CB 3.26Å; S136-A140 PolarHBondContact O-N 2.9Å; L137-A140 PolarHBondContact O-N 3.44Å; L137-A140 VanDerWaalsContact O-N 3.12Å; A140-R142 PolarHBondContact O-N 3.47Å; A140-T143 PolarHBondContact O-N 3.13Å; A140-K144 HydrophobicContact CB-CG 3.95Å; A140-K144 VanDerWaalsContact O-CB 3.3Å; A140-K144 WeakPolarHBondContact O-CB 3.39Å; A140-K144 WeakPolarHBondContact O-CG 3.48Å; A140-K144 PolarHBondContact O-N 2.87Å; A140-F148 HydrophobicContact CB-CE1 3.89Å; A140-F148 HydrophobicContact CB-CE2 4.47Å; A140-F148 HydrophobicContact CB-CZ 3.75Å
141	L	87.9	Confident	85.7	Confident	5 Å²	5	50.8 Å²	50.8	3%	0.026	25%	0.246	C	C	.	.	H	α-helix	trans	-60.2	-16.1	175.3	-72.6	170	0	0	0	114	L137 T139 F148 F152 C184 A187	L137-L141 HydrophobicContact CD1-CD1 3.81Å; L137-L141 HydrophobicContact CD1-CD2 4.39Å; L137-L141 HydrophobicContact CD1-CG 3.78Å; L137-L141 HydrophobicContact CG-CD1 3.86Å; L137-L141 HydrophobicContact CG-CG 4.29Å; L137-L141 WeakPolarHBondContact O-CG 3.43Å; L137-L141 PolarHBondContact O-N 3.17Å; T139-L141 PolarHBondContact O-N 2.84Å; L141-F148 HydrophobicContact CD2-CE1 4.08Å; L141-F148 HydrophobicContact CG-CE1 4.44Å; L141-F152 HydrophobicContact CD1-CE1 4.44Å; L141-F152 HydrophobicContact CD2-CB 4.33Å; L141-F152 HydrophobicContact CD2-CD1 3.75Å; L141-F152 HydrophobicContact CD2-CD2 4.4Å; L141-F152 HydrophobicContact CD2-CE1 4.13Å; L141-F152 HydrophobicContact CD2-CG 3.9Å; L141-C184 HydrophobicContact CD1-CB 3.84Å; L141-A187 HydrophobicContact CB-CB 3.99Å
142	R	85.3	Confident	85.9	Confident	153 Å²	153	49.9 Å²	49.9	58%	0.577	24%	0.239	S	C	*	.	H	α-helix	trans	-106.6	-22.4	178.5	-167.6	179.1	63.2	154.3	2.3	113.8	T139 A140 A187	T139-R142 PolarHBondContact O-N 2.58Å; A140-R142 PolarHBondContact O-N 3.47Å; R142-A187 HydrophobicContact CB-CB 4.18Å
143	T	82	Confident	86.1	Confident	92 Å²	92	45 Å²	45	56%	0.564	22%	0.219	S	C	*	.	H	α-helix	trans	-127	-7.3	-170.3	68.5	0	0	0	0	115.7	T139 A140	T139-T143 HydrophobicContact CG2-CG2 4.41Å; T139-T143 PolarHBondContact O-N 3.18Å; T139-T143 PolarHBondContact O-OG1 3.43Å; T139-T143 VanDerWaalsContact O-OG1 3.05Å; A140-T143 PolarHBondContact O-N 3.13Å
144	K	82	Confident	86.1	Confident	44 Å²	44	48.7 Å²	48.7	19%	0.191	24%	0.237	C	C	.	.	S	Bend	trans	-83.5	156.7	169.1	-65.2	-71.6	-175.1	170.1	0	110.2	N96 A140 F148	N96-K144 PolarHBondContact OD1-NZ 2.87Å; A140-K144 HydrophobicContact CB-CG 3.95Å; A140-K144 VanDerWaalsContact O-CB 3.3Å; A140-K144 WeakPolarHBondContact O-CB 3.39Å; A140-K144 WeakPolarHBondContact O-CG 3.48Å; A140-K144 PolarHBondContact O-N 2.87Å; K144-F148 HydrophobicContact CB-CB 3.63Å; K144-F148 HydrophobicContact CB-CD1 3.98Å; K144-F148 HydrophobicContact CB-CD2 4.1Å; K144-F148 HydrophobicContact CB-CG 3.64Å; K144-F148 HydrophobicContact CG-CD1 4.41Å; K144-F148 HydrophobicContact CG-CD2 4.1Å; K144-F148 HydrophobicContact CG-CE2 4.42Å; K144-F148 HydrophobicContact CG-CG 4.1Å
145	P	76.3	Confident	86.1	Confident	51 Å²	51	51.2 Å²	51.2	33%	0.331	25%	0.25	S	S	.	.			trans	-59.5	159.6	179.6	-22.8	33.9	0	0	0	113	R147 F148	P145-R147 PolarHBondContact O-N 3.45Å; P145-F148 WeakPolarHBondContact O-CB 3.49Å; P145-F148 PolarHBondContact O-N 2.87Å
146	M	77.5	Confident	86.2	Confident	24 Å²	24	52.3 Å²	52.3	12%	0.118	26%	0.258	C	S	.	.	H	α-helix	trans	-44.8	-43.2	178.2	173.1	62.4	77.7	0	0	113	E63 D65 F148 V149 T150 N191 Q193	E63-M146 VanDerWaalsContact O-CB 3.25Å; E63-M146 WeakPolarHBondContact O-CB 3.42Å; D65-M146 HydrophobicContact CB-CE 3.61Å; D65-M146 VanDerWaalsContact CG-CE 3.49Å; M146-F148 PolarHBondContact O-N 3.3Å; M146-F148 VanDerWaalsContact O-N 3.07Å; M146-V149 WeakPolarHBondContact O-CA 3.36Å; M146-V149 WeakPolarHBondContact O-CB 3.35Å; M146-V149 PolarHBondContact O-N 3.29Å; M146-T150 PolarHBondContact O-N 3.39Å; M146-T150 PolarHBondContact O-OG1 3.26Å; M146-N191 WeakPolarHBondContact CE-ND2 3.47Å; M146-N191 WeakPolarHBondContact CE-OD1 3.36Å; M146-Q193 HydrophobicContact CE-CG 4.3Å; M146-Q193 HydrophobicContact SD-CG 4.23Å
147	R	79.9	Confident	86.3	Confident	128 Å²	128	50.1 Å²	50.1	48%	0.483	24%	0.243	S	C	.	.	H	α-helix	trans	-52.7	-31.3	178.5	-73.6	-178.8	164.2	150.9	-13.2	113.9	E59 E63 P145 R151	E59-R147 VanDerWaalsContact CD-NH2 3.33Å; E59-R147 IonicContact OE1-NH2 2.67Å; E59-R147 IonicContact OE2-CZ 3.87Å; E59-R147 IonicContact OE2-NH1 3.76Å; E59-R147 IonicContact OE2-NH2 2.67Å; E59-R147 PolarHBondContact OE2-NH2 3.38Å; E63-R147 HydrophobicContact CG-CG 4.09Å; E63-R147 VanDerWaalsContact OE1-CD 3.3Å; E63-R147 WeakPolarHBondContact OE1-CD 3.31Å; E63-R147 IonicContact OE1-CZ 2.96Å; E63-R147 IonicContact OE1-NE 2.62Å; E63-R147 IonicContact OE1-NH1 2.69Å; E63-R147 PolarHBondContact OE1-NH1 2.8Å; P145-R147 PolarHBondContact O-N 3.45Å; R147-R151 WeakPolarHBondContact O-CB 3.31Å; R147-R151 PolarHBondContact O-N 2.97Å; R147-R151 VanDerWaalsContact O-N 3.1Å
148	F	86.8	Confident	86.4	Confident	13 Å²	13	50 Å²	50	6%	0.057	24%	0.243	C	C	.	.	H	α-helix	trans	-69.3	-42.8	172.4	-179.1	-84.7	0	0	0	111.9	S101 P103 Y106 A140 L141 K144 P145 M146 F152	S101-F148 VanDerWaalsContact O-CD2 3.32Å; S101-F148 WeakPolarHBondContact O-CD2 3.44Å; P103-F148 HydrophobicContact CB-CE2 4.46Å; P103-F148 HydrophobicContact CG-CD1 4.37Å; P103-F148 HydrophobicContact CG-CD2 3.65Å; P103-F148 HydrophobicContact CG-CE1 4.45Å; P103-F148 HydrophobicContact CG-CE2 3.76Å; P103-F148 HydrophobicContact CG-CG 3.97Å; P103-F148 HydrophobicContact CG-CZ 4.16Å; P103-F148 VanDerWaalsContact CG-O 3.29Å; P103-F148 WeakPolarHBondContact CG-O 3.28Å; Y106-F148 HydrophobicContact CD2-CE2 4.4Å; Y106-F148 AromaticContact CD2-CZ 3.9Å; Y106-F148 HydrophobicContact CD2-CZ 3.9Å; Y106-F148 HydrophobicContact CE2-CE2 4.24Å; Y106-F148 AromaticContact CE2-CZ 3.88Å; Y106-F148 HydrophobicContact CE2-CZ 3.88Å; A140-F148 HydrophobicContact CB-CE1 3.89Å; A140-F148 HydrophobicContact CB-CE2 4.47Å; A140-F148 HydrophobicContact CB-CZ 3.75Å; L141-F148 HydrophobicContact CD2-CE1 4.08Å; L141-F148 HydrophobicContact CG-CE1 4.44Å; K144-F148 HydrophobicContact CB-CB 3.63Å; K144-F148 HydrophobicContact CB-CD1 3.98Å; K144-F148 HydrophobicContact CB-CD2 4.1Å; K144-F148 HydrophobicContact CB-CG 3.64Å; K144-F148 HydrophobicContact CG-CD1 4.41Å; K144-F148 HydrophobicContact CG-CD2 4.1Å; K144-F148 HydrophobicContact CG-CE2 4.42Å; K144-F148 HydrophobicContact CG-CG 4.1Å; P145-F148 WeakPolarHBondContact O-CB 3.49Å; P145-F148 PolarHBondContact O-N 2.87Å; M146-F148 PolarHBondContact O-N 3.3Å; M146-F148 VanDerWaalsContact O-N 3.07Å; F148-F152 VanDerWaalsContact O-CB 3.31Å; F148-F152 WeakPolarHBondContact O-CB 3.45Å; F148-F152 PolarHBondContact O-N 2.74Å
149	V	85.3	Confident	86.4	Confident	5 Å²	5	49 Å²	49	3%	0.03	24%	0.242	C	C	.	.	H	α-helix	trans	-70.3	-46.7	-178.5	-178.9	0	0	0	0	110.8	M146 F152 I153 L188	M146-V149 WeakPolarHBondContact O-CA 3.36Å; M146-V149 WeakPolarHBondContact O-CB 3.35Å; M146-V149 PolarHBondContact O-N 3.29Å; V149-F152 PolarHBondContact O-N 3.18Å; V149-I153 HydrophobicContact CG1-CD1 4.17Å; V149-I153 WeakPolarHBondContact O-CG1 3.21Å; V149-I153 PolarHBondContact O-N 2.73Å; V149-L188 HydrophobicContact CG1-CD1 3.66Å
150	T	83.9	Confident	86.6	Confident	37 Å²	37	47 Å²	47	23%	0.227	23%	0.231	C	C	.	.	H	α-helix	trans	-58.3	-49.3	173.3	-43.5	0	0	0	0	110.6	M146 F152 I153 D154	M146-T150 PolarHBondContact O-N 3.39Å; M146-T150 PolarHBondContact O-OG1 3.26Å; T150-F152 VanDerWaalsContact C-N 3.3Å; T150-F152 PolarHBondContact O-N 2.84Å; T150-I153 CarbonylContact O-C 3.6Å; T150-I153 WeakPolarHBondContact O-CA 3.31Å; T150-I153 WeakPolarHBondContact O-CB 3.49Å; T150-I153 PolarHBondContact O-N 3.38Å; T150-D154 PolarHBondContact O-N 2.94Å
151	R	86.9	Confident	87	Confident	106 Å²	106	46.9 Å²	46.9	40%	0.4	23%	0.229	S	C	.	.	H	α-helix	trans	-62.4	-33.2	178.3	-179.7	60.1	174.7	172.7	3.4	113.4	P103 E104 R147 L155	P103-R151 HydrophobicContact CB-CG 4.41Å; P103-R151 HydrophobicContact CG-CB 4.02Å; P103-R151 HydrophobicContact CG-CG 3.87Å; E104-R151 IonicContact OE1-CZ 3.13Å; E104-R151 IonicContact OE1-NE 2.71Å; E104-R151 PolarHBondContact OE1-NE 3.4Å; E104-R151 IonicContact OE1-NH2 3.01Å; E104-R151 PolarHBondContact OE1-NH2 2.82Å; R147-R151 WeakPolarHBondContact O-CB 3.31Å; R147-R151 PolarHBondContact O-N 2.97Å; R147-R151 VanDerWaalsContact O-N 3.1Å; R151-L155 HydrophobicContact CG-CD1 4.12Å; R151-L155 WeakPolarHBondContact O-CB 3.19Å; R151-L155 WeakPolarHBondContact O-CD1 3.27Å; R151-L155 VanDerWaalsContact O-CG 3.24Å; R151-L155 WeakPolarHBondContact O-CG 3.45Å; R151-L155 PolarHBondContact O-N 2.99Å
152	F	91.1	Very high	87.3	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-68.6	-33.8	172.9	-177.5	-93.3	0	0	0	112.3	P103 I107 L137 L141 F148 V149 T150 G157 I161	P103-F152 HydrophobicContact CB-CB 3.93Å; P103-F152 HydrophobicContact CB-CD2 4.11Å; P103-F152 HydrophobicContact CG-CB 4.22Å; I107-F152 HydrophobicContact CD1-CD2 3.93Å; I107-F152 HydrophobicContact CD1-CE2 4.17Å; I107-F152 HydrophobicContact CG1-CD2 3.95Å; I107-F152 HydrophobicContact CG1-CE2 3.72Å; L137-F152 HydrophobicContact CD1-CD2 4.38Å; L137-F152 HydrophobicContact CD1-CE2 3.92Å; L137-F152 HydrophobicContact CD1-CZ 4.45Å; L137-F152 HydrophobicContact CD2-CE2 4.3Å; L137-F152 HydrophobicContact CD2-CZ 4.36Å; L141-F152 HydrophobicContact CD1-CE1 4.44Å; L141-F152 HydrophobicContact CD2-CB 4.33Å; L141-F152 HydrophobicContact CD2-CD1 3.75Å; L141-F152 HydrophobicContact CD2-CD2 4.4Å; L141-F152 HydrophobicContact CD2-CE1 4.13Å; L141-F152 HydrophobicContact CD2-CG 3.9Å; F148-F152 VanDerWaalsContact O-CB 3.31Å; F148-F152 WeakPolarHBondContact O-CB 3.45Å; F148-F152 PolarHBondContact O-N 2.74Å; V149-F152 PolarHBondContact O-N 3.18Å; T150-F152 VanDerWaalsContact C-N 3.3Å; T150-F152 PolarHBondContact O-N 2.84Å; F152-G157 VanDerWaalsContact CZ-O 3.28Å; F152-G157 WeakPolarHBondContact CZ-O 3.23Å; F152-G157 WeakPolarHBondContact O-CA 3.41Å; F152-G157 PolarHBondContact O-N 3.27Å; F152-I161 HydrophobicContact CE1-CD1 3.98Å; F152-I161 HydrophobicContact CZ-CD1 3.67Å; F152-I161 HydrophobicContact CZ-CG1 4.26Å
153	I	89.6	Confident	87.6	Confident	20 Å²	20	43.2 Å²	43.2	10%	0.103	22%	0.221	C	C	.	.	H	α-helix	trans	-70.3	-48.5	173.7	-68.2	162.8	0	0	0	110.6	V149 T150 L155 D156 L188 Q193 H197	V149-I153 HydrophobicContact CG1-CD1 4.17Å; V149-I153 WeakPolarHBondContact O-CG1 3.21Å; V149-I153 PolarHBondContact O-N 2.73Å; T150-I153 CarbonylContact O-C 3.6Å; T150-I153 WeakPolarHBondContact O-CA 3.31Å; T150-I153 WeakPolarHBondContact O-CB 3.49Å; T150-I153 PolarHBondContact O-N 3.38Å; I153-L155 PolarHBondContact O-N 2.82Å; I153-L155 VanDerWaalsContact O-N 3.09Å; I153-D156 PolarHBondContact O-N 2.59Å; I153-L188 HydrophobicContact CD1-CD1 4.1Å; I153-L188 HydrophobicContact CG1-CD1 4.11Å; I153-Q193 HydrophobicContact CD1-CB 4.45Å; I153-H197 HydrophobicContact CD1-CB 4.32Å; I153-H197 HydrophobicContact CG2-CB 4.17Å
154	D	89.5	Confident	88	Confident	109 Å²	109	39.4 Å²	39.4	58%	0.583	20%	0.197	S	C	*	.	H	α-helix	trans	-59.6	-21.7	179.9	-62.8	-29.5	0	0	0	113.7	T150	T150-D154 PolarHBondContact O-N 2.94Å
155	L	89.4	Confident	88.5	Confident	54 Å²	54	38 Å²	38	28%	0.283	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.3	19.2	178.8	-68.3	174.1	0	0	0	113.4	P103 E104 I107 R151 I153 G157	P103-L155 HydrophobicContact CB-CD1 4.39Å; E104-L155 HydrophobicContact CG-CD1 3.72Å; E104-L155 WeakPolarHBondContact OE1-CD1 3.49Å; I107-L155 HydrophobicContact CD1-CB 3.51Å; I107-L155 HydrophobicContact CD1-CD1 4.11Å; R151-L155 HydrophobicContact CG-CD1 4.12Å; R151-L155 WeakPolarHBondContact O-CB 3.19Å; R151-L155 WeakPolarHBondContact O-CD1 3.27Å; R151-L155 VanDerWaalsContact O-CG 3.24Å; R151-L155 WeakPolarHBondContact O-CG 3.45Å; R151-L155 PolarHBondContact O-N 2.99Å; I153-L155 PolarHBondContact O-N 2.82Å; I153-L155 VanDerWaalsContact O-N 3.09Å; L155-G157 PolarHBondContact O-N 3.11Å; L155-G157 VanDerWaalsContact O-N 3.12Å
156	D	89.8	Confident	89.2	Confident	95 Å²	95	39.7 Å²	39.7	51%	0.508	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.8	23.3	179.9	-103.3	-55.5	0	0	0	113.9	I153 L158 S159 C160	I153-D156 PolarHBondContact O-N 2.59Å; D156-L158 PolarHBondContact O-N 3.06Å; D156-L158 VanDerWaalsContact O-N 3.16Å; D156-S159 WeakPolarHBondContact O-CA 3.17Å; D156-S159 WeakPolarHBondContact O-CB 3.42Å; D156-S159 PolarHBondContact O-N 3.3Å; D156-S159 VanDerWaalsContact OD1-CB 3.31Å; D156-S159 WeakPolarHBondContact OD1-CB 3.32Å; D156-S159 PolarHBondContact OD1-OG 2.82Å; D156-C160 PolarHBondContact O-N 2.95Å
157	G	91.6	Very high	89.8	Confident	0 Å²	0	42 Å²	42	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-61.3	-29.4	-175	0	0	0	0	0	114	F152 L155 C160 I161	F152-G157 VanDerWaalsContact CZ-O 3.28Å; F152-G157 WeakPolarHBondContact CZ-O 3.23Å; F152-G157 WeakPolarHBondContact O-CA 3.41Å; F152-G157 PolarHBondContact O-N 3.27Å; L155-G157 PolarHBondContact O-N 3.11Å; L155-G157 VanDerWaalsContact O-N 3.12Å; G157-C160 PolarHBondContact O-N 3.22Å; G157-I161 WeakPolarHBondContact O-CG1 3.47Å; G157-I161 PolarHBondContact O-N 2.9Å; G157-I161 VanDerWaalsContact O-N 3.14Å
158	L	93.1	Very high	90.1	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-62.7	-46.2	168.8	174.3	61.3	0	0	0	111.1	D156 C160 I161 L162 I185 L188 H197 V198 H201	D156-L158 PolarHBondContact O-N 3.06Å; D156-L158 VanDerWaalsContact O-N 3.16Å; L158-C160 VanDerWaalsContact C-N 3.28Å; L158-C160 PolarHBondContact O-N 3.2Å; L158-I161 PolarHBondContact O-N 3.37Å; L158-I161 VanDerWaalsContact O-N 3.13Å; L158-L162 HydrophobicContact CD1-CD1 4.03Å; L158-L162 HydrophobicContact CD1-CD2 4.44Å; L158-L162 HydrophobicContact CD1-CG 3.97Å; L158-L162 HydrophobicContact CD2-CD1 4.42Å; L158-L162 HydrophobicContact CG-CD1 3.86Å; L158-L162 HydrophobicContact CG-CG 4.24Å; L158-L162 VanDerWaalsContact O-CG 3.32Å; L158-L162 WeakPolarHBondContact O-CG 3.26Å; L158-L162 PolarHBondContact O-N 3.38Å; L158-I185 HydrophobicContact CD1-CG1 4.48Å; L158-L188 HydrophobicContact CB-CD2 4.25Å; L158-L188 HydrophobicContact CD1-CD2 4.1Å; L158-H197 WeakPolarHBondContact CD2-ND1 3.24Å; L158-V198 HydrophobicContact CD1-CG2 3.99Å; L158-V198 HydrophobicContact CD2-CB 4.37Å; L158-V198 HydrophobicContact CD2-CG2 3.77Å; L158-H201 HydrophobicContact CD2-CB 4.14Å
159	S	92.5	Very high	90.1	Very high	32 Å²	32	40.3 Å²	40.3	22%	0.224	21%	0.209	C	C	.	.	H	α-helix	trans	-61.9	-36.5	179.4	-50.8	0	0	0	0	111.1	D156 L162 N163	D156-S159 WeakPolarHBondContact O-CA 3.17Å; D156-S159 WeakPolarHBondContact O-CB 3.42Å; D156-S159 PolarHBondContact O-N 3.3Å; D156-S159 VanDerWaalsContact OD1-CB 3.31Å; D156-S159 WeakPolarHBondContact OD1-CB 3.32Å; D156-S159 PolarHBondContact OD1-OG 2.82Å; S159-L162 PolarHBondContact O-N 3.37Å; S159-N163 VanDerWaalsContact O-CB 3.28Å; S159-N163 WeakPolarHBondContact O-CB 3.48Å; S159-N163 PolarHBondContact O-N 3.36Å
160	C	92.2	Very high	90.1	Very high	16 Å²	16	47.6 Å²	47.6	11%	0.108	24%	0.238	C	C	.	.	H	α-helix	trans	-62.7	-45.6	170.5	-69.8	0	0	0	0	113.2	L110 N111 D156 G157 L158 N163 F164	L110-C160 HydrophobicContact CB-CB 4.47Å; L110-C160 HydrophobicContact CD1-CB 4.4Å; N111-C160 PolarHBondContact ND2-SG 2.92Å; N111-C160 PolarHBondContact OD1-SG 3.24Å; D156-C160 PolarHBondContact O-N 2.95Å; G157-C160 PolarHBondContact O-N 3.22Å; L158-C160 VanDerWaalsContact C-N 3.28Å; L158-C160 PolarHBondContact O-N 3.2Å; C160-N163 PolarHBondContact O-N 3.22Å; C160-F164 PolarHBondContact O-N 3.05Å
161	I	94.1	Very high	90.1	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-61.2	-48	174.5	-66.4	168.3	0	0	0	110.4	L110 L137 F152 G157 L158 N163 F164 L165 L181 C184 I185	L110-I161 HydrophobicContact CD1-CG1 3.68Å; L137-I161 HydrophobicContact CD2-CD1 4.42Å; F152-I161 HydrophobicContact CE1-CD1 3.98Å; F152-I161 HydrophobicContact CZ-CD1 3.67Å; F152-I161 HydrophobicContact CZ-CG1 4.26Å; G157-I161 WeakPolarHBondContact O-CG1 3.47Å; G157-I161 PolarHBondContact O-N 2.9Å; G157-I161 VanDerWaalsContact O-N 3.14Å; L158-I161 PolarHBondContact O-N 3.37Å; L158-I161 VanDerWaalsContact O-N 3.13Å; I161-N163 VanDerWaalsContact C-N 3.33Å; I161-N163 PolarHBondContact O-N 2.97Å; I161-F164 PolarHBondContact O-N 3.4Å; I161-L165 HydrophobicContact CG2-CD1 4.12Å; I161-L165 HydrophobicContact CG2-CG 4.4Å; I161-L165 WeakPolarHBondContact O-CG 3.45Å; I161-L165 PolarHBondContact O-N 3Å; I161-L181 HydrophobicContact CG2-CB 4.5Å; I161-L181 HydrophobicContact CG2-CD2 4.28Å; I161-C184 HydrophobicContact CD1-CB 3.79Å; I161-I185 HydrophobicContact CG2-CD1 4.01Å; I161-I185 HydrophobicContact CG2-CG1 3.87Å
162	L	94.1	Very high	90.1	Very high	4 Å²	4	49.2 Å²	49.2	2%	0.021	25%	0.249	C	C	.	.	H	α-helix	trans	-64	-36.6	-179.2	-66.7	175.7	0	0	0	112.1	L158 S159 L165 K166 I185 H201 V207	L158-L162 HydrophobicContact CD1-CD1 4.03Å; L158-L162 HydrophobicContact CD1-CD2 4.44Å; L158-L162 HydrophobicContact CD1-CG 3.97Å; L158-L162 HydrophobicContact CD2-CD1 4.42Å; L158-L162 HydrophobicContact CG-CD1 3.86Å; L158-L162 HydrophobicContact CG-CG 4.24Å; L158-L162 VanDerWaalsContact O-CG 3.32Å; L158-L162 WeakPolarHBondContact O-CG 3.26Å; L158-L162 PolarHBondContact O-N 3.38Å; S159-L162 PolarHBondContact O-N 3.37Å; L162-L165 HydrophobicContact CD2-CD1 4.47Å; L162-L165 PolarHBondContact O-N 3.39Å; L162-K166 WeakPolarHBondContact O-CG 3.25Å; L162-K166 PolarHBondContact O-N 2.91Å; L162-K166 VanDerWaalsContact O-N 3.13Å; L162-I185 HydrophobicContact CD2-CD1 3.95Å; L162-H201 VanDerWaalsContact CD1-CE1 3.45Å; L162-H201 WeakPolarHBondContact CD1-CE1 3.48Å; L162-H201 WeakPolarHBondContact CD1-ND1 3.08Å; L162-V207 HydrophobicContact CD2-CB 3.97Å; L162-V207 HydrophobicContact CD2-CG1 3.95Å
163	N	91.5	Very high	90	Very high	77 Å²	77	50 Å²	50	41%	0.412	25%	0.254	S	S	.	.	H	α-helix	trans	-65.5	-47.4	174.9	-175	58	0	0	0	111.4	S159 C160 I161 L165 K166 T167	S159-N163 VanDerWaalsContact O-CB 3.28Å; S159-N163 WeakPolarHBondContact O-CB 3.48Å; S159-N163 PolarHBondContact O-N 3.36Å; C160-N163 PolarHBondContact O-N 3.22Å; I161-N163 VanDerWaalsContact C-N 3.33Å; I161-N163 PolarHBondContact O-N 2.97Å; N163-L165 VanDerWaalsContact C-N 3.28Å; N163-L165 PolarHBondContact O-N 2.87Å; N163-K166 WeakPolarHBondContact O-CA 3.41Å; N163-K166 WeakPolarHBondContact O-CB 3.09Å; N163-K166 PolarHBondContact O-N 3.31Å; N163-T167 WeakPolarHBondContact O-CG2 3.34Å; N163-T167 PolarHBondContact O-N 3.2Å; N163-T167 PolarHBondContact O-OG1 3.47Å
164	F	91.4	Very high	90	Very high	12 Å²	12	51.3 Å²	51.3	5%	0.053	26%	0.26	C	S	.	.	H	α-helix	trans	-61	-37.7	175.9	-166.3	-177.2	0	0	0	111.5	L110 M113 A114 I134 C160 I161 K166 T167 M168 T172 I177 L181	L110-F164 HydrophobicContact CD2-CD1 3.89Å; L110-F164 HydrophobicContact CD2-CE1 4.41Å; M113-F164 HydrophobicContact CB-CD1 4.45Å; M113-F164 HydrophobicContact CB-CE1 3.61Å; M113-F164 HydrophobicContact CB-CZ 3.67Å; M113-F164 HydrophobicContact CE-CE1 4.37Å; M113-F164 HydrophobicContact SD-CE1 4.26Å; A114-F164 HydrophobicContact CB-CB 3.93Å; A114-F164 HydrophobicContact CB-CD2 3.98Å; A114-F164 HydrophobicContact CB-CG 3.92Å; I134-F164 HydrophobicContact CD1-CE1 3.95Å; C160-F164 PolarHBondContact O-N 3.05Å; I161-F164 PolarHBondContact O-N 3.4Å; F164-K166 VanDerWaalsContact C-N 3.27Å; F164-K166 PolarHBondContact O-N 3.03Å; F164-T167 PolarHBondContact O-N 2.91Å; F164-M168 PolarHBondContact O-N 3.24Å; F164-M168 VanDerWaalsContact O-N 3.14Å; F164-T172 HydrophobicContact CE2-CG2 4.3Å; F164-I177 HydrophobicContact CE1-CG2 4.37Å; F164-I177 HydrophobicContact CZ-CG2 4.16Å; F164-L181 HydrophobicContact CD1-CD1 3.87Å; F164-L181 HydrophobicContact CD1-CD2 4.06Å; F164-L181 HydrophobicContact CE1-CD1 4.15Å; F164-L181 HydrophobicContact CG-CD1 4.1Å
165	L	93.1	Very high	90	Very high	14 Å²	14	46.8 Å²	46.8	7%	0.073	24%	0.236	C	C	.	.	H	α-helix	trans	-61.8	-31	172.8	-72.6	176.2	0	0	0	113.4	I161 L162 N163 M168 L181 I182 I185 V207	I161-L165 HydrophobicContact CG2-CD1 4.12Å; I161-L165 HydrophobicContact CG2-CG 4.4Å; I161-L165 WeakPolarHBondContact O-CG 3.45Å; I161-L165 PolarHBondContact O-N 3Å; L162-L165 HydrophobicContact CD2-CD1 4.47Å; L162-L165 PolarHBondContact O-N 3.39Å; N163-L165 VanDerWaalsContact C-N 3.28Å; N163-L165 PolarHBondContact O-N 2.87Å; L165-M168 HydrophobicContact CB-CE 4.41Å; L165-M168 HydrophobicContact CD2-CE 3.51Å; L165-M168 HydrophobicContact CG-CE 4.48Å; L165-L181 HydrophobicContact CD2-CB 3.74Å; L165-L181 HydrophobicContact CD2-CD1 3.96Å; L165-L181 HydrophobicContact CG-CB 4.35Å; L165-I182 HydrophobicContact CD1-CD1 3.85Å; L165-I182 HydrophobicContact CD2-CD1 4.17Å; L165-I182 HydrophobicContact CD2-CG1 4.45Å; L165-I185 HydrophobicContact CD1-CD1 3.62Å; L165-V207 HydrophobicContact CB-CG1 3.58Å; L165-V207 HydrophobicContact CD1-CG1 4Å; L165-V207 HydrophobicContact CG-CG1 4.47Å
166	K	90.7	Very high	90	Very high	88 Å²	88	53.2 Å²	53.2	38%	0.383	26%	0.257	S	S	.	.	H	α-helix	trans	-81.5	-28.5	174.9	-67.9	-178.5	-164.3	-175.1	0	114.1	L162 N163 F164 E203 V207	L162-K166 WeakPolarHBondContact O-CG 3.25Å; L162-K166 PolarHBondContact O-N 2.91Å; L162-K166 VanDerWaalsContact O-N 3.13Å; N163-K166 WeakPolarHBondContact O-CA 3.41Å; N163-K166 WeakPolarHBondContact O-CB 3.09Å; N163-K166 PolarHBondContact O-N 3.31Å; F164-K166 VanDerWaalsContact C-N 3.27Å; F164-K166 PolarHBondContact O-N 3.03Å; K166-E203 IonicContact NZ-OE1 3.67Å; K166-E203 PolarHBondContact NZ-OE1 3.09Å; K166-E203 IonicContact NZ-OE2 3.37Å; K166-E203 PolarHBondContact NZ-OE2 3.33Å; K166-V207 HydrophobicContact CD-CG2 4.27Å; K166-V207 VanDerWaalsContact CE-CG2 3.41Å; K166-V207 HydrophobicContact CG-CG1 4.41Å; K166-V207 HydrophobicContact CG-CG2 3.93Å
167	T	88.6	Confident	90	Very high	72 Å²	72	48.9 Å²	48.9	44%	0.442	23%	0.234	S	C	.	.	H	α-helix	trans	-105.9	1.5	-169.8	65.2	0	0	0	0	115	N163 F164	N163-T167 WeakPolarHBondContact O-CG2 3.34Å; N163-T167 PolarHBondContact O-N 3.2Å; N163-T167 PolarHBondContact O-OG1 3.47Å; F164-T167 PolarHBondContact O-N 2.91Å
168	M	87.3	Confident	90	Very high	36 Å²	36	49.1 Å²	49.1	18%	0.177	24%	0.235	C	C	.	.			trans	-62.1	148.4	176.8	62.9	170.9	76.3	0	0	113	F164 L165 T172 S173 H178 L181	F164-M168 PolarHBondContact O-N 3.24Å; F164-M168 VanDerWaalsContact O-N 3.14Å; L165-M168 HydrophobicContact CB-CE 4.41Å; L165-M168 HydrophobicContact CD2-CE 3.51Å; L165-M168 HydrophobicContact CG-CE 4.48Å; M168-T172 HydrophobicContact CB-CG2 3.97Å; M168-S173 WeakPolarHBondContact SD-CA 3.18Å; M168-S173 WeakPolarHBondContact SD-CB 3.45Å; M168-H178 HydrophobicContact CE-CB 4.15Å; M168-H178 VanDerWaalsContact CE-CD2 3.5Å; M168-H178 WeakPolarHBondContact CE-CD2 3.34Å; M168-H178 HydrophobicContact SD-CB 4.36Å; M168-L181 HydrophobicContact CE-CD1 4.41Å
169	D	86	Confident	90.1	Very high	69 Å²	69	50.6 Å²	50.6	37%	0.369	24%	0.244	S	C	.	.			trans	-82.8	173.7	167.6	69.8	-80.2	0	0	0	111.8	E171 T172 S173	D169-E171 PolarHBondContact O-N 2.63Å; D169-E171 WeakPolarHBondContact OD2-CA 3.33Å; D169-E171 WeakPolarHBondContact OD2-CB 3.48Å; D169-E171 PolarHBondContact OD2-N 3.13Å; D169-T172 PolarHBondContact O-N 3.37Å; D169-T172 WeakPolarHBondContact OD1-CB 3.47Å; D169-T172 PolarHBondContact OD1-OG1 3Å; D169-T172 PolarHBondContact OD2-N 2.58Å; D169-S173 WeakPolarHBondContact O-CB 3.4Å; D169-S173 PolarHBondContact O-N 3.41Å
170	Y	86.1	Confident	90.1	Very high	159 Å²	159	49.6 Å²	49.6	62%	0.624	24%	0.237	S	C	*	.	H	α-helix	trans	-66.7	-34	-176.5	-176.1	-94.4	0	0	0	114.3	S173 E174	Y170-S173 WeakPolarHBondContact CA-OG 3.31Å; Y170-S173 PolarHBondContact O-N 3.49Å; Y170-S173 PolarHBondContact O-OG 3.19Å; Y170-E174 HydrophobicContact CE1-CG 4.19Å; Y170-E174 HydrophobicContact CE2-CG 4.39Å; Y170-E174 PolarHBondContact O-N 2.88Å
171	E	84.1	Confident	90.3	Very high	156 Å²	156	48.8 Å²	48.8	73%	0.729	23%	0.232	S	C	*	.	H	α-helix	trans	-71.6	-43.2	178	-57.8	-171.6	159.5	0	0	109.3	D169 S173 E174 S175	D169-E171 PolarHBondContact O-N 2.63Å; D169-E171 WeakPolarHBondContact OD2-CA 3.33Å; D169-E171 WeakPolarHBondContact OD2-CB 3.48Å; D169-E171 PolarHBondContact OD2-N 3.13Å; E171-S173 VanDerWaalsContact C-N 3.33Å; E171-S173 PolarHBondContact O-N 3.49Å; E171-E174 PolarHBondContact O-N 3.31Å; E171-S175 WeakPolarHBondContact O-CB 3.49Å; E171-S175 PolarHBondContact O-N 2.92Å; E171-S175 VanDerWaalsContact O-N 3.1Å
172	T	87.2	Confident	90.3	Very high	21 Å²	21	48.8 Å²	48.8	13%	0.129	23%	0.232	C	C	.	.	H	α-helix	trans	-61.9	-36.5	171.9	-59.9	0	0	0	0	112.4	F164 M168 D169 E174 S175 I177	F164-T172 HydrophobicContact CE2-CG2 4.3Å; M168-T172 HydrophobicContact CB-CG2 3.97Å; D169-T172 PolarHBondContact O-N 3.37Å; D169-T172 WeakPolarHBondContact OD1-CB 3.47Å; D169-T172 PolarHBondContact OD1-OG1 3Å; D169-T172 PolarHBondContact OD2-N 2.58Å; T172-E174 PolarHBondContact O-N 2.99Å; T172-S175 WeakPolarHBondContact O-CB 3.3Å; T172-S175 PolarHBondContact O-N 3.25Å; T172-S175 PolarHBondContact O-OG 3.21Å; T172-I177 HydrophobicContact CG2-CB 4.31Å; T172-I177 HydrophobicContact CG2-CG2 3.95Å
173	S	88.5	Confident	90.3	Very high	17 Å²	17	49.2 Å²	49.2	12%	0.119	24%	0.237	C	C	.	.	H	α-helix	trans	-68.3	-33.8	-179.2	75.4	0	0	0	0	113.8	M168 D169 Y170 E171 H178 T214	M168-S173 WeakPolarHBondContact SD-CA 3.18Å; M168-S173 WeakPolarHBondContact SD-CB 3.45Å; D169-S173 WeakPolarHBondContact O-CB 3.4Å; D169-S173 PolarHBondContact O-N 3.41Å; Y170-S173 WeakPolarHBondContact CA-OG 3.31Å; Y170-S173 PolarHBondContact O-N 3.49Å; Y170-S173 PolarHBondContact O-OG 3.19Å; E171-S173 VanDerWaalsContact C-N 3.33Å; E171-S173 PolarHBondContact O-N 3.49Å; S173-H178 WeakPolarHBondContact O-CB 3.35Å; S173-H178 PolarHBondContact O-ND1 2.87Å; S173-T214 PolarHBondContact O-OG1 2.93Å
174	E	89.1	Confident	90.5	Very high	47 Å²	47	45.6 Å²	45.6	22%	0.22	22%	0.217	C	C	.	.	H	α-helix	trans	-85	-18.6	175.7	-61	-47	115.1	0	0	113.3	Y170 E171 T172 T214 E215 N216	Y170-E174 HydrophobicContact CE1-CG 4.19Å; Y170-E174 HydrophobicContact CE2-CG 4.39Å; Y170-E174 PolarHBondContact O-N 2.88Å; E171-E174 PolarHBondContact O-N 3.31Å; T172-E174 PolarHBondContact O-N 2.99Å; E174-T214 WeakPolarHBondContact OE1-CA 3.06Å; E174-T214 VanDerWaalsContact OE1-CB 3.28Å; E174-T214 WeakPolarHBondContact OE1-CB 3.48Å; E174-T214 PolarHBondContact OE1-OG1 3.35Å; E174-T214 PolarHBondContact OE2-OG1 3.43Å; E174-T214 VanDerWaalsContact OE2-OG1 3.07Å; E174-E215 VanDerWaalsContact CD-N 3.33Å; E174-E215 PolarHBondContact OE1-N 3.43Å; E174-E215 VanDerWaalsContact OE2-CA 3.3Å; E174-E215 WeakPolarHBondContact OE2-CA 3.24Å; E174-E215 WeakPolarHBondContact OE2-CB 3.37Å; E174-E215 PolarHBondContact OE2-N 2.88Å; E174-N216 PolarHBondContact O-ND2 3.49Å; E174-N216 PolarHBondContact OE2-N 3.32Å
175	S	89.5	Confident	90.6	Very high	13 Å²	13	45 Å²	45	9%	0.091	22%	0.215	C	C	.	.	S	Bend	trans	-64.6	177.6	179.9	82.2	0	0	0	0	114.6	E127 E171 T172 I177 N216	E127-S175 WeakPolarHBondContact OE1-CB 3.44Å; E171-S175 WeakPolarHBondContact O-CB 3.49Å; E171-S175 PolarHBondContact O-N 2.92Å; E171-S175 VanDerWaalsContact O-N 3.1Å; T172-S175 WeakPolarHBondContact O-CB 3.3Å; T172-S175 PolarHBondContact O-N 3.25Å; T172-S175 PolarHBondContact O-OG 3.21Å; S175-I177 VanDerWaalsContact C-N 3.28Å; S175-I177 PolarHBondContact O-N 3.44Å; S175-I177 WeakPolarHBondContact OG-CB 3.2Å; S175-I177 PolarHBondContact OG-N 3.39Å; S175-N216 PolarHBondContact O-ND2 3.44Å
176	R	88.6	Confident	90.6	Very high	190 Å²	190	45.8 Å²	45.8	72%	0.717	22%	0.218	S	C	*	.	H	α-helix	trans	-71.4	-20.9	171.1	-61.5	-174.2	-173.2	-172.5	6.7	113.3	H178 T179 S180	R176-H178 VanDerWaalsContact C-N 3.34Å; R176-H178 PolarHBondContact O-N 3.35Å; R176-T179 PolarHBondContact O-N 3.4Å; R176-S180 PolarHBondContact O-N 3.14Å; R176-S180 PolarHBondContact O-OG 3.44Å
177	I	90.1	Very high	90.6	Very high	3 Å²	3	41.9 Å²	41.9	2%	0.015	20%	0.202	C	C	.	.	H	α-helix	trans	-59.7	-46.6	-179.4	-71.9	165	0	0	0	109.9	E127 R130 I134 F164 T172 S175 T179 S180 L181	E127-I177 HydrophobicContact CG-CD1 4.27Å; R130-I177 HydrophobicContact CB-CD1 4.03Å; I134-I177 HydrophobicContact CD1-CB 4.41Å; I134-I177 HydrophobicContact CD1-CG1 4.35Å; I134-I177 HydrophobicContact CD1-CG2 3.54Å; F164-I177 HydrophobicContact CE1-CG2 4.37Å; F164-I177 HydrophobicContact CZ-CG2 4.16Å; T172-I177 HydrophobicContact CG2-CB 4.31Å; T172-I177 HydrophobicContact CG2-CG2 3.95Å; S175-I177 VanDerWaalsContact C-N 3.28Å; S175-I177 PolarHBondContact O-N 3.44Å; S175-I177 WeakPolarHBondContact OG-CB 3.2Å; S175-I177 PolarHBondContact OG-N 3.39Å; I177-T179 PolarHBondContact O-N 3.33Å; I177-S180 PolarHBondContact O-N 3.3Å; I177-S180 VanDerWaalsContact O-N 3.16Å; I177-L181 HydrophobicContact CG2-CD1 3.9Å; I177-L181 HydrophobicContact CG2-CG 4.3Å; I177-L181 WeakPolarHBondContact O-CG 3.49Å; I177-L181 PolarHBondContact O-N 3.44Å
178	H	93.1	Very high	90.7	Very high	5 Å²	5	38.4 Å²	38.4	2%	0.023	18%	0.181	C	C	.	.	H	α-helix	trans	-58.7	-46.8	176.8	-170.4	-176.6	0	0	0	112.1	M168 S173 R176 S180 L181 I182 S211	M168-H178 HydrophobicContact CE-CB 4.15Å; M168-H178 VanDerWaalsContact CE-CD2 3.5Å; M168-H178 WeakPolarHBondContact CE-CD2 3.34Å; M168-H178 HydrophobicContact SD-CB 4.36Å; S173-H178 WeakPolarHBondContact O-CB 3.35Å; S173-H178 PolarHBondContact O-ND1 2.87Å; R176-H178 VanDerWaalsContact C-N 3.34Å; R176-H178 PolarHBondContact O-N 3.35Å; H178-S180 VanDerWaalsContact C-N 3.31Å; H178-S180 PolarHBondContact O-N 2.85Å; H178-L181 PolarHBondContact O-N 3.38Å; H178-I182 WeakPolarHBondContact O-CG1 3.5Å; H178-I182 PolarHBondContact O-N 2.9Å; H178-I182 VanDerWaalsContact O-N 3.09Å; H178-S211 WeakPolarHBondContact NE2-CB 3.49Å; H178-S211 PolarHBondContact NE2-OG 2.93Å
179	T	93.8	Very high	90.9	Very high	32 Å²	32	36.7 Å²	36.7	20%	0.196	17%	0.172	C	C	.	.	H	α-helix	trans	-61.2	-38.4	176.1	-42.6	0	0	0	0	112.1	R176 I177 G183 N216 K218 T219	R176-T179 PolarHBondContact O-N 3.4Å; I177-T179 PolarHBondContact O-N 3.33Å; T179-G183 PolarHBondContact O-N 3.4Å; T179-N216 PolarHBondContact OG1-ND2 3.13Å; T179-K218 HydrophobicContact CG2-CB 3.94Å; T179-T219 PolarHBondContact OG1-OG1 3.48Å
180	S	93.5	Very high	90.9	Very high	10 Å²	10	34.9 Å²	34.9	7%	0.07	16%	0.162	C	C	.	.	H	α-helix	trans	-74.6	-33.2	178.6	-68.1	0	0	0	0	113.1	E135 R176 I177 H178 G183 C184	E135-S180 PolarHBondContact OE2-OG 3.07Å; R176-S180 PolarHBondContact O-N 3.14Å; R176-S180 PolarHBondContact O-OG 3.44Å; I177-S180 PolarHBondContact O-N 3.3Å; I177-S180 VanDerWaalsContact O-N 3.16Å; H178-S180 VanDerWaalsContact C-N 3.31Å; H178-S180 PolarHBondContact O-N 2.85Å; S180-G183 CarbonylContact O-C 3.59Å; S180-G183 WeakPolarHBondContact O-CA 3.39Å; S180-G183 PolarHBondContact O-N 2.96Å; S180-C184 PolarHBondContact O-N 2.9Å; S180-C184 PolarHBondContact O-SG 2.87Å
181	L	94.9	Very high	90.8	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-64.6	-46.3	172.4	-72.8	170.2	0	0	0	111.7	L110 I134 I161 F164 L165 M168 I177 H178 G183 C184 I185	L110-L181 HydrophobicContact CD2-CD2 3.69Å; I134-L181 HydrophobicContact CD1-CD2 4.19Å; I134-L181 HydrophobicContact CD1-CG 4.38Å; I134-L181 HydrophobicContact CG2-CD2 3.84Å; I134-L181 HydrophobicContact CG2-CG 4.06Å; I161-L181 HydrophobicContact CG2-CB 4.5Å; I161-L181 HydrophobicContact CG2-CD2 4.28Å; F164-L181 HydrophobicContact CD1-CD1 3.87Å; F164-L181 HydrophobicContact CD1-CD2 4.06Å; F164-L181 HydrophobicContact CE1-CD1 4.15Å; F164-L181 HydrophobicContact CG-CD1 4.1Å; L165-L181 HydrophobicContact CD2-CB 3.74Å; L165-L181 HydrophobicContact CD2-CD1 3.96Å; L165-L181 HydrophobicContact CG-CB 4.35Å; M168-L181 HydrophobicContact CE-CD1 4.41Å; I177-L181 HydrophobicContact CG2-CD1 3.9Å; I177-L181 HydrophobicContact CG2-CG 4.3Å; I177-L181 WeakPolarHBondContact O-CG 3.49Å; I177-L181 PolarHBondContact O-N 3.44Å; H178-L181 PolarHBondContact O-N 3.38Å; L181-G183 PolarHBondContact O-N 3.47Å; L181-C184 WeakPolarHBondContact O-CB 3.42Å; L181-C184 PolarHBondContact O-N 3Å; L181-I185 PolarHBondContact O-N 3.35Å
182	I	96.1	Very high	90.7	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-61.1	-36.5	171.1	-64.3	-62.1	0	0	0	110.6	L165 H178 C184 I185 K186 T219 A222 V223 I226	L165-I182 HydrophobicContact CD1-CD1 3.85Å; L165-I182 HydrophobicContact CD2-CD1 4.17Å; L165-I182 HydrophobicContact CD2-CG1 4.45Å; H178-I182 WeakPolarHBondContact O-CG1 3.5Å; H178-I182 PolarHBondContact O-N 2.9Å; H178-I182 VanDerWaalsContact O-N 3.09Å; I182-C184 PolarHBondContact O-N 3.34Å; I182-I185 PolarHBondContact O-N 2.7Å; I182-K186 PolarHBondContact O-N 2.69Å; I182-T219 HydrophobicContact CG1-CG2 4.17Å; I182-A222 HydrophobicContact CG2-CB 3.82Å; I182-V223 HydrophobicContact CD1-CG2 4.17Å; I182-V223 HydrophobicContact CG1-CG2 4.21Å; I182-V223 HydrophobicContact CG2-CG2 4.09Å; I182-I226 HydrophobicContact CG2-CD1 3.63Å
183	G	93.9	Very high	90.4	Very high	13 Å²	13	26.7 Å²	26.7	13%	0.134	13%	0.134	C	C	.	.	H	α-helix	trans	-59.9	-38.5	170.4	0	0	0	0	0	114.2	K138 T179 S180 L181 K186 A187	K138-G183 WeakPolarHBondContact CG-O 3.12Å; T179-G183 PolarHBondContact O-N 3.4Å; S180-G183 CarbonylContact O-C 3.59Å; S180-G183 WeakPolarHBondContact O-CA 3.39Å; S180-G183 PolarHBondContact O-N 2.96Å; L181-G183 PolarHBondContact O-N 3.47Å; G183-K186 PolarHBondContact O-N 3.48Å; G183-A187 PolarHBondContact O-N 2.87Å
184	C	94.4	Very high	90.4	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-63.5	-41.9	175.6	-64.4	0	0	0	0	111.3	L141 I161 S180 L181 I182 A187 L188	L141-C184 HydrophobicContact CD1-CB 3.84Å; I161-C184 HydrophobicContact CD1-CB 3.79Å; S180-C184 PolarHBondContact O-N 2.9Å; S180-C184 PolarHBondContact O-SG 2.87Å; L181-C184 WeakPolarHBondContact O-CB 3.42Å; L181-C184 PolarHBondContact O-N 3Å; I182-C184 PolarHBondContact O-N 3.34Å; C184-A187 PolarHBondContact O-N 3.36Å; C184-L188 WeakPolarHBondContact O-CB 3.45Å; C184-L188 PolarHBondContact O-N 3.27Å
185	I	94.6	Very high	90.4	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-62.5	-45.1	173.5	-61.1	179.6	0	0	0	110.3	L158 I161 L162 L165 L181 I182 A187 L188 M189 V198 I208	L158-I185 HydrophobicContact CD1-CG1 4.48Å; I161-I185 HydrophobicContact CG2-CD1 4.01Å; I161-I185 HydrophobicContact CG2-CG1 3.87Å; L162-I185 HydrophobicContact CD2-CD1 3.95Å; L165-I185 HydrophobicContact CD1-CD1 3.62Å; L181-I185 PolarHBondContact O-N 3.35Å; I182-I185 PolarHBondContact O-N 2.7Å; I185-A187 VanDerWaalsContact C-N 3.33Å; I185-A187 PolarHBondContact O-N 2.84Å; I185-L188 PolarHBondContact O-N 2.8Å; I185-M189 HydrophobicContact CG2-CG 4.35Å; I185-M189 HydrophobicContact CG2-SD 3.98Å; I185-M189 VanDerWaalsContact O-CG 3.31Å; I185-M189 WeakPolarHBondContact O-CG 3.48Å; I185-M189 PolarHBondContact O-N 2.75Å; I185-V198 HydrophobicContact CG2-CG1 4.32Å; I185-V198 HydrophobicContact CG2-CG2 4.5Å; I185-I208 HydrophobicContact CD1-CD1 4.31Å; I185-I208 HydrophobicContact CD1-CG1 3.94Å; I185-I208 HydrophobicContact CG2-CD1 3.78Å; I185-I208 HydrophobicContact CG2-CG1 4.39Å
186	K	92.5	Very high	90.3	Very high	30 Å²	30	27.9 Å²	27.9	13%	0.13	14%	0.144	C	C	.	.	H	α-helix	trans	-59.5	-42.4	177.2	-162.5	-179.1	-178.1	-164.6	0	112.3	I182 G183 M189 N190 E225 I226 D1034	I182-K186 PolarHBondContact O-N 2.69Å; G183-K186 PolarHBondContact O-N 3.48Å; K186-M189 PolarHBondContact O-N 3.49Å; K186-N190 PolarHBondContact O-N 2.77Å; K186-E225 IonicContact NZ-OE2 3.58Å; K186-E225 PolarHBondContact NZ-OE2 2.92Å; K186-I226 HydrophobicContact CB-CD1 4.03Å; K186-I226 HydrophobicContact CB-CG1 4.21Å; K186-I226 HydrophobicContact CG-CD1 4.49Å; K186-I226 HydrophobicContact CG-CG1 4.13Å; K186-D1034 WeakPolarHBondContact CE-OD1 3.42Å; K186-D1034 IonicContact NZ-OD1 2.74Å; K186-D1034 PolarHBondContact NZ-OD1 3.34Å; K186-D1034 VanDerWaalsContact NZ-OD1 3.12Å
187	A	91.1	Very high	90.4	Very high	6 Å²	6	21.5 Å²	21.5	5%	0.05	12%	0.122	C	C	.	.	H	α-helix	trans	-62.1	-46.7	175.4	0	0	0	0	0	111.8	K138 L141 R142 G183 C184 I185 M189 N190	K138-A187 HydrophobicContact CG-CB 4.33Å; L141-A187 HydrophobicContact CB-CB 3.99Å; R142-A187 HydrophobicContact CB-CB 4.18Å; G183-A187 PolarHBondContact O-N 2.87Å; C184-A187 PolarHBondContact O-N 3.36Å; I185-A187 VanDerWaalsContact C-N 3.33Å; I185-A187 PolarHBondContact O-N 2.84Å; A187-M189 VanDerWaalsContact C-N 3.3Å; A187-M189 PolarHBondContact O-N 2.75Å; A187-N190 WeakPolarHBondContact O-CB 3.26Å; A187-N190 PolarHBondContact O-N 2.75Å
188	L	90.9	Very high	90.5	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-59.7	-39	176.1	-176.8	63.2	0	0	0	112.2	V149 I153 L158 C184 I185 N190 N191 G194 R195 V198	V149-L188 HydrophobicContact CG1-CD1 3.66Å; I153-L188 HydrophobicContact CD1-CD1 4.1Å; I153-L188 HydrophobicContact CG1-CD1 4.11Å; L158-L188 HydrophobicContact CB-CD2 4.25Å; L158-L188 HydrophobicContact CD1-CD2 4.1Å; C184-L188 WeakPolarHBondContact O-CB 3.45Å; C184-L188 PolarHBondContact O-N 3.27Å; I185-L188 PolarHBondContact O-N 2.8Å; L188-N190 PolarHBondContact O-N 2.91Å; L188-N191 PolarHBondContact O-N 3.46Å; L188-G194 CarbonylContact O-C 3.51Å; L188-G194 VanDerWaalsContact O-CA 3.26Å; L188-G194 WeakPolarHBondContact O-CA 3.36Å; L188-R195 PolarHBondContact O-N 3.31Å; L188-V198 HydrophobicContact CD2-CG2 3.7Å; L188-V198 HydrophobicContact CG-CG2 4.12Å
189	M	90.1	Very high	90.4	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-72.9	-12.7	176.4	-67.5	-178.6	77.2	0	0	114.4	I185 K186 A187 N191 R195 V198 I226 V230 F1033	I185-M189 HydrophobicContact CG2-CG 4.35Å; I185-M189 HydrophobicContact CG2-SD 3.98Å; I185-M189 VanDerWaalsContact O-CG 3.31Å; I185-M189 WeakPolarHBondContact O-CG 3.48Å; I185-M189 PolarHBondContact O-N 2.75Å; K186-M189 PolarHBondContact O-N 3.49Å; A187-M189 VanDerWaalsContact C-N 3.3Å; A187-M189 PolarHBondContact O-N 2.75Å; M189-N191 PolarHBondContact O-N 3.23Å; M189-R195 WeakPolarHBondContact O-CB 3.48Å; M189-V198 HydrophobicContact CE-CG1 4.18Å; M189-V198 HydrophobicContact CG-CB 3.96Å; M189-V198 HydrophobicContact CG-CG1 3.91Å; M189-V198 HydrophobicContact CG-CG2 3.95Å; M189-V198 HydrophobicContact SD-CB 4.42Å; M189-V198 HydrophobicContact SD-CG1 3.72Å; M189-I226 HydrophobicContact CE-CG2 4.25Å; M189-I226 HydrophobicContact SD-CG2 3.7Å; M189-V230 HydrophobicContact CE-CG2 3.54Å; M189-F1033 HydrophobicContact CB-CD1 3.72Å; M189-F1033 HydrophobicContact CB-CE1 3.76Å; M189-F1033 HydrophobicContact CB-CG 4.22Å; M189-F1033 HydrophobicContact CB-CZ 4.28Å; M189-F1033 HydrophobicContact CE-CE1 4.08Å; M189-F1033 HydrophobicContact CE-CE2 3.9Å; M189-F1033 HydrophobicContact CE-CZ 3.51Å; M189-F1033 WeakPolarHBondContact O-CB 3.43Å; M189-F1033 WeakPolarHBondContact O-CG 3.32Å; M189-F1033 HydrophobicContact SD-CE1 4.16Å; M189-F1033 HydrophobicContact SD-CZ 4.15Å
190	N	87.6	Confident	90.2	Very high	31 Å²	31	24.2 Å²	24.2	17%	0.166	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.8	-6.5	173.6	-154.6	34	0	0	0	113.6	K186 A187 L188 G1031 F1033 D1034	K186-N190 PolarHBondContact O-N 2.77Å; A187-N190 WeakPolarHBondContact O-CB 3.26Å; A187-N190 PolarHBondContact O-N 2.75Å; L188-N190 PolarHBondContact O-N 2.91Å; N190-G1031 WeakPolarHBondContact OD1-CA 3.39Å; N190-G1031 PolarHBondContact OD1-O 3.12Å; N190-F1033 HydrophobicContact CB-CB 4.48Å; N190-F1033 PolarHBondContact OD1-N 2.83Å; N190-F1033 VanDerWaalsContact OD1-N 3.11Å; N190-D1034 PolarHBondContact OD1-N 2.89Å
191	N	82.7	Confident	90.2	Very high	24 Å²	24	25.9 Å²	25.9	13%	0.128	15%	0.152	C	C	.	.	S	Bend	trans	-106.8	149.2	174.7	-176.9	-95.5	0	0	0	111.7	D65 M146 L188 M189 Q193 G194 R195	D65-N191 PolarHBondContact OD2-ND2 3.25Å; M146-N191 WeakPolarHBondContact CE-ND2 3.47Å; M146-N191 WeakPolarHBondContact CE-OD1 3.36Å; L188-N191 PolarHBondContact O-N 3.46Å; M189-N191 PolarHBondContact O-N 3.23Å; N191-Q193 PolarHBondContact O-N 2.92Å; N191-Q193 WeakPolarHBondContact OD1-CB 3.26Å; N191-Q193 PolarHBondContact OD1-N 2.79Å; N191-G194 PolarHBondContact OD1-N 3.19Å; N191-R195 WeakPolarHBondContact O-CB 3.28Å; N191-R195 PolarHBondContact O-N 3.42Å
192	S	82	Confident	89.8	Confident	39 Å²	39	30.8 Å²	30.8	27%	0.273	19%	0.187	S	C	.	.	H	α-helix	trans	-60.6	-45.9	-177.8	76.8	0	0	0	0	112.7	D65 A196	D65-S192 VanDerWaalsContact CG-OG 3.25Å; D65-S192 WeakPolarHBondContact OD1-CB 3.46Å; D65-S192 PolarHBondContact OD1-OG 3.41Å; D65-S192 VanDerWaalsContact OD2-CB 3.32Å; D65-S192 WeakPolarHBondContact OD2-CB 3.2Å; D65-S192 PolarHBondContact OD2-N 2.94Å; D65-S192 PolarHBondContact OD2-OG 3.12Å; D65-S192 VanDerWaalsContact OD2-OG 3.1Å; S192-A196 PolarHBondContact O-N 2.97Å; S192-A196 VanDerWaalsContact O-N 3.1Å
193	Q	82.6	Confident	89.5	Confident	101 Å²	101	34.3 Å²	34.3	47%	0.472	20%	0.203	S	C	.	.	H	α-helix	trans	-70.3	-47.6	-179.5	-65.1	-121.5	-22	0	0	111.4	M146 I153 N191 R195 A196 H197	M146-Q193 HydrophobicContact CE-CG 4.3Å; M146-Q193 HydrophobicContact SD-CG 4.23Å; I153-Q193 HydrophobicContact CD1-CB 4.45Å; N191-Q193 PolarHBondContact O-N 2.92Å; N191-Q193 WeakPolarHBondContact OD1-CB 3.26Å; N191-Q193 PolarHBondContact OD1-N 2.79Å; Q193-R195 VanDerWaalsContact C-N 3.33Å; Q193-R195 PolarHBondContact O-N 2.86Å; Q193-A196 PolarHBondContact O-N 3.27Å; Q193-H197 PolarHBondContact O-N 2.87Å
194	G	87.8	Confident	89.5	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-62.9	-38	178.7	0	0	0	0	0	112.8	L188 N191 H197 V198	L188-G194 CarbonylContact O-C 3.51Å; L188-G194 VanDerWaalsContact O-CA 3.26Å; L188-G194 WeakPolarHBondContact O-CA 3.36Å; N191-G194 PolarHBondContact OD1-N 3.19Å; G194-H197 PolarHBondContact O-N 3.09Å; G194-V198 WeakPolarHBondContact O-CB 3.36Å; G194-V198 VanDerWaalsContact O-CG2 3.26Å; G194-V198 WeakPolarHBondContact O-CG2 3.3Å; G194-V198 PolarHBondContact O-N 3.04Å
195	R	88.8	Confident	89.6	Confident	42 Å²	42	34.1 Å²	34.1	16%	0.158	20%	0.199	C	C	.	.	H	α-helix	trans	-62.7	-44.6	172.1	-172.4	168.5	63.5	-126.2	9.2	112.3	L188 M189 N191 Q193 L199 E1032	L188-R195 PolarHBondContact O-N 3.31Å; M189-R195 WeakPolarHBondContact O-CB 3.48Å; N191-R195 WeakPolarHBondContact O-CB 3.28Å; N191-R195 PolarHBondContact O-N 3.42Å; Q193-R195 VanDerWaalsContact C-N 3.33Å; Q193-R195 PolarHBondContact O-N 2.86Å; R195-L199 HydrophobicContact CG-CD1 4.15Å; R195-L199 WeakPolarHBondContact O-CB 3.41Å; R195-L199 VanDerWaalsContact O-CG 3.3Å; R195-L199 WeakPolarHBondContact O-CG 3.13Å; R195-L199 PolarHBondContact O-N 2.63Å; R195-E1032 IonicContact CZ-OE2 3.6Å; R195-E1032 IonicContact NH1-OE2 3.85Å; R195-E1032 PolarHBondContact NH1-OE2 3.33Å; R195-E1032 VanDerWaalsContact NH1-OE2 3.11Å; R195-E1032 IonicContact NH2-OE2 2.65Å; R195-E1032 PolarHBondContact NH2-OE2 3.01Å
196	A	87.6	Confident	89.7	Confident	59 Å²	59	35.6 Å²	35.6	49%	0.488	21%	0.207	S	C	.	.	H	α-helix	trans	-62.7	-44.8	175.8	0	0	0	0	0	111.6	S192 Q193 L199 A200	S192-A196 PolarHBondContact O-N 2.97Å; S192-A196 VanDerWaalsContact O-N 3.1Å; Q193-A196 PolarHBondContact O-N 3.27Å; A196-L199 PolarHBondContact O-N 3.47Å; A196-A200 VanDerWaalsContact O-CB 3.31Å; A196-A200 WeakPolarHBondContact O-CB 3.2Å; A196-A200 PolarHBondContact O-N 3.05Å
197	H	90.7	Very high	89.9	Confident	56 Å²	56	34.3 Å²	34.3	26%	0.259	20%	0.202	S	C	.	.	H	α-helix	trans	-66	-46.1	179.5	-167.3	-104.2	0	0	0	112.6	I153 L158 Q193 G194 L199 A200 H201	I153-H197 HydrophobicContact CD1-CB 4.32Å; I153-H197 HydrophobicContact CG2-CB 4.17Å; L158-H197 WeakPolarHBondContact CD2-ND1 3.24Å; Q193-H197 PolarHBondContact O-N 2.87Å; G194-H197 PolarHBondContact O-N 3.09Å; H197-L199 VanDerWaalsContact C-N 3.29Å; H197-L199 PolarHBondContact O-N 3.37Å; H197-A200 PolarHBondContact O-N 3.2Å; H197-A200 VanDerWaalsContact O-N 3.13Å; H197-H201 PolarHBondContact O-N 2.86Å
198	V	92.4	Very high	90.1	Very high	0 Å²	0	34 Å²	34	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-59.3	-41.2	175	171.5	0	0	0	0	111	L158 I185 L188 M189 G194 S204 I205	L158-V198 HydrophobicContact CD1-CG2 3.99Å; L158-V198 HydrophobicContact CD2-CB 4.37Å; L158-V198 HydrophobicContact CD2-CG2 3.77Å; I185-V198 HydrophobicContact CG2-CG1 4.32Å; I185-V198 HydrophobicContact CG2-CG2 4.5Å; L188-V198 HydrophobicContact CD2-CG2 3.7Å; L188-V198 HydrophobicContact CG-CG2 4.12Å; M189-V198 HydrophobicContact CE-CG1 4.18Å; M189-V198 HydrophobicContact CG-CB 3.96Å; M189-V198 HydrophobicContact CG-CG1 3.91Å; M189-V198 HydrophobicContact CG-CG2 3.95Å; M189-V198 HydrophobicContact SD-CB 4.42Å; M189-V198 HydrophobicContact SD-CG1 3.72Å; G194-V198 WeakPolarHBondContact O-CB 3.36Å; G194-V198 VanDerWaalsContact O-CG2 3.26Å; G194-V198 WeakPolarHBondContact O-CG2 3.3Å; G194-V198 PolarHBondContact O-N 3.04Å; V198-S204 WeakPolarHBondContact O-CB 3.47Å; V198-S204 PolarHBondContact O-OG 2.98Å; V198-I205 HydrophobicContact CG1-CD1 4.33Å
199	L	90.4	Very high	90.4	Very high	24 Å²	24	34 Å²	34	13%	0.126	20%	0.199	C	C	.	.	H	α-helix	trans	-72.6	-29.1	176.5	-71.2	168.7	0	0	0	113.2	R195 A196 H197 I205 V230 V233 K239	R195-L199 HydrophobicContact CG-CD1 4.15Å; R195-L199 WeakPolarHBondContact O-CB 3.41Å; R195-L199 VanDerWaalsContact O-CG 3.3Å; R195-L199 WeakPolarHBondContact O-CG 3.13Å; R195-L199 PolarHBondContact O-N 2.63Å; A196-L199 PolarHBondContact O-N 3.47Å; H197-L199 VanDerWaalsContact C-N 3.29Å; H197-L199 PolarHBondContact O-N 3.37Å; L199-I205 HydrophobicContact CD2-CD1 4.25Å; L199-V230 HydrophobicContact CD2-CG1 3.92Å; L199-V230 HydrophobicContact CD2-CG2 4.38Å; L199-V233 HydrophobicContact CD1-CB 4.45Å; L199-V233 HydrophobicContact CD1-CG1 3.7Å; L199-K239 PolarHBondContact O-NZ 3.41Å
200	A	90.8	Very high	90.7	Very high	74 Å²	74	35.1 Å²	35.1	61%	0.612	20%	0.204	S	C	*	.	H	α-helix	trans	-73.3	-38.1	178	0	0	0	0	0	112.6	A196 H197 S202	A196-A200 VanDerWaalsContact O-CB 3.31Å; A196-A200 WeakPolarHBondContact O-CB 3.2Å; A196-A200 PolarHBondContact O-N 3.05Å; H197-A200 PolarHBondContact O-N 3.2Å; H197-A200 VanDerWaalsContact O-N 3.13Å; A200-S202 PolarHBondContact O-N 2.65Å
201	H	92.3	Very high	91.1	Very high	44 Å²	44	33.9 Å²	33.9	20%	0.204	20%	0.198	C	C	.	.	S	Bend	trans	-59.4	130.3	-179.7	-172.5	-79.1	0	0	0	112	L158 L162 H197 E203 S204	L158-H201 HydrophobicContact CD2-CB 4.14Å; L162-H201 VanDerWaalsContact CD1-CE1 3.45Å; L162-H201 WeakPolarHBondContact CD1-CE1 3.48Å; L162-H201 WeakPolarHBondContact CD1-ND1 3.08Å; H197-H201 PolarHBondContact O-N 2.86Å; H201-E203 PolarHBondContact ND1-N 3.37Å; H201-E203 PolarHBondContact O-N 2.79Å; H201-S204 PolarHBondContact ND1-N 2.69Å; H201-S204 PolarHBondContact O-OG 2.93Å; H201-S204 VanDerWaalsContact O-OG 3.08Å
202	S	86.6	Confident	91.7	Very high	103 Å²	103	33.1 Å²	33.1	72%	0.72	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.4	-37	-167.5	53.1	0	0	0	0	114.7	A200	A200-S202 PolarHBondContact O-N 2.65Å
203	E	90.1	Very high	92.3	Very high	75 Å²	75	34.4 Å²	34.4	35%	0.35	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.1	-2.5	-175.5	-64.8	-176.5	96.1	0	0	114.7	K166 H201 I205 N206 V207	K166-E203 IonicContact NZ-OE1 3.67Å; K166-E203 PolarHBondContact NZ-OE1 3.09Å; K166-E203 IonicContact NZ-OE2 3.37Å; K166-E203 PolarHBondContact NZ-OE2 3.33Å; H201-E203 PolarHBondContact ND1-N 3.37Å; H201-E203 PolarHBondContact O-N 2.79Å; E203-I205 PolarHBondContact O-N 3.38Å; E203-N206 WeakPolarHBondContact O-CB 3.33Å; E203-N206 PolarHBondContact O-N 3.41Å; E203-N206 VanDerWaalsContact O-N 3.12Å; E203-V207 HydrophobicContact CB-CG2 4.47Å; E203-V207 WeakPolarHBondContact O-CG2 3.23Å; E203-V207 PolarHBondContact O-N 3.08Å
204	S	94.6	Very high	92.8	Very high	1 Å²	1	29.7 Å²	29.7	1%	0.007	18%	0.181	C	C	.	.	H	α-helix	trans	-58.2	-53.4	-167.9	53.8	0	0	0	0	112.3	V198 H201 N206 V207 I208	V198-S204 WeakPolarHBondContact O-CB 3.47Å; V198-S204 PolarHBondContact O-OG 2.98Å; H201-S204 PolarHBondContact ND1-N 2.69Å; H201-S204 PolarHBondContact O-OG 2.93Å; H201-S204 VanDerWaalsContact O-OG 3.08Å; S204-N206 VanDerWaalsContact C-N 3.27Å; S204-N206 PolarHBondContact O-N 2.85Å; S204-V207 PolarHBondContact O-N 3.16Å; S204-I208 WeakPolarHBondContact O-CD1 3.31Å; S204-I208 VanDerWaalsContact O-CG1 3.24Å; S204-I208 WeakPolarHBondContact O-CG1 3.08Å; S204-I208 PolarHBondContact O-N 3.31Å
205	I	96.2	Very high	92.9	Very high	7 Å²	7	35.4 Å²	35.4	4%	0.036	21%	0.208	C	C	.	.	H	α-helix	trans	-66.4	-32	179.9	-43.9	-54.4	0	0	0	110.8	V198 L199 E203 I208 A209 L227 K239 V240 A243	V198-I205 HydrophobicContact CG1-CD1 4.33Å; L199-I205 HydrophobicContact CD2-CD1 4.25Å; E203-I205 PolarHBondContact O-N 3.38Å; I205-I208 HydrophobicContact CD1-CD1 4.24Å; I205-A209 WeakPolarHBondContact O-CB 3.25Å; I205-A209 PolarHBondContact O-N 3.09Å; I205-L227 HydrophobicContact CG2-CD2 3.6Å; I205-K239 HydrophobicContact CG1-CB 4.46Å; I205-V240 HydrophobicContact CG2-CG2 4.33Å; I205-A243 HydrophobicContact CB-CB 4.21Å; I205-A243 HydrophobicContact CG2-CB 3.69Å
206	N	95.8	Very high	93	Very high	32 Å²	32	34.9 Å²	34.9	17%	0.171	21%	0.208	C	C	.	.	H	α-helix	trans	-67.1	-39	176	-60.6	-12.4	0	0	0	111.8	E203 S204 Q210 A243 H246	E203-N206 WeakPolarHBondContact O-CB 3.33Å; E203-N206 PolarHBondContact O-N 3.41Å; E203-N206 VanDerWaalsContact O-N 3.12Å; S204-N206 VanDerWaalsContact C-N 3.27Å; S204-N206 PolarHBondContact O-N 2.85Å; N206-Q210 VanDerWaalsContact C-NE2 3.31Å; N206-Q210 VanDerWaalsContact O-CG 3.28Å; N206-Q210 WeakPolarHBondContact O-CG 3.38Å; N206-Q210 PolarHBondContact O-N 3.45Å; N206-Q210 VanDerWaalsContact O-N 3.08Å; N206-Q210 PolarHBondContact O-NE2 2.87Å; N206-A243 WeakPolarHBondContact OD1-CA 3.29Å; N206-H246 HydrophobicContact CB-CB 4.35Å
207	V	96.2	Very high	93.2	Very high	2 Å²	2	33.4 Å²	33.4	1%	0.012	19%	0.192	C	C	.	.	H	α-helix	trans	-73.4	-41.6	176.6	173.3	0	0	0	0	110.8	L162 L165 K166 E203 S204 A209 Q210 S211	L162-V207 HydrophobicContact CD2-CB 3.97Å; L162-V207 HydrophobicContact CD2-CG1 3.95Å; L165-V207 HydrophobicContact CB-CG1 3.58Å; L165-V207 HydrophobicContact CD1-CG1 4Å; L165-V207 HydrophobicContact CG-CG1 4.47Å; K166-V207 HydrophobicContact CD-CG2 4.27Å; K166-V207 VanDerWaalsContact CE-CG2 3.41Å; K166-V207 HydrophobicContact CG-CG1 4.41Å; K166-V207 HydrophobicContact CG-CG2 3.93Å; E203-V207 HydrophobicContact CB-CG2 4.47Å; E203-V207 WeakPolarHBondContact O-CG2 3.23Å; E203-V207 PolarHBondContact O-N 3.08Å; S204-V207 PolarHBondContact O-N 3.16Å; V207-A209 PolarHBondContact O-N 3.46Å; V207-Q210 WeakPolarHBondContact O-CB 3.45Å; V207-Q210 PolarHBondContact O-N 3.47Å; V207-Q210 VanDerWaalsContact O-N 3.08Å; V207-S211 PolarHBondContact O-N 2.88Å
208	I	96.8	Very high	93.3	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-58.1	-39.8	173.2	-65.3	159.2	0	0	0	110.5	I185 S204 I205 S211 V223 I226 L227	I185-I208 HydrophobicContact CD1-CD1 4.31Å; I185-I208 HydrophobicContact CD1-CG1 3.94Å; I185-I208 HydrophobicContact CG2-CD1 3.78Å; I185-I208 HydrophobicContact CG2-CG1 4.39Å; S204-I208 WeakPolarHBondContact O-CD1 3.31Å; S204-I208 VanDerWaalsContact O-CG1 3.24Å; S204-I208 WeakPolarHBondContact O-CG1 3.08Å; S204-I208 PolarHBondContact O-N 3.31Å; I205-I208 HydrophobicContact CD1-CD1 4.24Å; I208-S211 WeakPolarHBondContact O-CB 3.34Å; I208-S211 PolarHBondContact O-N 2.98Å; I208-V223 HydrophobicContact CG2-CG1 4.12Å; I208-V223 WeakPolarHBondContact O-CG1 3.33Å; I208-I226 HydrophobicContact CD1-CG2 4.36Å; I208-I226 HydrophobicContact CG2-CB 4.42Å; I208-I226 HydrophobicContact CG2-CG2 4.16Å; I208-L227 HydrophobicContact CG2-CD2 4.07Å; I208-L227 HydrophobicContact CG2-CG 4.24Å
209	A	96.9	Very high	93.4	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-69.8	-33.9	174.6	0	0	0	0	0	113.6	I205 V207 S211 L212 L227 A243 Y247	I205-A209 WeakPolarHBondContact O-CB 3.25Å; I205-A209 PolarHBondContact O-N 3.09Å; V207-A209 PolarHBondContact O-N 3.46Å; A209-S211 PolarHBondContact O-N 3.33Å; A209-L212 WeakPolarHBondContact O-CB 3.34Å; A209-L212 WeakPolarHBondContact O-CG 3.36Å; A209-L212 PolarHBondContact O-N 3.23Å; A209-L212 VanDerWaalsContact O-N 3.1Å; A209-L227 HydrophobicContact CB-CD1 4.25Å; A209-A243 HydrophobicContact CB-CB 4Å; A209-Y247 WeakPolarHBondContact O-CD2 3.33Å; A209-Y247 WeakPolarHBondContact O-CE2 3.25Å
210	Q	95.9	Very high	93.7	Very high	24 Å²	24	36.7 Å²	36.7	11%	0.112	20%	0.204	C	C	.	.	H	α-helix	trans	-57	-36.1	173.8	-75.5	158.9	64.9	0	0	112	N206 V207 L212 S213 H246 Y250	N206-Q210 VanDerWaalsContact C-NE2 3.31Å; N206-Q210 VanDerWaalsContact O-CG 3.28Å; N206-Q210 WeakPolarHBondContact O-CG 3.38Å; N206-Q210 PolarHBondContact O-N 3.45Å; N206-Q210 VanDerWaalsContact O-N 3.08Å; N206-Q210 PolarHBondContact O-NE2 2.87Å; V207-Q210 WeakPolarHBondContact O-CB 3.45Å; V207-Q210 PolarHBondContact O-N 3.47Å; V207-Q210 VanDerWaalsContact O-N 3.08Å; Q210-L212 PolarHBondContact O-N 3.12Å; Q210-S213 PolarHBondContact O-N 3.39Å; Q210-S213 VanDerWaalsContact O-N 3.09Å; Q210-S213 PolarHBondContact O-OG 3.45Å; Q210-H246 PolarHBondContact NE2-CE1 2.94Å; Q210-H246 VanDerWaalsContact NE2-CE1 3.29Å; Q210-Y250 HydrophobicContact CB-CD1 4.23Å; Q210-Y250 HydrophobicContact CB-CE1 3.93Å; Q210-Y250 HydrophobicContact CB-CE2 4.48Å; Q210-Y250 HydrophobicContact CG-CD1 3.79Å; Q210-Y250 HydrophobicContact CG-CD2 3.86Å; Q210-Y250 HydrophobicContact CG-CE1 3.93Å; Q210-Y250 HydrophobicContact CG-CE2 4Å; Q210-Y250 HydrophobicContact CG-CG 3.75Å
211	S	96	Very high	93.9	Very high	5 Å²	5	34.2 Å²	34.2	4%	0.035	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	0.4	175.5	-63.3	0	0	0	0	115.7	H178 V207 I208 A209 S213 T214	H178-S211 WeakPolarHBondContact NE2-CB 3.49Å; H178-S211 PolarHBondContact NE2-OG 2.93Å; V207-S211 PolarHBondContact O-N 2.88Å; I208-S211 WeakPolarHBondContact O-CB 3.34Å; I208-S211 PolarHBondContact O-N 2.98Å; A209-S211 PolarHBondContact O-N 3.33Å; S211-S213 VanDerWaalsContact C-N 3.3Å; S211-T214 WeakPolarHBondContact O-CG2 3.38Å
212	L	95.8	Very high	94.1	Very high	8 Å²	8	32.9 Å²	32.9	4%	0.042	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-15.9	166.6	-67.8	175.8	0	0	0	113.7	A209 Q210 K220 V223 L224 L227 M244 Y247	A209-L212 WeakPolarHBondContact O-CB 3.34Å; A209-L212 WeakPolarHBondContact O-CG 3.36Å; A209-L212 PolarHBondContact O-N 3.23Å; A209-L212 VanDerWaalsContact O-N 3.1Å; Q210-L212 PolarHBondContact O-N 3.12Å; L212-K220 WeakPolarHBondContact O-CE 3.34Å; L212-K220 PolarHBondContact O-NZ 3.28Å; L212-V223 HydrophobicContact CD2-CB 4.06Å; L212-V223 HydrophobicContact CD2-CG1 3.53Å; L212-V223 HydrophobicContact CG-CG1 3.76Å; L212-L224 HydrophobicContact CD2-CD2 4.03Å; L212-L224 HydrophobicContact CD2-CG 3.97Å; L212-L227 HydrophobicContact CD1-CD1 4.44Å; L212-M244 HydrophobicContact CD1-CE 4.06Å; L212-M244 HydrophobicContact CD1-SD 4.21Å; L212-Y247 HydrophobicContact CB-CE1 4.28Å; L212-Y247 HydrophobicContact CB-CE2 3.88Å; L212-Y247 HydrophobicContact CD1-CE1 4.41Å
213	S	93.6	Very high	94.6	Very high	65 Å²	65	28 Å²	28	46%	0.455	14%	0.144	S	C	.	.	S	Bend	trans	-75.4	-19.4	-175.3	63.8	0	0	0	0	115.1	Q210 S211	Q210-S213 PolarHBondContact O-N 3.39Å; Q210-S213 VanDerWaalsContact O-N 3.09Å; Q210-S213 PolarHBondContact O-OG 3.45Å; S211-S213 VanDerWaalsContact C-N 3.3Å
214	T	92.8	Very high	94.9	Very high	3 Å²	3	24.7 Å²	24.7	2%	0.018	13%	0.129	C	C	.	.	S	Bend	trans	-58.9	156	175	-175.1	0	0	0	0	112.3	S173 E174 S211 N216 T219 K220	S173-T214 PolarHBondContact O-OG1 2.93Å; E174-T214 WeakPolarHBondContact OE1-CA 3.06Å; E174-T214 VanDerWaalsContact OE1-CB 3.28Å; E174-T214 WeakPolarHBondContact OE1-CB 3.48Å; E174-T214 PolarHBondContact OE1-OG1 3.35Å; E174-T214 PolarHBondContact OE2-OG1 3.43Å; E174-T214 VanDerWaalsContact OE2-OG1 3.07Å; S211-T214 WeakPolarHBondContact O-CG2 3.38Å; T214-N216 HydrophobicContact CG2-CB 4.42Å; T214-N216 WeakPolarHBondContact OG1-CB 3.38Å; T214-N216 PolarHBondContact OG1-N 3.31Å; T214-N216 VanDerWaalsContact OG1-N 3.17Å; T214-T219 HydrophobicContact CG2-CG2 4.01Å; T214-K220 HydrophobicContact CG2-CG 4.13Å; T214-K220 WeakPolarHBondContact O-CE 3.38Å; T214-K220 PolarHBondContact O-NZ 3.34Å
215	E	90.1	Very high	95	Very high	120 Å²	120	25.5 Å²	25.5	56%	0.561	13%	0.132	S	C	*	.	S	Bend	trans	-85.9	-14.7	166.3	-66.4	-141.4	109.7	0	0	112.5	E174 I217 K266	E174-E215 VanDerWaalsContact CD-N 3.33Å; E174-E215 PolarHBondContact OE1-N 3.43Å; E174-E215 VanDerWaalsContact OE2-CA 3.3Å; E174-E215 WeakPolarHBondContact OE2-CA 3.24Å; E174-E215 WeakPolarHBondContact OE2-CB 3.37Å; E174-E215 PolarHBondContact OE2-N 2.88Å; E215-I217 PolarHBondContact O-N 3.5Å; E215-K266 IonicContact OE1-NZ 2.61Å; E215-K266 PolarHBondContact OE1-NZ 2.9Å
216	N	91.4	Very high	94.9	Very high	30 Å²	30	25.1 Å²	25.1	16%	0.16	13%	0.131	C	C	.	.			trans	-65.4	100	180	-176.3	-20.8	0	0	0	112.5	E174 S175 T179 T214 K218 T219 K220	E174-N216 PolarHBondContact O-ND2 3.49Å; E174-N216 PolarHBondContact OE2-N 3.32Å; S175-N216 PolarHBondContact O-ND2 3.44Å; T179-N216 PolarHBondContact OG1-ND2 3.13Å; T214-N216 HydrophobicContact CG2-CB 4.42Å; T214-N216 WeakPolarHBondContact OG1-CB 3.38Å; T214-N216 PolarHBondContact OG1-N 3.31Å; T214-N216 VanDerWaalsContact OG1-N 3.17Å; N216-K218 PolarHBondContact O-N 3.04Å; N216-K218 VanDerWaalsContact O-N 3.1Å; N216-K218 WeakPolarHBondContact OD1-CB 3.45Å; N216-K218 PolarHBondContact OD1-N 2.66Å; N216-T219 WeakPolarHBondContact O-CB 3.33Å; N216-T219 PolarHBondContact O-N 2.72Å; N216-T219 PolarHBondContact OD1-N 3.13Å; N216-K220 PolarHBondContact O-N 3.22Å; N216-K220 VanDerWaalsContact O-N 3.1Å
217	I	92.6	Very high	95	Very high	29 Å²	29	23.6 Å²	23.6	15%	0.149	12%	0.122	C	C	.	.	H	α-helix	trans	-50.5	-36.8	-179.8	-60.3	169.6	0	0	0	113.1	E215 K220 V221 T268 D273 L277	E215-I217 PolarHBondContact O-N 3.5Å; I217-K220 PolarHBondContact O-N 3.14Å; I217-V221 HydrophobicContact CG2-CG2 4.39Å; I217-V221 WeakPolarHBondContact O-CG2 3.21Å; I217-V221 PolarHBondContact O-N 2.99Å; I217-T268 HydrophobicContact CD1-CG2 3.78Å; I217-D273 HydrophobicContact CD1-CB 3.81Å; I217-D273 HydrophobicContact CG2-CB 4.24Å; I217-L277 HydrophobicContact CG2-CB 3.94Å; I217-L277 HydrophobicContact CG2-CD2 4.33Å
218	K	92.5	Very high	94.9	Very high	136 Å²	136	23.5 Å²	23.5	59%	0.591	12%	0.122	S	C	*	.	H	α-helix	trans	-70.4	-36.2	-178.7	-64.3	-179.6	-179.6	176.2	0	111.7	T179 N216 A222	T179-K218 HydrophobicContact CG2-CB 3.94Å; N216-K218 PolarHBondContact O-N 3.04Å; N216-K218 VanDerWaalsContact O-N 3.1Å; N216-K218 WeakPolarHBondContact OD1-CB 3.45Å; N216-K218 PolarHBondContact OD1-N 2.66Å; K218-A222 WeakPolarHBondContact O-CB 3.41Å; K218-A222 PolarHBondContact O-N 3.01Å
219	T	95	Very high	94.8	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-66.4	-47.2	172.6	-54	0	0	0	0	110.1	T179 I182 T214 N216 V221 A222 V223	T179-T219 PolarHBondContact OG1-OG1 3.48Å; I182-T219 HydrophobicContact CG1-CG2 4.17Å; T214-T219 HydrophobicContact CG2-CG2 4.01Å; N216-T219 WeakPolarHBondContact O-CB 3.33Å; N216-T219 PolarHBondContact O-N 2.72Å; N216-T219 PolarHBondContact OD1-N 3.13Å; T219-V221 PolarHBondContact O-N 3.15Å; T219-A222 PolarHBondContact O-N 3.27Å; T219-A222 VanDerWaalsContact O-N 3.17Å; T219-V223 HydrophobicContact CG2-CG2 4.36Å; T219-V223 VanDerWaalsContact O-CG2 3.31Å; T219-V223 WeakPolarHBondContact O-CG2 3.41Å; T219-V223 PolarHBondContact O-N 3.25Å
220	K	95.6	Very high	94.6	Very high	13 Å²	13	23.5 Å²	23.5	6%	0.057	12%	0.122	C	C	.	.	H	α-helix	trans	-54.8	-47.8	174.9	-65.9	-160.3	-177	-161.1	0	112.7	L212 T214 N216 I217 A222 V223 L224 D263 L277	L212-K220 WeakPolarHBondContact O-CE 3.34Å; L212-K220 PolarHBondContact O-NZ 3.28Å; T214-K220 HydrophobicContact CG2-CG 4.13Å; T214-K220 WeakPolarHBondContact O-CE 3.38Å; T214-K220 PolarHBondContact O-NZ 3.34Å; N216-K220 PolarHBondContact O-N 3.22Å; N216-K220 VanDerWaalsContact O-N 3.1Å; I217-K220 PolarHBondContact O-N 3.14Å; K220-A222 PolarHBondContact O-N 3.18Å; K220-V223 PolarHBondContact O-N 3.2Å; K220-L224 WeakPolarHBondContact O-CB 3.41Å; K220-L224 VanDerWaalsContact O-CG 3.26Å; K220-L224 WeakPolarHBondContact O-CG 3.46Å; K220-L224 PolarHBondContact O-N 3.49Å; K220-D263 IonicContact NZ-OD1 2.63Å; K220-D263 PolarHBondContact NZ-OD1 2.98Å; K220-D263 IonicContact NZ-OD2 3.84Å; K220-D263 PolarHBondContact NZ-OD2 3.26Å; K220-L277 HydrophobicContact CB-CD1 3.69Å; K220-L277 HydrophobicContact CD-CD1 4.22Å
221	V	95.6	Very high	94.5	Very high	21 Å²	21	22.6 Å²	22.6	13%	0.127	12%	0.118	C	C	.	.	H	α-helix	trans	-60.3	-45.7	177.2	169	0	0	0	0	111.4	I217 T219 V223 L224 E225 L277 A280	I217-V221 HydrophobicContact CG2-CG2 4.39Å; I217-V221 WeakPolarHBondContact O-CG2 3.21Å; I217-V221 PolarHBondContact O-N 2.99Å; T219-V221 PolarHBondContact O-N 3.15Å; V221-V223 PolarHBondContact O-N 3.25Å; V221-L224 PolarHBondContact O-N 2.7Å; V221-E225 WeakPolarHBondContact O-CB 3.48Å; V221-E225 WeakPolarHBondContact O-CG 3.5Å; V221-E225 PolarHBondContact O-N 3.41Å; V221-L277 HydrophobicContact CG2-CB 4.4Å; V221-L277 HydrophobicContact CG2-CD1 4.24Å; V221-A280 HydrophobicContact CB-CB 4.42Å; V221-A280 HydrophobicContact CG1-CB 4.23Å; V221-A280 HydrophobicContact CG2-CB 4.12Å
222	A	95.4	Very high	94.2	Very high	17 Å²	17	24.3 Å²	24.3	14%	0.14	13%	0.127	C	C	.	.	H	α-helix	trans	-64.3	-38.1	178.9	0	0	0	0	0	112.8	I182 K218 T219 K220 I226	I182-A222 HydrophobicContact CG2-CB 3.82Å; K218-A222 WeakPolarHBondContact O-CB 3.41Å; K218-A222 PolarHBondContact O-N 3.01Å; T219-A222 PolarHBondContact O-N 3.27Å; T219-A222 VanDerWaalsContact O-N 3.17Å; K220-A222 PolarHBondContact O-N 3.18Å; A222-I226 WeakPolarHBondContact O-CG1 3Å; A222-I226 PolarHBondContact O-N 2.82Å; A222-I226 VanDerWaalsContact O-N 3.16Å
223	V	97.3	Very high	93.8	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-65.4	-49.2	174.8	169.7	0	0	0	0	111.2	I182 I208 L212 T219 K220 V221 E225 I226 L227	I182-V223 HydrophobicContact CD1-CG2 4.17Å; I182-V223 HydrophobicContact CG1-CG2 4.21Å; I182-V223 HydrophobicContact CG2-CG2 4.09Å; I208-V223 HydrophobicContact CG2-CG1 4.12Å; I208-V223 WeakPolarHBondContact O-CG1 3.33Å; L212-V223 HydrophobicContact CD2-CB 4.06Å; L212-V223 HydrophobicContact CD2-CG1 3.53Å; L212-V223 HydrophobicContact CG-CG1 3.76Å; T219-V223 HydrophobicContact CG2-CG2 4.36Å; T219-V223 VanDerWaalsContact O-CG2 3.31Å; T219-V223 WeakPolarHBondContact O-CG2 3.41Å; T219-V223 PolarHBondContact O-N 3.25Å; K220-V223 PolarHBondContact O-N 3.2Å; V221-V223 PolarHBondContact O-N 3.25Å; V223-E225 VanDerWaalsContact C-N 3.29Å; V223-E225 PolarHBondContact O-N 2.82Å; V223-I226 PolarHBondContact O-N 3.44Å; V223-I226 VanDerWaalsContact O-N 3.15Å; V223-L227 HydrophobicContact CG1-CD1 3.73Å; V223-L227 HydrophobicContact CG1-CG 4.2Å; V223-L227 WeakPolarHBondContact O-CG 3.06Å; V223-L227 PolarHBondContact O-N 3.45Å
224	L	97.6	Very high	93.3	Very high	5 Å²	5	28 Å²	28	3%	0.026	15%	0.149	C	C	.	.	H	α-helix	trans	-63.2	-34.6	179.2	-70	167.2	0	0	0	112.3	L212 K220 V221 G228 L260 L277 A280 I281 F284	L212-L224 HydrophobicContact CD2-CD2 4.03Å; L212-L224 HydrophobicContact CD2-CG 3.97Å; K220-L224 WeakPolarHBondContact O-CB 3.41Å; K220-L224 VanDerWaalsContact O-CG 3.26Å; K220-L224 WeakPolarHBondContact O-CG 3.46Å; K220-L224 PolarHBondContact O-N 3.49Å; V221-L224 PolarHBondContact O-N 2.7Å; L224-G228 WeakPolarHBondContact O-CA 3.37Å; L224-G228 PolarHBondContact O-N 2.9Å; L224-L260 HydrophobicContact CD2-CD1 3.64Å; L224-L277 HydrophobicContact CD1-CD1 4.15Å; L224-A280 HydrophobicContact CB-CB 4.08Å; L224-A280 HydrophobicContact CD1-CB 4.1Å; L224-I281 HydrophobicContact CD1-CB 4.47Å; L224-I281 HydrophobicContact CD1-CG1 3.53Å; L224-F284 HydrophobicContact CB-CB 4.49Å; L224-F284 HydrophobicContact CD2-CB 4.03Å; L224-F284 HydrophobicContact CD2-CD1 3.9Å; L224-F284 HydrophobicContact CD2-CD2 4.43Å; L224-F284 HydrophobicContact CD2-CG 3.85Å
225	E	95.4	Very high	92.9	Very high	18 Å²	18	30.6 Å²	30.6	8%	0.084	18%	0.176	C	C	.	.	H	α-helix	trans	-61.8	-46.5	171.1	-82.4	-179.4	-166.3	0	0	112.4	K186 V221 V223 A229 V1037 R1041	K186-E225 IonicContact NZ-OE2 3.58Å; K186-E225 PolarHBondContact NZ-OE2 2.92Å; V221-E225 WeakPolarHBondContact O-CB 3.48Å; V221-E225 WeakPolarHBondContact O-CG 3.5Å; V221-E225 PolarHBondContact O-N 3.41Å; V223-E225 VanDerWaalsContact C-N 3.29Å; V223-E225 PolarHBondContact O-N 2.82Å; E225-A229 VanDerWaalsContact O-CB 3.31Å; E225-A229 WeakPolarHBondContact O-CB 3.28Å; E225-A229 PolarHBondContact O-N 3.12Å; E225-V1037 HydrophobicContact CB-CG1 3.72Å; E225-V1037 HydrophobicContact CG-CG1 3.67Å; E225-V1037 VanDerWaalsContact OE2-CG1 3.3Å; E225-V1037 WeakPolarHBondContact OE2-CG1 3.43Å; E225-R1041 IonicContact OE1-CZ 2.61Å; E225-R1041 IonicContact OE1-NE 3.34Å; E225-R1041 PolarHBondContact OE1-NE 3.29Å; E225-R1041 IonicContact OE1-NH2 3.11Å; E225-R1041 PolarHBondContact OE1-NH2 3.38Å; E225-R1041 IonicContact OE2-NH2 2.67Å; E225-R1041 PolarHBondContact OE2-NH2 3.49Å
226	I	95.6	Very high	92.9	Very high	0 Å²	0	25 Å²	25	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-65.3	-52.3	178.1	-66	164.7	0	0	0	110.3	I182 K186 M189 I208 A222 V223 G228 A229 V230	I182-I226 HydrophobicContact CG2-CD1 3.63Å; K186-I226 HydrophobicContact CB-CD1 4.03Å; K186-I226 HydrophobicContact CB-CG1 4.21Å; K186-I226 HydrophobicContact CG-CD1 4.49Å; K186-I226 HydrophobicContact CG-CG1 4.13Å; M189-I226 HydrophobicContact CE-CG2 4.25Å; M189-I226 HydrophobicContact SD-CG2 3.7Å; I208-I226 HydrophobicContact CD1-CG2 4.36Å; I208-I226 HydrophobicContact CG2-CB 4.42Å; I208-I226 HydrophobicContact CG2-CG2 4.16Å; A222-I226 WeakPolarHBondContact O-CG1 3Å; A222-I226 PolarHBondContact O-N 2.82Å; A222-I226 VanDerWaalsContact O-N 3.16Å; V223-I226 PolarHBondContact O-N 3.44Å; V223-I226 VanDerWaalsContact O-N 3.15Å; I226-G228 VanDerWaalsContact C-N 3.3Å; I226-G228 PolarHBondContact O-N 3.21Å; I226-A229 PolarHBondContact O-N 2.91Å; I226-V230 HydrophobicContact CG2-CG2 4.33Å; I226-V230 WeakPolarHBondContact O-CB 3.22Å; I226-V230 VanDerWaalsContact O-CG2 3.25Å; I226-V230 WeakPolarHBondContact O-CG2 3.28Å; I226-V230 PolarHBondContact O-N 3.25Å
227	L	96.8	Very high	92.9	Very high	0 Å²	0	24 Å²	24	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-61.9	-39.6	-179	-63.8	176.1	0	0	0	111.4	I205 I208 A209 L212 V223 V230 C231 V240 M244 F284	I205-L227 HydrophobicContact CG2-CD2 3.6Å; I208-L227 HydrophobicContact CG2-CD2 4.07Å; I208-L227 HydrophobicContact CG2-CG 4.24Å; A209-L227 HydrophobicContact CB-CD1 4.25Å; L212-L227 HydrophobicContact CD1-CD1 4.44Å; V223-L227 HydrophobicContact CG1-CD1 3.73Å; V223-L227 HydrophobicContact CG1-CG 4.2Å; V223-L227 WeakPolarHBondContact O-CG 3.06Å; V223-L227 PolarHBondContact O-N 3.45Å; L227-V230 PolarHBondContact O-N 3.15Å; L227-C231 PolarHBondContact O-N 3.26Å; L227-V240 HydrophobicContact CB-CG1 4.42Å; L227-V240 HydrophobicContact CD2-CG2 4.35Å; L227-V240 WeakPolarHBondContact O-CG2 3.35Å; L227-M244 HydrophobicContact CD1-SD 4.43Å; L227-F284 HydrophobicContact CB-CD2 4Å; L227-F284 HydrophobicContact CB-CE2 3.62Å
228	G	94.9	Very high	92.8	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-62.5	-47.8	174.9	0	0	0	0	0	112.3	L224 I226 V230 C231 L232	L224-G228 WeakPolarHBondContact O-CA 3.37Å; L224-G228 PolarHBondContact O-N 2.9Å; I226-G228 VanDerWaalsContact C-N 3.3Å; I226-G228 PolarHBondContact O-N 3.21Å; G228-V230 PolarHBondContact O-N 2.63Å; G228-C231 WeakPolarHBondContact O-CB 3.15Å; G228-C231 PolarHBondContact O-N 3.33Å; G228-L232 WeakPolarHBondContact O-CD1 3.36Å
229	A	93.3	Very high	92.8	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-66.5	-34.9	177.5	0	0	0	0	0	112.7	E225 I226 C231 L232 F1033 V1037	E225-A229 VanDerWaalsContact O-CB 3.31Å; E225-A229 WeakPolarHBondContact O-CB 3.28Å; E225-A229 PolarHBondContact O-N 3.12Å; I226-A229 PolarHBondContact O-N 2.91Å; A229-C231 PolarHBondContact O-N 2.75Å; A229-L232 PolarHBondContact O-N 2.74Å; A229-F1033 HydrophobicContact CB-CD2 4.38Å; A229-F1033 HydrophobicContact CB-CE1 4.29Å; A229-F1033 HydrophobicContact CB-CE2 3.61Å; A229-F1033 HydrophobicContact CB-CZ 3.54Å; A229-V1037 HydrophobicContact CB-CG2 3.52Å
230	V	94.1	Very high	92.8	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-60.9	-30.8	173.1	171.1	0	0	0	0	112	M189 L199 I226 L227 G228 L232 V233 G236 V240 F1033	M189-V230 HydrophobicContact CE-CG2 3.54Å; L199-V230 HydrophobicContact CD2-CG1 3.92Å; L199-V230 HydrophobicContact CD2-CG2 4.38Å; I226-V230 HydrophobicContact CG2-CG2 4.33Å; I226-V230 WeakPolarHBondContact O-CB 3.22Å; I226-V230 VanDerWaalsContact O-CG2 3.25Å; I226-V230 WeakPolarHBondContact O-CG2 3.28Å; I226-V230 PolarHBondContact O-N 3.25Å; L227-V230 PolarHBondContact O-N 3.15Å; G228-V230 PolarHBondContact O-N 2.63Å; V230-L232 PolarHBondContact O-N 3.34Å; V230-V233 PolarHBondContact O-N 3.41Å; V230-V233 VanDerWaalsContact O-N 3.09Å; V230-G236 CarbonylContact O-C 3.45Å; V230-G236 WeakPolarHBondContact O-CA 3.39Å; V230-V240 HydrophobicContact CB-CG2 3.9Å; V230-V240 HydrophobicContact CG1-CG2 3.57Å; V230-F1033 HydrophobicContact CG2-CZ 4.38Å
231	C	93.4	Very high	92.7	Very high	4 Å²	4	23.3 Å²	23.3	3%	0.027	14%	0.141	C	C	.	.	H	α-helix	trans	-61.9	-26.3	173.3	-73.3	0	0	0	0	113.7	L227 G228 A229 H237 A287 Q291	L227-C231 PolarHBondContact O-N 3.26Å; G228-C231 WeakPolarHBondContact O-CB 3.15Å; G228-C231 PolarHBondContact O-N 3.33Å; A229-C231 PolarHBondContact O-N 2.75Å; C231-H237 HydrophobicContact CB-CB 4.43Å; C231-A287 HydrophobicContact CB-CB 4.01Å; C231-Q291 HydrophobicContact CB-CB 4.28Å; C231-Q291 HydrophobicContact CB-CG 4.42Å; C231-Q291 VanDerWaalsContact O-CB 3.26Å; C231-Q291 WeakPolarHBondContact O-CB 3.49Å
232	L	89.6	Confident	92.6	Very high	42 Å²	42	26.1 Å²	26.1	22%	0.22	15%	0.153	C	C	.	.	H	α-helix	trans	-82	-16	174.8	-64.5	103.4	0	0	0	113.5	G228 A229 V230 Q291 L1036 L1040 V1045	G228-L232 WeakPolarHBondContact O-CD1 3.36Å; A229-L232 PolarHBondContact O-N 2.74Å; V230-L232 PolarHBondContact O-N 3.34Å; L232-Q291 HydrophobicContact CG-CG 4.35Å; L232-L1036 HydrophobicContact CB-CD2 4.35Å; L232-L1036 HydrophobicContact CD2-CD2 4.22Å; L232-L1040 HydrophobicContact CD1-CD1 4.48Å; L232-L1040 HydrophobicContact CD1-CD2 4.03Å; L232-V1045 HydrophobicContact CD2-CG1 3.84Å; L232-V1045 HydrophobicContact CD2-CG2 4.05Å
233	V	87.8	Confident	92.6	Very high	24 Å²	24	25.3 Å²	25.3	15%	0.145	15%	0.146	C	C	.	.	S	Bend	trans	-84.3	136.9	-177.8	-173.7	0	0	0	0	110	L199 V230 G235 G236 F1033	L199-V233 HydrophobicContact CD1-CB 4.45Å; L199-V233 HydrophobicContact CD1-CG1 3.7Å; V230-V233 PolarHBondContact O-N 3.41Å; V230-V233 VanDerWaalsContact O-N 3.09Å; V233-G235 PolarHBondContact O-N 3.39Å; V233-G236 PolarHBondContact O-N 3.03Å; V233-F1033 HydrophobicContact CG2-CE2 4.43Å
234	P	82.6	Confident	92.5	Very high	126 Å²	126	25.4 Å²	25.4	82%	0.818	15%	0.146	S	C	*	.	T	Hydrogen-bonded Turn	trans	-50.2	122.7	178.6	-31	37	0	0	0	113.4	G236	P234-G236 PolarHBondContact O-N 3.18Å
235	G	84.2	Confident	92.2	Very high	58 Å²	58	26.4 Å²	26.4	60%	0.598	15%	0.151	S	C	*	.	T	Hydrogen-bonded Turn	trans	75.7	-10.7	-176.7	0	0	0	0	0	115.9	V233	V233-G235 PolarHBondContact O-N 3.39Å
236	G	89.6	Confident	92.1	Very high	1 Å²	1	28.6 Å²	28.6	1%	0.01	16%	0.162	C	C	.	.	H	α-helix	trans	-68.5	-40.8	-179.1	0	0	0	0	0	113.5	V230 V233 P234 K238 K239 V240	V230-G236 CarbonylContact O-C 3.45Å; V230-G236 WeakPolarHBondContact O-CA 3.39Å; V233-G236 PolarHBondContact O-N 3.03Å; P234-G236 PolarHBondContact O-N 3.18Å; G236-K238 VanDerWaalsContact C-N 3.31Å; G236-K238 PolarHBondContact O-N 2.98Å; G236-K239 WeakPolarHBondContact O-CA 2.94Å; G236-K239 WeakPolarHBondContact O-CB 3.46Å; G236-K239 PolarHBondContact O-N 2.92Å; G236-V240 PolarHBondContact O-N 3.15Å
237	H	92.6	Very high	92.1	Very high	10 Å²	10	28.8 Å²	28.8	5%	0.046	16%	0.162	C	C	.	.	H	α-helix	trans	-49.8	-45.6	175.8	175.8	-93	0	0	0	113.5	C231 K239 V240 L241 V288 Q291 F300	C231-H237 HydrophobicContact CB-CB 4.43Å; H237-K239 VanDerWaalsContact C-N 3.34Å; H237-K239 PolarHBondContact O-N 3.37Å; H237-V240 PolarHBondContact O-N 2.86Å; H237-L241 PolarHBondContact O-N 3.44Å; H237-L241 VanDerWaalsContact O-N 3.09Å; H237-V288 PolarHBondContact NE2-O 2.67Å; H237-Q291 PolarHBondContact CD2-O 3.05Å; H237-Q291 PolarHBondContact CE1-O 3.21Å; H237-Q291 PolarHBondContact NE2-O 3.12Å; H237-F300 AromaticContact CE1-CE1 3.76Å; H237-F300 AromaticContact CE1-CZ 3.88Å
238	K	90.6	Very high	91.9	Very high	80 Å²	80	30.9 Å²	30.9	35%	0.348	17%	0.172	S	C	.	.	H	α-helix	trans	-64.3	-37.9	176.7	-174.8	165.5	-174.4	157.6	0	112.3	G236 L241 Q242 D421 S424	G236-K238 VanDerWaalsContact C-N 3.31Å; G236-K238 PolarHBondContact O-N 2.98Å; K238-L241 PolarHBondContact O-N 2.78Å; K238-Q242 VanDerWaalsContact O-CG 3.3Å; K238-Q242 WeakPolarHBondContact O-CG 3.25Å; K238-Q242 PolarHBondContact O-N 3.06Å; K238-Q242 VanDerWaalsContact O-N 3.07Å; K238-D421 PolarHBondContact NZ-O 3.18Å; K238-S424 WeakPolarHBondContact CE-OG 3.42Å
239	K	92.1	Very high	91.7	Very high	82 Å²	82	38.6 Å²	38.6	36%	0.357	21%	0.206	S	C	.	.	H	α-helix	trans	-68.4	-33.8	176.3	-68.9	-175.8	170.8	180	0	112.1	L199 I205 G236 H237 Q242 A243	L199-K239 PolarHBondContact O-NZ 3.41Å; I205-K239 HydrophobicContact CG1-CB 4.46Å; G236-K239 WeakPolarHBondContact O-CA 2.94Å; G236-K239 WeakPolarHBondContact O-CB 3.46Å; G236-K239 PolarHBondContact O-N 2.92Å; H237-K239 VanDerWaalsContact C-N 3.34Å; H237-K239 PolarHBondContact O-N 3.37Å; K239-Q242 PolarHBondContact O-N 2.68Å; K239-A243 VanDerWaalsContact O-CB 3.3Å; K239-A243 WeakPolarHBondContact O-CB 3.48Å; K239-A243 PolarHBondContact O-N 3.48Å
240	V	95.3	Very high	91.8	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-65.9	-45.9	173.2	171.6	0	0	0	0	111.2	I205 L227 V230 G236 H237 Q242 A243 M244 F284 V288	I205-V240 HydrophobicContact CG2-CG2 4.33Å; L227-V240 HydrophobicContact CB-CG1 4.42Å; L227-V240 HydrophobicContact CD2-CG2 4.35Å; L227-V240 WeakPolarHBondContact O-CG2 3.35Å; V230-V240 HydrophobicContact CB-CG2 3.9Å; V230-V240 HydrophobicContact CG1-CG2 3.57Å; G236-V240 PolarHBondContact O-N 3.15Å; H237-V240 PolarHBondContact O-N 2.86Å; V240-Q242 VanDerWaalsContact C-N 3.31Å; V240-Q242 PolarHBondContact O-N 3.28Å; V240-A243 PolarHBondContact O-N 3.43Å; V240-A243 VanDerWaalsContact O-N 3.15Å; V240-M244 WeakPolarHBondContact O-CG 3.46Å; V240-M244 PolarHBondContact O-N 2.88Å; V240-F284 HydrophobicContact CG1-CE2 3.68Å; V240-F284 HydrophobicContact CG1-CZ 3.92Å; V240-V288 HydrophobicContact CG1-CG2 4.42Å
241	L	93.8	Very high	91.7	Very high	1 Å²	1	46.1 Å²	46.1	1%	0.005	24%	0.243	C	C	.	.	H	α-helix	trans	-61.5	-39.3	176.2	-69.5	174.3	0	0	0	112.4	H237 K238 M244 L245 F257 V288 F300 L304	H237-L241 PolarHBondContact O-N 3.44Å; H237-L241 VanDerWaalsContact O-N 3.09Å; K238-L241 PolarHBondContact O-N 2.78Å; L241-M244 PolarHBondContact O-N 3.08Å; L241-L245 WeakPolarHBondContact O-CG 3.27Å; L241-L245 PolarHBondContact O-N 3.14Å; L241-F257 HydrophobicContact CD2-CZ 4.23Å; L241-V288 HydrophobicContact CD2-CG1 3.91Å; L241-F300 HydrophobicContact CD1-CZ 3.81Å; L241-L304 HydrophobicContact CD2-CD1 4.5Å; L241-L304 HydrophobicContact CD2-CD2 4.32Å
242	Q	92.5	Very high	91.6	Very high	81 Å²	81	51 Å²	51	38%	0.379	28%	0.277	S	S	.	.	H	α-helix	trans	-65.3	-40.3	172.9	-71.3	174.4	-8.5	0	0	112.4	K238 K239 V240 M244 L245 H246 S424	K238-Q242 VanDerWaalsContact O-CG 3.3Å; K238-Q242 WeakPolarHBondContact O-CG 3.25Å; K238-Q242 PolarHBondContact O-N 3.06Å; K238-Q242 VanDerWaalsContact O-N 3.07Å; K239-Q242 PolarHBondContact O-N 2.68Å; V240-Q242 VanDerWaalsContact C-N 3.31Å; V240-Q242 PolarHBondContact O-N 3.28Å; Q242-M244 VanDerWaalsContact C-N 3.35Å; Q242-M244 PolarHBondContact O-N 2.95Å; Q242-L245 PolarHBondContact O-N 3.18Å; Q242-H246 PolarHBondContact O-N 3.24Å; Q242-S424 WeakPolarHBondContact CG-OG 3.48Å; Q242-S424 PolarHBondContact NE2-OG 2.99Å
243	A	94.8	Very high	91.6	Very high	0 Å²	0	50 Å²	50	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-66.2	-34	175.3	0	0	0	0	0	112.7	I205 N206 A209 K239 V240 H246 Y247	I205-A243 HydrophobicContact CB-CB 4.21Å; I205-A243 HydrophobicContact CG2-CB 3.69Å; N206-A243 WeakPolarHBondContact OD1-CA 3.29Å; A209-A243 HydrophobicContact CB-CB 4Å; K239-A243 VanDerWaalsContact O-CB 3.3Å; K239-A243 WeakPolarHBondContact O-CB 3.48Å; K239-A243 PolarHBondContact O-N 3.48Å; V240-A243 PolarHBondContact O-N 3.43Å; V240-A243 VanDerWaalsContact O-N 3.15Å; A243-H246 WeakPolarHBondContact O-CB 3.46Å; A243-H246 PolarHBondContact O-N 3.26Å; A243-Y247 WeakPolarHBondContact O-CB 3.28Å; A243-Y247 PolarHBondContact O-N 3.38Å
244	M	95.3	Very high	91.6	Very high	2 Å²	2	58.7 Å²	58.7	1%	0.01	30%	0.302	C	S	.	.	H	α-helix	trans	-71	-35	172.4	-63.4	-52.2	-56.2	0	0	112.2	L212 L227 V240 L241 Q242 H246 Y247 Q248 R256 F257 F284	L212-M244 HydrophobicContact CD1-CE 4.06Å; L212-M244 HydrophobicContact CD1-SD 4.21Å; L227-M244 HydrophobicContact CD1-SD 4.43Å; V240-M244 WeakPolarHBondContact O-CG 3.46Å; V240-M244 PolarHBondContact O-N 2.88Å; L241-M244 PolarHBondContact O-N 3.08Å; Q242-M244 VanDerWaalsContact C-N 3.35Å; Q242-M244 PolarHBondContact O-N 2.95Å; M244-H246 VanDerWaalsContact C-N 3.33Å; M244-Y247 HydrophobicContact CE-CD1 3.9Å; M244-Y247 PolarHBondContact O-N 2.63Å; M244-Q248 PolarHBondContact O-N 3.44Å; M244-R256 HydrophobicContact CB-CB 4.22Å; M244-R256 WeakPolarHBondContact CE-O 3.26Å; M244-R256 WeakPolarHBondContact O-CB 3.21Å; M244-F257 HydrophobicContact CB-CE1 4.2Å; M244-F257 HydrophobicContact CE-CD1 4.21Å; M244-F257 HydrophobicContact CE-CE1 4.46Å; M244-F257 HydrophobicContact CG-CE1 3.98Å; M244-F284 HydrophobicContact CG-CZ 4.28Å; M244-F284 HydrophobicContact SD-CZ 4.21Å
245	L	92.1	Very high	91.9	Very high	25 Å²	25	54.8 Å²	54.8	13%	0.131	28%	0.275	C	S	.	.	H	α-helix	trans	-67.3	-31.9	170.1	-72.2	167.8	0	0	0	112.6	L241 Q242 R256 S424	L241-L245 WeakPolarHBondContact O-CG 3.27Å; L241-L245 PolarHBondContact O-N 3.14Å; Q242-L245 PolarHBondContact O-N 3.18Å; L245-R256 HydrophobicContact CD2-CB 4.43Å; L245-S424 VanDerWaalsContact CD1-O 3.29Å; L245-S424 WeakPolarHBondContact CD1-O 3.18Å
246	H	93.3	Very high	92.2	Very high	65 Å²	65	52.2 Å²	52.2	30%	0.301	25%	0.247	S	C	.	.	H	α-helix	trans	-69.1	-47	169.7	-175.7	-71.7	0	0	0	111.2	N206 Q210 Q242 A243 M244 Q248 K249 Y250	N206-H246 HydrophobicContact CB-CB 4.35Å; Q210-H246 PolarHBondContact NE2-CE1 2.94Å; Q210-H246 VanDerWaalsContact NE2-CE1 3.29Å; Q242-H246 PolarHBondContact O-N 3.24Å; A243-H246 WeakPolarHBondContact O-CB 3.46Å; A243-H246 PolarHBondContact O-N 3.26Å; M244-H246 VanDerWaalsContact C-N 3.33Å; H246-Q248 VanDerWaalsContact C-N 3.27Å; H246-Q248 PolarHBondContact O-N 2.94Å; H246-K249 PolarHBondContact O-N 2.84Å; H246-K249 VanDerWaalsContact O-N 3.07Å; H246-Y250 PolarHBondContact O-N 3.39Å
247	Y	95.1	Very high	92.5	Very high	4 Å²	4	52.1 Å²	52.1	2%	0.016	25%	0.247	C	C	.	.	H	α-helix	trans	-57.3	-40.4	176.9	-177.2	-110.1	0	0	0	111.6	A209 L212 A243 M244 K249 Y250 A251 E253	A209-Y247 WeakPolarHBondContact O-CD2 3.33Å; A209-Y247 WeakPolarHBondContact O-CE2 3.25Å; L212-Y247 HydrophobicContact CB-CE1 4.28Å; L212-Y247 HydrophobicContact CB-CE2 3.88Å; L212-Y247 HydrophobicContact CD1-CE1 4.41Å; A243-Y247 WeakPolarHBondContact O-CB 3.28Å; A243-Y247 PolarHBondContact O-N 3.38Å; M244-Y247 HydrophobicContact CE-CD1 3.9Å; M244-Y247 PolarHBondContact O-N 2.63Å; Y247-K249 VanDerWaalsContact C-N 3.3Å; Y247-K249 PolarHBondContact O-N 3.25Å; Y247-Y250 HydrophobicContact CD2-CD1 4.19Å; Y247-Y250 HydrophobicContact CE2-CD1 4.24Å; Y247-Y250 PolarHBondContact O-N 3.09Å; Y247-Y250 VanDerWaalsContact O-N 3.14Å; Y247-A251 HydrophobicContact CE1-CB 4.12Å; Y247-A251 HydrophobicContact CE2-CB 4.06Å; Y247-A251 WeakPolarHBondContact O-CB 3.13Å; Y247-A251 PolarHBondContact O-N 3.24Å; Y247-E253 WeakPolarHBondContact CE1-OE1 3.31Å
248	Q	93.4	Very high	92.6	Very high	44 Å²	44	54.3 Å²	54.3	21%	0.206	26%	0.257	C	S	.	.	H	α-helix	trans	-53	-46.9	173.7	-167.1	-172.5	-29.1	0	0	112.4	M244 H246 S252 E253 R254 R256	M244-Q248 PolarHBondContact O-N 3.44Å; H246-Q248 VanDerWaalsContact C-N 3.27Å; H246-Q248 PolarHBondContact O-N 2.94Å; Q248-S252 CarbonylContact O-C 3.6Å; Q248-S252 WeakPolarHBondContact O-CA 3.4Å; Q248-S252 PolarHBondContact O-N 2.94Å; Q248-S252 VanDerWaalsContact O-N 3.15Å; Q248-E253 HydrophobicContact CG-CB 3.99Å; Q248-E253 WeakPolarHBondContact CG-O 3.29Å; Q248-E253 PolarHBondContact NE2-O 3.15Å; Q248-E253 PolarHBondContact O-N 2.89Å; Q248-R254 VanDerWaalsContact NE2-C 3.32Å; Q248-R254 PolarHBondContact NE2-O 2.9Å; Q248-R254 VanDerWaalsContact NE2-O 3.1Å; Q248-R256 HydrophobicContact CB-CB 4.06Å; Q248-R256 HydrophobicContact CG-CB 4.49Å; Q248-R256 VanDerWaalsContact OE1-N 3.15Å
249	K	91.6	Very high	92.7	Very high	162 Å²	162	52.1 Å²	52.1	70%	0.704	25%	0.251	S	S	*	.	H	α-helix	trans	-69	-38.9	179.6	-64.4	177.1	-176.2	178.3	0	111.6	H246 Y247	H246-K249 PolarHBondContact O-N 2.84Å; H246-K249 VanDerWaalsContact O-N 3.07Å; Y247-K249 VanDerWaalsContact C-N 3.3Å; Y247-K249 PolarHBondContact O-N 3.25Å
250	Y	93.5	Very high	92.9	Very high	120 Å²	120	48.6 Å²	48.6	47%	0.471	24%	0.236	S	C	.	.	H	α-helix	trans	-67.5	-53.1	179.5	172.7	-95.8	0	0	0	112.5	Q210 H246 Y247 S252	Q210-Y250 HydrophobicContact CB-CD1 4.23Å; Q210-Y250 HydrophobicContact CB-CE1 3.93Å; Q210-Y250 HydrophobicContact CB-CE2 4.48Å; Q210-Y250 HydrophobicContact CG-CD1 3.79Å; Q210-Y250 HydrophobicContact CG-CD2 3.86Å; Q210-Y250 HydrophobicContact CG-CE1 3.93Å; Q210-Y250 HydrophobicContact CG-CE2 4Å; Q210-Y250 HydrophobicContact CG-CG 3.75Å; H246-Y250 PolarHBondContact O-N 3.39Å; Y247-Y250 HydrophobicContact CD2-CD1 4.19Å; Y247-Y250 HydrophobicContact CE2-CD1 4.24Å; Y247-Y250 PolarHBondContact O-N 3.09Å; Y247-Y250 VanDerWaalsContact O-N 3.14Å; Y250-S252 PolarHBondContact O-N 3.16Å
251	A	92.9	Very high	92.9	Very high	37 Å²	37	48.9 Å²	48.9	31%	0.306	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.2	1.3	178.7	0	0	0	0	0	113.6	Y247 E253	Y247-A251 HydrophobicContact CE1-CB 4.12Å; Y247-A251 HydrophobicContact CE2-CB 4.06Å; Y247-A251 WeakPolarHBondContact O-CB 3.13Å; Y247-A251 PolarHBondContact O-N 3.24Å; A251-E253 HydrophobicContact CB-CG 3.96Å; A251-E253 PolarHBondContact O-N 3.35Å
252	S	91.4	Very high	92.9	Very high	108 Å²	108	52.9 Å²	52.9	76%	0.755	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	55	33.7	-175.8	-59.7	0	0	0	0	114	Q248 Y250	Q248-S252 CarbonylContact O-C 3.6Å; Q248-S252 WeakPolarHBondContact O-CA 3.4Å; Q248-S252 PolarHBondContact O-N 2.94Å; Q248-S252 VanDerWaalsContact O-N 3.15Å; Y250-S252 PolarHBondContact O-N 3.16Å
253	E	90.5	Very high	93	Very high	19 Å²	19	49.8 Å²	49.8	9%	0.089	25%	0.245	C	C	.	.			trans	-77	145.3	-177.2	-73.7	179.5	-147.3	0	0	112.7	Y247 Q248 A251 T255 Q258 T259	Y247-E253 WeakPolarHBondContact CE1-OE1 3.31Å; Q248-E253 HydrophobicContact CG-CB 3.99Å; Q248-E253 WeakPolarHBondContact CG-O 3.29Å; Q248-E253 PolarHBondContact NE2-O 3.15Å; Q248-E253 PolarHBondContact O-N 2.89Å; A251-E253 HydrophobicContact CB-CG 3.96Å; A251-E253 PolarHBondContact O-N 3.35Å; E253-T255 VanDerWaalsContact C-N 3.27Å; E253-T255 WeakPolarHBondContact CB-O 3.3Å; E253-T255 PolarHBondContact O-N 3.3Å; E253-Q258 HydrophobicContact CB-CB 4.3Å; E253-Q258 HydrophobicContact CG-CB 4.25Å; E253-Q258 WeakPolarHBondContact OE2-CA 3.34Å; E253-Q258 VanDerWaalsContact OE2-CB 3.3Å; E253-Q258 WeakPolarHBondContact OE2-CB 3.44Å; E253-Q258 PolarHBondContact OE2-N 3.01Å; E253-T259 WeakPolarHBondContact OE1-CB 3.38Å; E253-T259 PolarHBondContact OE1-OG1 3.01Å; E253-T259 PolarHBondContact OE2-N 3.06Å
254	R	86.8	Confident	93	Very high	208 Å²	208	49.8 Å²	49.8	79%	0.785	25%	0.245	S	C	*	.	S	Bend	trans	-65.5	-30.6	175.9	-173.2	177.6	175.1	-160.3	-5.1	112.7	Q248	Q248-R254 VanDerWaalsContact NE2-C 3.32Å; Q248-R254 PolarHBondContact NE2-O 2.9Å; Q248-R254 VanDerWaalsContact NE2-O 3.1Å
255	T	88.6	Confident	92.9	Very high	43 Å²	43	53 Å²	53	26%	0.264	26%	0.261	S	S	.	.	S	Bend	trans	-147.1	152.3	174.3	66.5	0	0	0	0	109.3	E253 F257 Q258	E253-T255 VanDerWaalsContact C-N 3.27Å; E253-T255 WeakPolarHBondContact CB-O 3.3Å; E253-T255 PolarHBondContact O-N 3.3Å; T255-F257 PolarHBondContact O-N 2.96Å; T255-Q258 PolarHBondContact O-N 3.15Å
256	R	90.9	Very high	92.8	Very high	4 Å²	4	56.5 Å²	56.5	2%	0.015	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-3.7	-171.6	60.6	171.7	164.8	-169.7	-9.5	118.2	M244 L245 Q248 E307 D423	M244-R256 HydrophobicContact CB-CB 4.22Å; M244-R256 WeakPolarHBondContact CE-O 3.26Å; M244-R256 WeakPolarHBondContact O-CB 3.21Å; L245-R256 HydrophobicContact CD2-CB 4.43Å; Q248-R256 HydrophobicContact CB-CB 4.06Å; Q248-R256 HydrophobicContact CG-CB 4.49Å; Q248-R256 VanDerWaalsContact OE1-N 3.15Å; R256-E307 IonicContact CZ-OE1 3.15Å; R256-E307 IonicContact CZ-OE2 3.98Å; R256-E307 IonicContact NE-OE1 2.68Å; R256-E307 IonicContact NE-OE2 3.06Å; R256-E307 PolarHBondContact NE-OE2 2.8Å; R256-E307 IonicContact NH2-OE1 2.78Å; R256-E307 PolarHBondContact NH2-OE1 2.82Å; R256-E307 IonicContact NH2-OE2 3.14Å; R256-E307 PolarHBondContact NH2-OE2 2.96Å; R256-E307 VanDerWaalsContact NH2-OE2 3.17Å; R256-D423 IonicContact CZ-OD1 3.73Å; R256-D423 VanDerWaalsContact CZ-OD1 3.31Å; R256-D423 IonicContact CZ-OD2 2.75Å; R256-D423 IonicContact NH1-OD1 2.67Å; R256-D423 PolarHBondContact NH1-OD1 3.34Å; R256-D423 IonicContact NH1-OD2 2.74Å; R256-D423 VanDerWaalsContact NH2-CG 3.29Å; R256-D423 IonicContact NH2-OD1 2.74Å; R256-D423 PolarHBondContact NH2-OD1 2.82Å; R256-D423 IonicContact NH2-OD2 2.65Å; R256-D423 PolarHBondContact NH2-OD2 3.14Å
257	F	95.4	Very high	92.3	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-127.3	13.6	-179.2	-58.8	-60	0	0	0	112.8	L241 M244 T255 L260 I261 F284 V288 E307 F308 L311	L241-F257 HydrophobicContact CD2-CZ 4.23Å; M244-F257 HydrophobicContact CB-CE1 4.2Å; M244-F257 HydrophobicContact CE-CD1 4.21Å; M244-F257 HydrophobicContact CE-CE1 4.46Å; M244-F257 HydrophobicContact CG-CE1 3.98Å; T255-F257 PolarHBondContact O-N 2.96Å; F257-L260 HydrophobicContact CD1-CD2 4.05Å; F257-L260 WeakPolarHBondContact O-CB 3.43Å; F257-L260 PolarHBondContact O-N 3.44Å; F257-I261 PolarHBondContact O-N 2.86Å; F257-F284 HydrophobicContact CE1-CE1 4.43Å; F257-V288 HydrophobicContact CZ-CG1 4.34Å; F257-E307 WeakPolarHBondContact CE2-OE2 3.24Å; F257-F308 HydrophobicContact CB-CD1 4.32Å; F257-F308 HydrophobicContact CB-CE1 3.82Å; F257-F308 AromaticContact CD1-CE1 3.9Å; F257-F308 HydrophobicContact CD1-CE1 3.9Å; F257-F308 HydrophobicContact CD1-CZ 4.05Å; F257-F308 HydrophobicContact CD2-CD1 4.32Å; F257-F308 AromaticContact CD2-CE1 3.65Å; F257-F308 HydrophobicContact CD2-CE1 3.65Å; F257-F308 AromaticContact CD2-CZ 3.77Å; F257-F308 HydrophobicContact CD2-CZ 3.77Å; F257-F308 HydrophobicContact CE1-CE1 4.35Å; F257-F308 HydrophobicContact CE1-CZ 4.03Å; F257-F308 HydrophobicContact CE2-CE1 4.14Å; F257-F308 HydrophobicContact CE2-CE2 4.32Å; F257-F308 AromaticContact CE2-CZ 3.76Å; F257-F308 HydrophobicContact CE2-CZ 3.76Å; F257-F308 HydrophobicContact CG-CD1 4.36Å; F257-F308 AromaticContact CG-CE1 3.53Å; F257-F308 HydrophobicContact CG-CE1 3.53Å; F257-F308 AromaticContact CG-CZ 3.94Å; F257-F308 HydrophobicContact CG-CZ 3.94Å; F257-F308 HydrophobicContact CZ-CE1 4.47Å; F257-F308 AromaticContact CZ-CZ 3.89Å; F257-F308 HydrophobicContact CZ-CZ 3.89Å; F257-L311 HydrophobicContact CB-CD1 3.67Å
258	Q	94.4	Very high	91.5	Very high	56 Å²	56	59.3 Å²	59.3	26%	0.262	30%	0.301	S	S	.	.	H	α-helix	trans	-65.5	-50	-173.4	-177.7	70.5	78	0	0	111.8	E253 T255 L260 I261 N262 L311	E253-Q258 HydrophobicContact CB-CB 4.3Å; E253-Q258 HydrophobicContact CG-CB 4.25Å; E253-Q258 WeakPolarHBondContact OE2-CA 3.34Å; E253-Q258 VanDerWaalsContact OE2-CB 3.3Å; E253-Q258 WeakPolarHBondContact OE2-CB 3.44Å; E253-Q258 PolarHBondContact OE2-N 3.01Å; T255-Q258 PolarHBondContact O-N 3.15Å; Q258-L260 VanDerWaalsContact C-N 3.29Å; Q258-L260 PolarHBondContact O-N 3.07Å; Q258-I261 PolarHBondContact O-N 3.15Å; Q258-N262 PolarHBondContact NE2-OD1 2.79Å; Q258-N262 PolarHBondContact O-N 3.33Å; Q258-N262 PolarHBondContact O-ND2 3.48Å; Q258-N262 PolarHBondContact O-OD1 2.83Å; Q258-N262 VanDerWaalsContact O-OD1 3.11Å; Q258-L311 HydrophobicContact CB-CD2 4.44Å
259	T	93.3	Very high	90.5	Very high	34 Å²	34	60.5 Å²	60.5	21%	0.209	33%	0.326	C	S	.	.	H	α-helix	trans	-64.6	-36.1	178.3	-65.1	0	0	0	0	111.6	E253 I261 N262 D263	E253-T259 WeakPolarHBondContact OE1-CB 3.38Å; E253-T259 PolarHBondContact OE1-OG1 3.01Å; E253-T259 PolarHBondContact OE2-N 3.06Å; T259-I261 PolarHBondContact O-N 3.48Å; T259-N262 WeakPolarHBondContact O-CB 3.43Å; T259-N262 PolarHBondContact O-N 2.96Å; T259-D263 WeakPolarHBondContact CG2-OD2 3.38Å; T259-D263 WeakPolarHBondContact O-CB 3.46Å; T259-D263 PolarHBondContact O-N 3.44Å
260	L	95.3	Very high	90.1	Very high	8 Å²	8	60.9 Å²	60.9	4%	0.042	32%	0.323	C	S	.	.	H	α-helix	trans	-59.5	-43.1	178.8	-172.8	75.3	0	0	0	112.5	L224 F257 Q258 L264 I281 F284 I285 F308	L224-L260 HydrophobicContact CD2-CD1 3.64Å; F257-L260 HydrophobicContact CD1-CD2 4.05Å; F257-L260 WeakPolarHBondContact O-CB 3.43Å; F257-L260 PolarHBondContact O-N 3.44Å; Q258-L260 VanDerWaalsContact C-N 3.29Å; Q258-L260 PolarHBondContact O-N 3.07Å; L260-L264 PolarHBondContact O-N 3.44Å; L260-I281 HydrophobicContact CD1-CB 4.33Å; L260-I281 HydrophobicContact CD1-CG1 3.91Å; L260-I281 HydrophobicContact CD1-CG2 3.82Å; L260-I281 HydrophobicContact CD2-CG2 4.43Å; L260-I281 HydrophobicContact CG-CG2 3.8Å; L260-F284 HydrophobicContact CD1-CD1 4.24Å; L260-F284 HydrophobicContact CD2-CD1 3.8Å; L260-F284 HydrophobicContact CD2-CE1 3.8Å; L260-I285 HydrophobicContact CD2-CD1 4.13Å; L260-I285 HydrophobicContact CD2-CG1 3.87Å; L260-F308 HydrophobicContact CD2-CE1 4.29Å
261	I	95.8	Very high	89.7	Confident	6 Å²	6	61.2 Å²	61.2	3%	0.031	32%	0.324	C	S	.	.	H	α-helix	trans	-77.7	-31.3	176.8	-59.9	-57	0	0	0	111.5	F257 Q258 T259 L264 D265 I285 F308 L311 I313	F257-I261 PolarHBondContact O-N 2.86Å; Q258-I261 PolarHBondContact O-N 3.15Å; T259-I261 PolarHBondContact O-N 3.48Å; I261-L264 HydrophobicContact CD1-CD2 4.14Å; I261-L264 WeakPolarHBondContact O-CB 3.41Å; I261-L264 PolarHBondContact O-N 3.45Å; I261-D265 PolarHBondContact O-N 2.93Å; I261-I285 HydrophobicContact CD1-CD1 3.86Å; I261-F308 HydrophobicContact CD1-CD1 4.03Å; I261-F308 HydrophobicContact CG1-CD1 4.35Å; I261-L311 HydrophobicContact CB-CB 4.38Å; I261-L311 HydrophobicContact CG1-CB 4.09Å; I261-L311 HydrophobicContact CG1-CD1 4.05Å; I261-L311 HydrophobicContact CG2-CB 4.33Å; I261-I313 HydrophobicContact CD1-CB 4.31Å; I261-I313 HydrophobicContact CD1-CD1 3.85Å; I261-I313 HydrophobicContact CD1-CG1 3.98Å
262	N	94.3	Very high	89.2	Confident	84 Å²	84	69.5 Å²	69.5	45%	0.449	35%	0.347	S	S	.	.	H	α-helix	trans	-63.1	-44.7	172.1	-63.7	-8.8	0	0	0	111.7	Q258 T259 L264 D265 K266	Q258-N262 PolarHBondContact NE2-OD1 2.79Å; Q258-N262 PolarHBondContact O-N 3.33Å; Q258-N262 PolarHBondContact O-ND2 3.48Å; Q258-N262 PolarHBondContact O-OD1 2.83Å; Q258-N262 VanDerWaalsContact O-OD1 3.11Å; T259-N262 WeakPolarHBondContact O-CB 3.43Å; T259-N262 PolarHBondContact O-N 2.96Å; N262-L264 VanDerWaalsContact C-N 3.25Å; N262-L264 PolarHBondContact O-N 3.49Å; N262-D265 PolarHBondContact O-N 3.04Å; N262-K266 VanDerWaalsContact O-CB 3.29Å; N262-K266 WeakPolarHBondContact O-CB 3.42Å; N262-K266 PolarHBondContact O-N 2.78Å
263	D	93.9	Very high	89	Confident	17 Å²	17	65.6 Å²	65.6	9%	0.091	32%	0.318	C	S	.	.	H	α-helix	trans	-64.6	-28.5	174.8	-77.8	-44.7	0	0	0	112.6	K220 T259 L277 I281	K220-D263 IonicContact NZ-OD1 2.63Å; K220-D263 PolarHBondContact NZ-OD1 2.98Å; K220-D263 IonicContact NZ-OD2 3.84Å; K220-D263 PolarHBondContact NZ-OD2 3.26Å; T259-D263 WeakPolarHBondContact CG2-OD2 3.38Å; T259-D263 WeakPolarHBondContact O-CB 3.46Å; T259-D263 PolarHBondContact O-N 3.44Å; D263-L277 HydrophobicContact CB-CD2 4.4Å; D263-I281 HydrophobicContact CB-CD1 3.77Å
264	L	94.4	Very high	88.8	Confident	0 Å²	0	65.3 Å²	65.3	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-71.8	-32.3	177.4	-169.4	66	0	0	0	112.2	L260 I261 N262 K278 I281 M282 I313 V316 L320	L260-L264 PolarHBondContact O-N 3.44Å; I261-L264 HydrophobicContact CD1-CD2 4.14Å; I261-L264 WeakPolarHBondContact O-CB 3.41Å; I261-L264 PolarHBondContact O-N 3.45Å; N262-L264 VanDerWaalsContact C-N 3.25Å; N262-L264 PolarHBondContact O-N 3.49Å; L264-K278 HydrophobicContact CD1-CB 4.22Å; L264-K278 HydrophobicContact CD1-CG 4.19Å; L264-K278 WeakPolarHBondContact O-CE 3.43Å; L264-I281 HydrophobicContact CB-CD1 4.27Å; L264-I281 HydrophobicContact CB-CG2 4.23Å; L264-I281 HydrophobicContact CD1-CB 3.99Å; L264-I281 HydrophobicContact CD1-CD1 4.37Å; L264-I281 HydrophobicContact CD1-CG2 3.78Å; L264-I281 HydrophobicContact CD2-CG2 4.3Å; L264-I281 HydrophobicContact CG-CG2 4.32Å; L264-M282 HydrophobicContact CD1-CG 4.1Å; L264-M282 HydrophobicContact CD1-SD 4.41Å; L264-M282 HydrophobicContact CD2-SD 4Å; L264-I313 HydrophobicContact CD2-CD1 4.39Å; L264-I313 HydrophobicContact CD2-CG1 4.13Å; L264-V316 HydrophobicContact CB-CG1 4.21Å; L264-V316 HydrophobicContact CD2-CG1 4.01Å; L264-V316 HydrophobicContact CG-CG1 3.73Å; L264-L320 HydrophobicContact CD1-CD1 3.73Å; L264-L320 HydrophobicContact CD2-CD1 4.23Å; L264-L320 HydrophobicContact CG-CD1 3.93Å
265	D	93.1	Very high	89	Confident	68 Å²	68	55.9 Å²	55.9	36%	0.364	28%	0.282	S	S	.	.	H	α-helix	trans	-90.7	-29.8	176.6	-155	47	0	0	0	113.3	I261 N262 S267 V316 K319	I261-D265 PolarHBondContact O-N 2.93Å; N262-D265 PolarHBondContact O-N 3.04Å; D265-S267 PolarHBondContact O-N 3.2Å; D265-V316 HydrophobicContact CB-CG1 3.99Å; D265-V316 HydrophobicContact CB-CG2 3.95Å; D265-K319 VanDerWaalsContact OD1-CD 3.32Å; D265-K319 WeakPolarHBondContact OD1-CD 3.43Å; D265-K319 WeakPolarHBondContact OD1-CE 3.48Å; D265-K319 IonicContact OD1-NZ 3.22Å; D265-K319 PolarHBondContact OD1-NZ 3.29Å; D265-K319 IonicContact OD2-NZ 3.62Å; D265-K319 PolarHBondContact OD2-NZ 3.29Å
266	K	89.9	Confident	89.2	Confident	100 Å²	100	56.1 Å²	56.1	44%	0.435	29%	0.285	S	S	.	.			trans	-59.9	124.1	179.2	-174.2	176.2	178.4	-175.7	0	110.8	E215 N262	E215-K266 IonicContact OE1-NZ 2.61Å; E215-K266 PolarHBondContact OE1-NZ 2.9Å; N262-K266 VanDerWaalsContact O-CB 3.29Å; N262-K266 WeakPolarHBondContact O-CB 3.42Å; N262-K266 PolarHBondContact O-N 2.78Å
267	S	84.6	Confident	89.3	Confident	80 Å²	80	56.1 Å²	56.1	56%	0.559	29%	0.286	S	S	*	.			trans	-78.9	141.7	165.1	178.5	0	0	0	0	110.2	D265 G269 E274	D265-S267 PolarHBondContact O-N 3.2Å; S267-G269 PolarHBondContact OG-N 3.27Å; S267-E274 VanDerWaalsContact CA-OE2 3.23Å; S267-E274 WeakPolarHBondContact CA-OE2 3.43Å; S267-E274 WeakPolarHBondContact CB-OE2 3.49Å; S267-E274 PolarHBondContact OG-OE2 3.29Å
268	T	77.5	Confident	89.3	Confident	47 Å²	47	56.6 Å²	56.6	29%	0.288	29%	0.288	S	S	.	.			trans	-110.5	3.1	179.7	65.6	0	0	0	0	112.6	I217 R270 E274	I217-T268 HydrophobicContact CD1-CG2 3.78Å; T268-R270 PolarHBondContact O-N 3.43Å; T268-E274 HydrophobicContact CG2-CG 4.48Å; T268-E274 PolarHBondContact N-OE2 2.62Å; T268-E274 WeakPolarHBondContact OG1-CB 3.31Å
269	G	72.5	Confident	89.3	Confident	70 Å²	70	54.4 Å²	54.4	72%	0.722	28%	0.278	S	S	*	.	S	Bend	trans	71.7	-11.2	177.4	0	0	0	0	0	115.8	S267	S267-G269 PolarHBondContact OG-N 3.27Å
270	R	83.3	Confident	89.5	Confident	169 Å²	169	53.3 Å²	53.3	64%	0.638	27%	0.272	S	S	*	.			trans	-118	98.2	173.5	-65.8	-157.3	-58.7	-112.8	-3.9	110.6	T268 R272 D273 E274	T268-R270 PolarHBondContact O-N 3.43Å; R270-R272 VanDerWaalsContact C-N 3.27Å; R270-R272 PolarHBondContact O-N 3.08Å; R270-D273 HydrophobicContact CB-CB 4.32Å; R270-D273 IonicContact CZ-OD2 3.63Å; R270-D273 IonicContact NE-OD2 2.73Å; R270-D273 PolarHBondContact NE-OD2 3.5Å; R270-D273 IonicContact NH2-OD2 3.98Å; R270-D273 PolarHBondContact NH2-OD2 2.65Å; R270-D273 PolarHBondContact O-N 3.29Å; R270-E274 PolarHBondContact O-N 2.98Å
271	Y	84.9	Confident	89.5	Confident	127 Å²	127	53 Å²	53	50%	0.498	27%	0.271	S	S	.	.	H	α-helix	trans	-40.8	-46.1	-177.5	174.4	-98.7	0	0	0	114.9	D273 E274 V275 H323	Y271-D273 PolarHBondContact O-N 3.08Å; Y271-E274 PolarHBondContact O-N 2.91Å; Y271-V275 HydrophobicContact CD2-CG2 3.87Å; Y271-V275 HydrophobicContact CE1-CG2 4.34Å; Y271-V275 HydrophobicContact CE2-CG2 3.53Å; Y271-V275 HydrophobicContact CG-CG2 4.39Å; Y271-V275 WeakPolarHBondContact O-CB 3.42Å; Y271-V275 WeakPolarHBondContact O-CG2 3.09Å; Y271-V275 PolarHBondContact O-N 3.47Å; Y271-H323 WeakPolarHBondContact CE2-O 3.31Å; Y271-H323 PolarHBondContact OH-O 3.22Å
272	R	82.8	Confident	89.6	Confident	211 Å²	211	52.7 Å²	52.7	80%	0.796	27%	0.269	S	S	*	.	H	α-helix	trans	-62.2	-43.5	178.6	-175.9	-178.3	-179.8	-174.8	1.5	113	R270 S276	R270-R272 VanDerWaalsContact C-N 3.27Å; R270-R272 PolarHBondContact O-N 3.08Å; R272-S276 WeakPolarHBondContact O-CB 3.49Å; R272-S276 PolarHBondContact O-N 3.05Å; R272-S276 VanDerWaalsContact O-N 3.17Å; R272-S276 PolarHBondContact O-OG 2.88Å
273	D	86.8	Confident	89.6	Confident	26 Å²	26	49 Å²	49	14%	0.139	25%	0.25	C	C	.	.	H	α-helix	trans	-72.8	-43.7	-179.6	-62.2	-19.2	0	0	0	109	I217 R270 Y271 S276 L277	I217-D273 HydrophobicContact CD1-CB 3.81Å; I217-D273 HydrophobicContact CG2-CB 4.24Å; R270-D273 HydrophobicContact CB-CB 4.32Å; R270-D273 IonicContact CZ-OD2 3.63Å; R270-D273 IonicContact NE-OD2 2.73Å; R270-D273 PolarHBondContact NE-OD2 3.5Å; R270-D273 IonicContact NH2-OD2 3.98Å; R270-D273 PolarHBondContact NH2-OD2 2.65Å; R270-D273 PolarHBondContact O-N 3.29Å; Y271-D273 PolarHBondContact O-N 3.08Å; D273-S276 PolarHBondContact O-N 2.89Å; D273-S276 PolarHBondContact O-OG 3.04Å; D273-L277 PolarHBondContact O-N 2.89Å
274	E	86.9	Confident	89.8	Confident	14 Å²	14	48.2 Å²	48.2	7%	0.065	25%	0.246	C	C	.	.	H	α-helix	trans	-56.9	-51.5	177.3	-153.5	-176.4	110.4	0	0	112.6	S267 T268 R270 Y271 S276 L277 K278 H323	S267-E274 VanDerWaalsContact CA-OE2 3.23Å; S267-E274 WeakPolarHBondContact CA-OE2 3.43Å; S267-E274 WeakPolarHBondContact CB-OE2 3.49Å; S267-E274 PolarHBondContact OG-OE2 3.29Å; T268-E274 HydrophobicContact CG2-CG 4.48Å; T268-E274 PolarHBondContact N-OE2 2.62Å; T268-E274 WeakPolarHBondContact OG1-CB 3.31Å; R270-E274 PolarHBondContact O-N 2.98Å; Y271-E274 PolarHBondContact O-N 2.91Å; E274-S276 VanDerWaalsContact C-N 3.34Å; E274-S276 PolarHBondContact O-N 2.98Å; E274-L277 PolarHBondContact O-N 3Å; E274-K278 HydrophobicContact CG-CD 3.93Å; E274-K278 WeakPolarHBondContact O-CB 3.3Å; E274-K278 WeakPolarHBondContact O-CD 3.38Å; E274-K278 VanDerWaalsContact O-CG 3.24Å; E274-K278 WeakPolarHBondContact O-CG 3.3Å; E274-K278 PolarHBondContact O-N 2.93Å; E274-K278 IonicContact OE1-NZ 2.61Å; E274-K278 PolarHBondContact OE1-NZ 2.67Å; E274-H323 IonicContact OE1-CD2 3.6Å; E274-H323 IonicContact OE1-CE1 3.16Å; E274-H323 IonicContact OE1-NE2 2.73Å; E274-H323 PolarHBondContact OE1-NE2 2.94Å
275	V	90.8	Very high	89.9	Confident	10 Å²	10	48.2 Å²	48.2	6%	0.061	25%	0.246	C	C	.	.	H	α-helix	trans	-65.8	-36	178	170.9	0	0	0	0	111.6	Y271 K278 T279 H323 N325	Y271-V275 HydrophobicContact CD2-CG2 3.87Å; Y271-V275 HydrophobicContact CE1-CG2 4.34Å; Y271-V275 HydrophobicContact CE2-CG2 3.53Å; Y271-V275 HydrophobicContact CG-CG2 4.39Å; Y271-V275 WeakPolarHBondContact O-CB 3.42Å; Y271-V275 WeakPolarHBondContact O-CG2 3.09Å; Y271-V275 PolarHBondContact O-N 3.47Å; V275-K278 PolarHBondContact O-N 3.49Å; V275-T279 VanDerWaalsContact O-CB 3.27Å; V275-T279 WeakPolarHBondContact O-CB 3.22Å; V275-T279 PolarHBondContact O-N 3.33Å; V275-T279 PolarHBondContact O-OG1 3.27Å; V275-H323 HydrophobicContact CG2-CB 4.41Å; V275-N325 HydrophobicContact CG1-CB 3.89Å
276	S	91.9	Very high	90	Very high	47 Å²	47	45 Å²	45	33%	0.329	23%	0.228	S	C	.	.	H	α-helix	trans	-67.2	-39.4	177.7	67.4	0	0	0	0	112.3	R272 D273 E274 A280	R272-S276 WeakPolarHBondContact O-CB 3.49Å; R272-S276 PolarHBondContact O-N 3.05Å; R272-S276 VanDerWaalsContact O-N 3.17Å; R272-S276 PolarHBondContact O-OG 2.88Å; D273-S276 PolarHBondContact O-N 2.89Å; D273-S276 PolarHBondContact O-OG 3.04Å; E274-S276 VanDerWaalsContact C-N 3.34Å; E274-S276 PolarHBondContact O-N 2.98Å; S276-A280 WeakPolarHBondContact O-CB 3.08Å; S276-A280 PolarHBondContact O-N 3.41Å
277	L	94.1	Very high	90.2	Very high	4 Å²	4	40.2 Å²	40.2	2%	0.021	21%	0.208	C	C	.	.	H	α-helix	trans	-64.3	-50.9	172.5	-173.6	56.4	0	0	0	111.9	I217 K220 V221 L224 D263 D273 E274 T279 A280 I281	I217-L277 HydrophobicContact CG2-CB 3.94Å; I217-L277 HydrophobicContact CG2-CD2 4.33Å; K220-L277 HydrophobicContact CB-CD1 3.69Å; K220-L277 HydrophobicContact CD-CD1 4.22Å; V221-L277 HydrophobicContact CG2-CB 4.4Å; V221-L277 HydrophobicContact CG2-CD1 4.24Å; L224-L277 HydrophobicContact CD1-CD1 4.15Å; D263-L277 HydrophobicContact CB-CD2 4.4Å; D273-L277 PolarHBondContact O-N 2.89Å; E274-L277 PolarHBondContact O-N 3Å; L277-T279 VanDerWaalsContact C-N 3.29Å; L277-T279 PolarHBondContact O-N 2.77Å; L277-A280 PolarHBondContact O-N 3.38Å; L277-A280 VanDerWaalsContact O-N 3.12Å; L277-I281 HydrophobicContact CD1-CD1 4.07Å; L277-I281 HydrophobicContact CD1-CG1 4.29Å; L277-I281 HydrophobicContact CG-CD1 3.85Å; L277-I281 HydrophobicContact CG-CG1 4.47Å; L277-I281 WeakPolarHBondContact O-CG1 3.49Å; L277-I281 PolarHBondContact O-N 2.84Å
278	K	95.2	Very high	90.6	Very high	10 Å²	10	36.5 Å²	36.5	4%	0.043	18%	0.182	C	C	.	.	H	α-helix	trans	-60.6	-38.2	-179.3	-71.1	167.6	168.2	-167.2	0	112.3	L264 E274 V275 M282 L320 H323 L328	L264-K278 HydrophobicContact CD1-CB 4.22Å; L264-K278 HydrophobicContact CD1-CG 4.19Å; L264-K278 WeakPolarHBondContact O-CE 3.43Å; E274-K278 HydrophobicContact CG-CD 3.93Å; E274-K278 WeakPolarHBondContact O-CB 3.3Å; E274-K278 WeakPolarHBondContact O-CD 3.38Å; E274-K278 VanDerWaalsContact O-CG 3.24Å; E274-K278 WeakPolarHBondContact O-CG 3.3Å; E274-K278 PolarHBondContact O-N 2.93Å; E274-K278 IonicContact OE1-NZ 2.61Å; E274-K278 PolarHBondContact OE1-NZ 2.67Å; V275-K278 PolarHBondContact O-N 3.49Å; K278-M282 WeakPolarHBondContact O-CB 3.5Å; K278-M282 PolarHBondContact O-N 2.82Å; K278-L320 HydrophobicContact CB-CD2 4.2Å; K278-L320 HydrophobicContact CD-CD2 3.48Å; K278-L320 VanDerWaalsContact CD-CD2 3.48Å; K278-L320 HydrophobicContact CG-CD2 3.95Å; K278-H323 PolarHBondContact NZ-CE1 2.79Å; K278-H323 PolarHBondContact NZ-NE2 3.32Å; K278-L328 HydrophobicContact CB-CD1 4.3Å; K278-L328 HydrophobicContact CB-CD2 4.4Å
279	T	94.9	Very high	91.4	Very high	11 Å²	11	34.3 Å²	34.3	7%	0.067	17%	0.168	C	C	.	.	H	α-helix	trans	-66.7	-44.7	174	-53.4	0	0	0	0	111.3	V275 L277 M282 S283 T327	V275-T279 VanDerWaalsContact O-CB 3.27Å; V275-T279 WeakPolarHBondContact O-CB 3.22Å; V275-T279 PolarHBondContact O-N 3.33Å; V275-T279 PolarHBondContact O-OG1 3.27Å; L277-T279 VanDerWaalsContact C-N 3.29Å; L277-T279 PolarHBondContact O-N 2.77Å; T279-M282 PolarHBondContact O-N 3.43Å; T279-S283 WeakPolarHBondContact O-CB 3.36Å; T279-S283 PolarHBondContact O-N 3.45Å; T279-T327 HydrophobicContact CG2-CG2 3.91Å
280	A	95.9	Very high	92.1	Very high	10 Å²	10	31.7 Å²	31.7	8%	0.083	14%	0.139	C	C	.	.	H	α-helix	trans	-63.2	-41.5	177.2	0	0	0	0	0	112.3	V221 L224 S276 L277 S283 F284	V221-A280 HydrophobicContact CB-CB 4.42Å; V221-A280 HydrophobicContact CG1-CB 4.23Å; V221-A280 HydrophobicContact CG2-CB 4.12Å; L224-A280 HydrophobicContact CB-CB 4.08Å; L224-A280 HydrophobicContact CD1-CB 4.1Å; S276-A280 WeakPolarHBondContact O-CB 3.08Å; S276-A280 PolarHBondContact O-N 3.41Å; L277-A280 PolarHBondContact O-N 3.38Å; L277-A280 VanDerWaalsContact O-N 3.12Å; A280-S283 PolarHBondContact O-N 3.46Å; A280-F284 VanDerWaalsContact O-CB 3.31Å; A280-F284 WeakPolarHBondContact O-CB 3.36Å; A280-F284 PolarHBondContact O-N 3.43Å
281	I	97.1	Very high	92.4	Very high	1 Å²	1	25.7 Å²	25.7	1%	0.005	12%	0.118	C	C	.	.	H	α-helix	trans	-63.4	-51.7	175.6	-65.9	167.6	0	0	0	110.8	L224 L260 D263 L264 L277 S283 F284 I285	L224-I281 HydrophobicContact CD1-CB 4.47Å; L224-I281 HydrophobicContact CD1-CG1 3.53Å; L260-I281 HydrophobicContact CD1-CB 4.33Å; L260-I281 HydrophobicContact CD1-CG1 3.91Å; L260-I281 HydrophobicContact CD1-CG2 3.82Å; L260-I281 HydrophobicContact CD2-CG2 4.43Å; L260-I281 HydrophobicContact CG-CG2 3.8Å; D263-I281 HydrophobicContact CB-CD1 3.77Å; L264-I281 HydrophobicContact CB-CD1 4.27Å; L264-I281 HydrophobicContact CB-CG2 4.23Å; L264-I281 HydrophobicContact CD1-CB 3.99Å; L264-I281 HydrophobicContact CD1-CD1 4.37Å; L264-I281 HydrophobicContact CD1-CG2 3.78Å; L264-I281 HydrophobicContact CD2-CG2 4.3Å; L264-I281 HydrophobicContact CG-CG2 4.32Å; L277-I281 HydrophobicContact CD1-CD1 4.07Å; L277-I281 HydrophobicContact CD1-CG1 4.29Å; L277-I281 HydrophobicContact CG-CD1 3.85Å; L277-I281 HydrophobicContact CG-CG1 4.47Å; L277-I281 WeakPolarHBondContact O-CG1 3.49Å; L277-I281 PolarHBondContact O-N 2.84Å; I281-S283 VanDerWaalsContact C-N 3.29Å; I281-S283 PolarHBondContact O-N 2.82Å; I281-F284 PolarHBondContact O-N 3.17Å; I281-I285 HydrophobicContact CG2-CD1 3.68Å; I281-I285 HydrophobicContact CG2-CG1 4.33Å; I281-I285 WeakPolarHBondContact O-CG1 3.38Å; I281-I285 PolarHBondContact O-N 2.84Å
282	M	96.1	Very high	92.5	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-64.5	-34.2	179.6	-76.9	-55.9	-47.5	0	0	112.5	L264 K278 T279 I285 N286 I313 I317 L320 L328 H331 L332 F335	L264-M282 HydrophobicContact CD1-CG 4.1Å; L264-M282 HydrophobicContact CD1-SD 4.41Å; L264-M282 HydrophobicContact CD2-SD 4Å; K278-M282 WeakPolarHBondContact O-CB 3.5Å; K278-M282 PolarHBondContact O-N 2.82Å; T279-M282 PolarHBondContact O-N 3.43Å; M282-I285 HydrophobicContact SD-CD1 4.44Å; M282-N286 WeakPolarHBondContact O-CB 3.36Å; M282-N286 VanDerWaalsContact O-CG 3.26Å; M282-N286 PolarHBondContact O-N 2.89Å; M282-N286 PolarHBondContact O-ND2 2.94Å; M282-I313 HydrophobicContact SD-CD1 4.5Å; M282-I317 HydrophobicContact CE-CD1 4.48Å; M282-I317 HydrophobicContact SD-CG1 4.47Å; M282-L320 HydrophobicContact CG-CD1 4.32Å; M282-L328 HydrophobicContact CB-CD1 4.26Å; M282-L328 HydrophobicContact CG-CD1 4.01Å; M282-H331 HydrophobicContact CB-CB 3.87Å; M282-L332 HydrophobicContact CE-CD2 4.1Å; M282-L332 HydrophobicContact CG-CD2 3.97Å; M282-L332 HydrophobicContact SD-CD2 4.11Å; M282-F335 HydrophobicContact CE-CB 3.85Å; M282-F335 HydrophobicContact CE-CD2 4.1Å; M282-F335 HydrophobicContact CE-CG 4.05Å
283	S	95.6	Very high	92.6	Very high	6 Å²	6	12.7 Å²	12.7	4%	0.042	9%	0.086	C	C	.	.	H	α-helix	trans	-68	-42.6	174.6	-168.7	0	0	0	0	111.8	T279 A280 I281 N286 A287 H331 L1040	T279-S283 WeakPolarHBondContact O-CB 3.36Å; T279-S283 PolarHBondContact O-N 3.45Å; A280-S283 PolarHBondContact O-N 3.46Å; I281-S283 VanDerWaalsContact C-N 3.29Å; I281-S283 PolarHBondContact O-N 2.82Å; S283-N286 PolarHBondContact O-N 3.33Å; S283-A287 PolarHBondContact O-N 3.28Å; S283-H331 PolarHBondContact OG-CE1 3.37Å; S283-H331 VanDerWaalsContact OG-CE1 3.24Å; S283-L1040 WeakPolarHBondContact OG-CD1 3.18Å; S283-L1040 VanDerWaalsContact OG-CG 3.29Å; S283-L1040 WeakPolarHBondContact OG-CG 3.48Å; S283-L1040 PolarHBondContact OG-O 3.01Å
284	F	97.1	Very high	92.4	Very high	1 Å²	1	11.5 Å²	11.5	0%	0.004	8%	0.079	C	C	.	.	H	α-helix	trans	-60.5	-48.3	172.8	172.3	-104.1	0	0	0	112.8	L224 L227 V240 M244 F257 L260 A280 I281 N286 A287 V288	L224-F284 HydrophobicContact CB-CB 4.49Å; L224-F284 HydrophobicContact CD2-CB 4.03Å; L224-F284 HydrophobicContact CD2-CD1 3.9Å; L224-F284 HydrophobicContact CD2-CD2 4.43Å; L224-F284 HydrophobicContact CD2-CG 3.85Å; L227-F284 HydrophobicContact CB-CD2 4Å; L227-F284 HydrophobicContact CB-CE2 3.62Å; V240-F284 HydrophobicContact CG1-CE2 3.68Å; V240-F284 HydrophobicContact CG1-CZ 3.92Å; M244-F284 HydrophobicContact CG-CZ 4.28Å; M244-F284 HydrophobicContact SD-CZ 4.21Å; F257-F284 HydrophobicContact CE1-CE1 4.43Å; L260-F284 HydrophobicContact CD1-CD1 4.24Å; L260-F284 HydrophobicContact CD2-CD1 3.8Å; L260-F284 HydrophobicContact CD2-CE1 3.8Å; A280-F284 VanDerWaalsContact O-CB 3.31Å; A280-F284 WeakPolarHBondContact O-CB 3.36Å; A280-F284 PolarHBondContact O-N 3.43Å; I281-F284 PolarHBondContact O-N 3.17Å; F284-N286 VanDerWaalsContact C-N 3.29Å; F284-N286 PolarHBondContact O-N 2.91Å; F284-A287 PolarHBondContact O-N 2.71Å; F284-A287 VanDerWaalsContact O-N 3.13Å; F284-V288 HydrophobicContact CD1-CG2 4.42Å; F284-V288 HydrophobicContact CD2-CG2 4.19Å; F284-V288 HydrophobicContact CE1-CG2 3.95Å; F284-V288 HydrophobicContact CE2-CG2 3.68Å; F284-V288 HydrophobicContact CZ-CG2 3.56Å; F284-V288 WeakPolarHBondContact O-CG2 3.28Å; F284-V288 PolarHBondContact O-N 3.18Å
285	I	96.8	Very high	92.3	Very high	0 Å²	0	15.2 Å²	15.2	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-58.2	-43.7	177.4	-70.1	171.2	0	0	0	110.5	L260 I261 I281 M282 V288 L289 F308 I313 F335	L260-I285 HydrophobicContact CD2-CD1 4.13Å; L260-I285 HydrophobicContact CD2-CG1 3.87Å; I261-I285 HydrophobicContact CD1-CD1 3.86Å; I281-I285 HydrophobicContact CG2-CD1 3.68Å; I281-I285 HydrophobicContact CG2-CG1 4.33Å; I281-I285 WeakPolarHBondContact O-CG1 3.38Å; I281-I285 PolarHBondContact O-N 2.84Å; M282-I285 HydrophobicContact SD-CD1 4.44Å; I285-V288 PolarHBondContact O-N 3.01Å; I285-L289 HydrophobicContact CG2-CD1 3.89Å; I285-L289 WeakPolarHBondContact O-CB 3.38Å; I285-L289 WeakPolarHBondContact O-CG 3.36Å; I285-L289 PolarHBondContact O-N 2.81Å; I285-F308 HydrophobicContact CD1-CD1 4.42Å; I285-F308 HydrophobicContact CD1-CE1 4.22Å; I285-F308 HydrophobicContact CG1-CE1 3.95Å; I285-F308 HydrophobicContact CG1-CZ 4.1Å; I285-F308 HydrophobicContact CG2-CD2 4.25Å; I285-F308 HydrophobicContact CG2-CE1 4.44Å; I285-F308 HydrophobicContact CG2-CE2 4.07Å; I285-F308 HydrophobicContact CG2-CZ 4.16Å; I285-I313 HydrophobicContact CD1-CD1 3.89Å; I285-I313 HydrophobicContact CG2-CD1 4.45Å; I285-F335 HydrophobicContact CG2-CD2 4.15Å; I285-F335 HydrophobicContact CG2-CE2 4.04Å
286	N	95.1	Very high	91.9	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-66.3	-36.4	176.9	-76.7	-44.5	0	0	0	112.9	M282 S283 F284 S290 H331 F334 F1046	M282-N286 WeakPolarHBondContact O-CB 3.36Å; M282-N286 VanDerWaalsContact O-CG 3.26Å; M282-N286 PolarHBondContact O-N 2.89Å; M282-N286 PolarHBondContact O-ND2 2.94Å; S283-N286 PolarHBondContact O-N 3.33Å; F284-N286 VanDerWaalsContact C-N 3.29Å; F284-N286 PolarHBondContact O-N 2.91Å; N286-S290 VanDerWaalsContact O-CB 3.25Å; N286-S290 WeakPolarHBondContact O-CB 3.45Å; N286-S290 PolarHBondContact O-N 3.09Å; N286-S290 PolarHBondContact O-OG 2.61Å; N286-H331 PolarHBondContact ND2-O 3.27Å; N286-F334 HydrophobicContact CB-CD1 3.86Å; N286-F334 HydrophobicContact CB-CE1 4.06Å; N286-F334 WeakPolarHBondContact OD1-CD1 3.47Å; N286-F1046 HydrophobicContact CB-CE2 4.14Å; N286-F1046 HydrophobicContact CB-CZ 3.96Å
287	A	94.5	Very high	91.7	Very high	1 Å²	1	23 Å²	23	1%	0.008	14%	0.138	C	C	.	.	H	α-helix	trans	-66.5	-40.8	172.4	0	0	0	0	0	112.2	C231 S283 F284 Q291 L1040	C231-A287 HydrophobicContact CB-CB 4.01Å; S283-A287 PolarHBondContact O-N 3.28Å; F284-A287 PolarHBondContact O-N 2.71Å; F284-A287 VanDerWaalsContact O-N 3.13Å; A287-Q291 VanDerWaalsContact O-CB 3.24Å; A287-Q291 WeakPolarHBondContact O-CB 3.41Å; A287-Q291 WeakPolarHBondContact O-CG 3.29Å; A287-Q291 PolarHBondContact O-N 3.3Å; A287-L1040 HydrophobicContact CB-CD1 4.18Å
288	V	93.9	Very high	91.5	Very high	1 Å²	1	23 Å²	23	1%	0.006	14%	0.138	C	C	.	.	H	α-helix	trans	-64.7	-39.1	176.5	168.8	0	0	0	0	112.1	H237 V240 L241 F257 F284 I285 L304	H237-V288 PolarHBondContact NE2-O 2.67Å; V240-V288 HydrophobicContact CG1-CG2 4.42Å; L241-V288 HydrophobicContact CD2-CG1 3.91Å; F257-V288 HydrophobicContact CZ-CG1 4.34Å; F284-V288 HydrophobicContact CD1-CG2 4.42Å; F284-V288 HydrophobicContact CD2-CG2 4.19Å; F284-V288 HydrophobicContact CE1-CG2 3.95Å; F284-V288 HydrophobicContact CE2-CG2 3.68Å; F284-V288 HydrophobicContact CZ-CG2 3.56Å; F284-V288 WeakPolarHBondContact O-CG2 3.28Å; F284-V288 PolarHBondContact O-N 3.18Å; I285-V288 PolarHBondContact O-N 3.01Å; V288-L304 HydrophobicContact CG1-CD1 4.13Å
289	L	92.4	Very high	91.2	Very high	1 Å²	1	24.7 Å²	24.7	1%	0.005	15%	0.147	C	C	.	.	H	α-helix	trans	-79.3	-32	-179.6	-70.9	173.4	0	0	0	114.4	I285 L304 R305 F308 F335	I285-L289 HydrophobicContact CG2-CD1 3.89Å; I285-L289 WeakPolarHBondContact O-CB 3.38Å; I285-L289 WeakPolarHBondContact O-CG 3.36Å; I285-L289 PolarHBondContact O-N 2.81Å; L289-L304 HydrophobicContact CD2-CB 3.59Å; L289-R305 HydrophobicContact CD2-CB 4.14Å; L289-F308 HydrophobicContact CD1-CD2 4.27Å; L289-F308 HydrophobicContact CD1-CE2 4.39Å; L289-F308 HydrophobicContact CD2-CD2 4.18Å; L289-F308 HydrophobicContact CD2-CE2 4.08Å; L289-F308 HydrophobicContact CG-CD2 4.41Å; L289-F308 HydrophobicContact CG-CE2 4.14Å; L289-F335 HydrophobicContact CD1-CD2 3.93Å; L289-F335 HydrophobicContact CD1-CE2 3.63Å
290	S	88.1	Confident	91	Very high	16 Å²	16	24.2 Å²	24.2	11%	0.112	14%	0.144	C	C	.	.	H	α-helix	trans	-98.5	-14.6	-172.8	65.5	0	0	0	0	115.3	N286 V295 F1046	N286-S290 VanDerWaalsContact O-CB 3.25Å; N286-S290 WeakPolarHBondContact O-CB 3.45Å; N286-S290 PolarHBondContact O-N 3.09Å; N286-S290 PolarHBondContact O-OG 2.61Å; S290-V295 VanDerWaalsContact O-CG2 3.28Å; S290-V295 WeakPolarHBondContact O-CG2 3.25Å; S290-F1046 WeakPolarHBondContact OG-CE1 3.18Å
291	Q	90.1	Very high	90.8	Very high	43 Å²	43	25.1 Å²	25.1	20%	0.201	15%	0.146	C	C	.	.	S	Bend	trans	-107.2	174.5	-174.9	-53.3	-55.9	-60.8	0	0	112.9	C231 L232 H237 A287 A293 G294	C231-Q291 HydrophobicContact CB-CB 4.28Å; C231-Q291 HydrophobicContact CB-CG 4.42Å; C231-Q291 VanDerWaalsContact O-CB 3.26Å; C231-Q291 WeakPolarHBondContact O-CB 3.49Å; L232-Q291 HydrophobicContact CG-CG 4.35Å; H237-Q291 PolarHBondContact CD2-O 3.05Å; H237-Q291 PolarHBondContact CE1-O 3.21Å; H237-Q291 PolarHBondContact NE2-O 3.12Å; A287-Q291 VanDerWaalsContact O-CB 3.24Å; A287-Q291 WeakPolarHBondContact O-CB 3.41Å; A287-Q291 WeakPolarHBondContact O-CG 3.29Å; A287-Q291 PolarHBondContact O-N 3.3Å; Q291-A293 PolarHBondContact O-N 3.47Å; Q291-G294 PolarHBondContact O-N 3.37Å
292	G	86.9	Confident	90.5	Very high	37 Å²	37	27 Å²	27	38%	0.381	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.3	-131.1	-179.3	0	0	0	0	0	112.5	G294 V295	G292-G294 PolarHBondContact O-N 3.43Å; G292-G294 VanDerWaalsContact O-N 3.14Å; G292-V295 WeakPolarHBondContact O-CB 3.27Å; G292-V295 WeakPolarHBondContact O-CG2 3.37Å; G292-V295 PolarHBondContact O-N 2.92Å; G292-V295 VanDerWaalsContact O-N 3.08Å
293	A	84.8	Confident	90.3	Very high	27 Å²	27	28 Å²	28	22%	0.223	16%	0.16	C	C	.	.	H	α-helix	trans	-62.4	-18.4	177.9	0	0	0	0	0	113.6	Q291 V295 E296 S297 F300 P422	Q291-A293 PolarHBondContact O-N 3.47Å; A293-V295 VanDerWaalsContact C-N 3.25Å; A293-V295 PolarHBondContact O-N 2.82Å; A293-E296 PolarHBondContact O-N 2.64Å; A293-S297 PolarHBondContact O-N 3Å; A293-F300 HydrophobicContact CB-CD1 3.76Å; A293-F300 HydrophobicContact CB-CD2 4.29Å; A293-F300 HydrophobicContact CB-CE1 3.77Å; A293-F300 HydrophobicContact CB-CE2 4.29Å; A293-F300 HydrophobicContact CB-CG 4.01Å; A293-F300 HydrophobicContact CB-CZ 4.03Å; A293-P422 HydrophobicContact CB-CB 3.64Å
294	G	83.2	Confident	90.1	Very high	1 Å²	1	27.8 Å²	27.8	1%	0.01	16%	0.158	C	C	.	.	H	α-helix	trans	-67	-22.2	173.7	0	0	0	0	0	113.9	Q291 G292 R301	Q291-G294 PolarHBondContact O-N 3.37Å; G292-G294 PolarHBondContact O-N 3.43Å; G292-G294 VanDerWaalsContact O-N 3.14Å; G294-R301 WeakPolarHBondContact O-CD 3.31Å; G294-R301 WeakPolarHBondContact O-CG 3.33Å; G294-R301 PolarHBondContact O-NH1 3.18Å
295	V	84.3	Confident	89.9	Confident	92 Å²	92	28 Å²	28	56%	0.558	16%	0.159	S	C	*	.	H	α-helix	trans	-66.5	-41.4	175.2	-178.6	0	0	0	0	111	S290 G292 A293	S290-V295 VanDerWaalsContact O-CG2 3.28Å; S290-V295 WeakPolarHBondContact O-CG2 3.25Å; G292-V295 WeakPolarHBondContact O-CB 3.27Å; G292-V295 WeakPolarHBondContact O-CG2 3.37Å; G292-V295 PolarHBondContact O-N 2.92Å; G292-V295 VanDerWaalsContact O-N 3.08Å; A293-V295 VanDerWaalsContact C-N 3.25Å; A293-V295 PolarHBondContact O-N 2.82Å
296	E	82.4	Confident	89.5	Confident	181 Å²	181	33.8 Å²	33.8	85%	0.846	18%	0.182	S	C	*	.	H	α-helix	trans	-102.8	-29.6	-167.4	-61.1	-177.7	158	0	0	113.6	A293	A293-E296 PolarHBondContact O-N 2.64Å
297	S	87.8	Confident	89.3	Confident	39 Å²	39	35 Å²	35	27%	0.273	19%	0.188	S	C	.	.			trans	-114.4	112.3	-174.9	177.4	0	0	0	0	112.7	A293 D299 F300 R301	A293-S297 PolarHBondContact O-N 3Å; S297-D299 VanDerWaalsContact C-N 3.32Å; S297-F300 PolarHBondContact O-N 3.01Å; S297-F300 PolarHBondContact OG-N 3.22Å; S297-R301 PolarHBondContact O-N 3.45Å; S297-R301 VanDerWaalsContact O-N 3.16Å
298	L	89.1	Confident	89.2	Confident	5 Å²	5	35 Å²	35	3%	0.026	19%	0.187	C	C	.	.	H	α-helix	trans	-57.8	-46	169.4	175.9	69.2	0	0	0	110.9	F300 R301 L302 D342 E345	L298-F300 PolarHBondContact O-N 3.48Å; L298-R301 WeakPolarHBondContact O-CB 3.23Å; L298-R301 PolarHBondContact O-N 2.75Å; L298-L302 HydrophobicContact CD1-CD1 4.23Å; L298-L302 HydrophobicContact CD1-CG 4.12Å; L298-L302 HydrophobicContact CD2-CD1 4.14Å; L298-L302 HydrophobicContact CG-CD1 3.79Å; L298-L302 HydrophobicContact CG-CG 4.12Å; L298-L302 WeakPolarHBondContact O-CG 3.37Å; L298-L302 PolarHBondContact O-N 3.24Å; L298-D342 HydrophobicContact CD1-CB 3.63Å; L298-D342 VanDerWaalsContact CD1-OD1 3.23Å; L298-D342 WeakPolarHBondContact CD1-OD1 3.44Å; L298-E345 HydrophobicContact CD1-CB 4.26Å; L298-E345 HydrophobicContact CD2-CB 3.88Å; L298-E345 HydrophobicContact CD2-CG 3.85Å
299	D	89.4	Confident	89.1	Confident	46 Å²	46	37.2 Å²	37.2	25%	0.246	20%	0.199	C	C	.	.	H	α-helix	trans	-61.2	-35.1	-176.4	-59.4	-93.2	0	0	0	111.7	S297 H303 R349 V413	S297-D299 VanDerWaalsContact C-N 3.32Å; D299-H303 WeakPolarHBondContact O-CB 3.41Å; D299-H303 PolarHBondContact O-N 3.17Å; D299-R349 VanDerWaalsContact CG-NH1 3.33Å; D299-R349 IonicContact OD1-CZ 2.72Å; D299-R349 IonicContact OD1-NH1 3.43Å; D299-R349 PolarHBondContact OD1-NH1 3.01Å; D299-R349 IonicContact OD1-NH2 2.7Å; D299-R349 IonicContact OD2-CZ 2.66Å; D299-R349 IonicContact OD2-NH1 3.54Å; D299-R349 PolarHBondContact OD2-NH1 3.39Å; D299-R349 IonicContact OD2-NH2 3.58Å; D299-R349 PolarHBondContact OD2-NH2 3.38Å; D299-V413 HydrophobicContact CB-CG1 4.24Å
300	F	91.3	Very high	88.9	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-69.2	-42	171.6	-178.3	-96.6	0	0	0	113	H237 L241 A293 S297 L298 L302 H303 L304 P422 D423	H237-F300 AromaticContact CE1-CE1 3.76Å; H237-F300 AromaticContact CE1-CZ 3.88Å; L241-F300 HydrophobicContact CD1-CZ 3.81Å; A293-F300 HydrophobicContact CB-CD1 3.76Å; A293-F300 HydrophobicContact CB-CD2 4.29Å; A293-F300 HydrophobicContact CB-CE1 3.77Å; A293-F300 HydrophobicContact CB-CE2 4.29Å; A293-F300 HydrophobicContact CB-CG 4.01Å; A293-F300 HydrophobicContact CB-CZ 4.03Å; S297-F300 PolarHBondContact O-N 3.01Å; S297-F300 PolarHBondContact OG-N 3.22Å; L298-F300 PolarHBondContact O-N 3.48Å; F300-L302 VanDerWaalsContact C-N 3.34Å; F300-L302 PolarHBondContact O-N 2.86Å; F300-H303 PolarHBondContact O-N 3.19Å; F300-L304 HydrophobicContact CD1-CD1 4.14Å; F300-L304 HydrophobicContact CE1-CD1 3.38Å; F300-L304 HydrophobicContact CE1-CG 4.13Å; F300-L304 HydrophobicContact CE2-CD1 4.39Å; F300-L304 HydrophobicContact CE2-CG 4.46Å; F300-L304 HydrophobicContact CZ-CD1 3.54Å; F300-L304 HydrophobicContact CZ-CG 4.08Å; F300-L304 PolarHBondContact O-N 3.13Å; F300-P422 HydrophobicContact CD2-CB 3.92Å; F300-P422 HydrophobicContact CD2-CG 3.5Å; F300-P422 HydrophobicContact CE2-CB 3.77Å; F300-P422 HydrophobicContact CE2-CG 3.76Å; F300-P422 HydrophobicContact CG-CG 4.43Å; F300-P422 HydrophobicContact CZ-CB 4.49Å; F300-D423 HydrophobicContact CE2-CB 3.87Å
301	R	91.8	Very high	89.1	Confident	30 Å²	30	43.9 Å²	43.9	11%	0.113	23%	0.231	C	C	.	.	H	α-helix	trans	-61.5	-41.6	173.4	-67.6	-161.4	-63.3	-83.6	2.8	112	G294 S297 L298 R305 D342 E345	G294-R301 WeakPolarHBondContact O-CD 3.31Å; G294-R301 WeakPolarHBondContact O-CG 3.33Å; G294-R301 PolarHBondContact O-NH1 3.18Å; S297-R301 PolarHBondContact O-N 3.45Å; S297-R301 VanDerWaalsContact O-N 3.16Å; L298-R301 WeakPolarHBondContact O-CB 3.23Å; L298-R301 PolarHBondContact O-N 2.75Å; R301-R305 VanDerWaalsContact O-CB 3.24Å; R301-R305 WeakPolarHBondContact O-CB 3.2Å; R301-R305 PolarHBondContact O-N 3.49Å; R301-D342 WeakPolarHBondContact CB-OD2 3.43Å; R301-D342 IonicContact CZ-OD1 2.69Å; R301-D342 VanDerWaalsContact NE-CG 3.32Å; R301-D342 IonicContact NE-OD1 2.75Å; R301-D342 PolarHBondContact NE-OD1 3.28Å; R301-D342 IonicContact NE-OD2 3.64Å; R301-D342 PolarHBondContact NE-OD2 3.15Å; R301-D342 IonicContact NH2-OD1 2.65Å; R301-D342 PolarHBondContact NH2-OD1 2.96Å; R301-E345 IonicContact NH2-OE2 2.59Å
302	L	90.4	Very high	89.1	Confident	39 Å²	39	43.3 Å²	43.3	20%	0.204	24%	0.236	C	C	.	.	H	α-helix	trans	-64.3	-46	177.6	-70.1	173	0	0	0	111.2	L298 F300 R305 Y306 D342 F346	L298-L302 HydrophobicContact CD1-CD1 4.23Å; L298-L302 HydrophobicContact CD1-CG 4.12Å; L298-L302 HydrophobicContact CD2-CD1 4.14Å; L298-L302 HydrophobicContact CG-CD1 3.79Å; L298-L302 HydrophobicContact CG-CG 4.12Å; L298-L302 WeakPolarHBondContact O-CG 3.37Å; L298-L302 PolarHBondContact O-N 3.24Å; F300-L302 VanDerWaalsContact C-N 3.34Å; F300-L302 PolarHBondContact O-N 2.86Å; L302-R305 PolarHBondContact O-N 2.92Å; L302-Y306 WeakPolarHBondContact O-CB 3.35Å; L302-Y306 PolarHBondContact O-N 3.31Å; L302-D342 HydrophobicContact CD2-CB 4.06Å; L302-F346 HydrophobicContact CD1-CB 4.04Å; L302-F346 HydrophobicContact CD1-CD2 3.55Å; L302-F346 HydrophobicContact CD1-CE2 4.24Å; L302-F346 HydrophobicContact CD1-CG 3.95Å
303	H	90.8	Very high	89.4	Confident	23 Å²	23	41.5 Å²	41.5	11%	0.106	22%	0.218	C	C	.	.	H	α-helix	trans	-56.2	-55.1	174.6	169.3	72.1	0	0	0	112.3	D299 F300 R305 Y306 E307 I414 D423	D299-H303 WeakPolarHBondContact O-CB 3.41Å; D299-H303 PolarHBondContact O-N 3.17Å; F300-H303 PolarHBondContact O-N 3.19Å; H303-R305 PolarHBondContact O-N 3.37Å; H303-Y306 WeakPolarHBondContact O-CB 3.34Å; H303-Y306 PolarHBondContact O-N 3.4Å; H303-Y306 VanDerWaalsContact O-N 3.17Å; H303-E307 PolarHBondContact O-N 2.87Å; H303-I414 HydrophobicContact CB-CG2 4.2Å; H303-D423 IonicContact CD2-OD2 3.64Å; H303-D423 IonicContact CE1-OD2 2.66Å; H303-D423 IonicContact NE2-OD2 2.68Å; H303-D423 PolarHBondContact NE2-OD2 3.31Å
304	L	91.3	Very high	89.7	Confident	0 Å²	0	42 Å²	42	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-63.1	-39.2	178.7	-72.5	-174.9	0	0	0	112.7	L241 V288 L289 F300 Y306 E307 F308	L241-L304 HydrophobicContact CD2-CD1 4.5Å; L241-L304 HydrophobicContact CD2-CD2 4.32Å; V288-L304 HydrophobicContact CG1-CD1 4.13Å; L289-L304 HydrophobicContact CD2-CB 3.59Å; F300-L304 HydrophobicContact CD1-CD1 4.14Å; F300-L304 HydrophobicContact CE1-CD1 3.38Å; F300-L304 HydrophobicContact CE1-CG 4.13Å; F300-L304 HydrophobicContact CE2-CD1 4.39Å; F300-L304 HydrophobicContact CE2-CG 4.46Å; F300-L304 HydrophobicContact CZ-CD1 3.54Å; F300-L304 HydrophobicContact CZ-CG 4.08Å; F300-L304 PolarHBondContact O-N 3.13Å; L304-Y306 VanDerWaalsContact C-N 3.29Å; L304-Y306 PolarHBondContact O-N 3.46Å; L304-E307 PolarHBondContact O-N 3.4Å; L304-F308 WeakPolarHBondContact O-CD2 3.5Å
305	R	92.9	Very high	90.1	Very high	6 Å²	6	45.7 Å²	45.7	2%	0.023	24%	0.239	C	C	.	.	H	α-helix	trans	-66.3	-33.5	176.8	-170.6	178.6	-65.3	100.9	-7.5	111.8	L289 R301 L302 H303 E307 F308 L309 F335 L338 D342	L289-R305 HydrophobicContact CD2-CB 4.14Å; R301-R305 VanDerWaalsContact O-CB 3.24Å; R301-R305 WeakPolarHBondContact O-CB 3.2Å; R301-R305 PolarHBondContact O-N 3.49Å; L302-R305 PolarHBondContact O-N 2.92Å; H303-R305 PolarHBondContact O-N 3.37Å; R305-E307 VanDerWaalsContact C-N 3.35Å; R305-E307 PolarHBondContact O-N 3.36Å; R305-F308 PolarHBondContact O-N 2.91Å; R305-L309 HydrophobicContact CG-CD1 4.04Å; R305-L309 HydrophobicContact CG-CG 4.25Å; R305-L309 WeakPolarHBondContact O-CG 3.09Å; R305-L309 PolarHBondContact O-N 3.24Å; R305-F335 HydrophobicContact CG-CZ 4.37Å; R305-L338 PolarHBondContact NH2-O 3.04Å; R305-D342 IonicContact CZ-OD2 2.93Å; R305-D342 IonicContact NH1-OD2 2.67Å; R305-D342 PolarHBondContact NH1-OD2 3.24Å; R305-D342 IonicContact NH2-OD2 2.67Å; R305-D342 PolarHBondContact NH2-OD2 3.01Å
306	Y	89.3	Confident	90.5	Very high	122 Å²	122	41.8 Å²	41.8	48%	0.478	22%	0.216	S	C	.	.	H	α-helix	trans	-64.2	-37.2	176.7	-170.9	-105.8	0	0	0	112	L302 H303 L304 F308 L309 M310	L302-Y306 WeakPolarHBondContact O-CB 3.35Å; L302-Y306 PolarHBondContact O-N 3.31Å; H303-Y306 WeakPolarHBondContact O-CB 3.34Å; H303-Y306 PolarHBondContact O-N 3.4Å; H303-Y306 VanDerWaalsContact O-N 3.17Å; L304-Y306 VanDerWaalsContact C-N 3.29Å; L304-Y306 PolarHBondContact O-N 3.46Å; Y306-F308 PolarHBondContact O-N 3.17Å; Y306-L309 PolarHBondContact O-N 3.05Å; Y306-M310 HydrophobicContact CD1-CG 3.92Å; Y306-M310 HydrophobicContact CD2-CG 4.36Å; Y306-M310 HydrophobicContact CE1-CG 3.58Å; Y306-M310 HydrophobicContact CE1-SD 4.21Å; Y306-M310 HydrophobicContact CE2-CG 4.05Å; Y306-M310 HydrophobicContact CE2-SD 4.09Å; Y306-M310 HydrophobicContact CG-CG 4.31Å; Y306-M310 WeakPolarHBondContact O-CB 3.37Å; Y306-M310 VanDerWaalsContact O-CG 3.29Å; Y306-M310 WeakPolarHBondContact O-CG 3.24Å; Y306-M310 PolarHBondContact O-N 2.94Å
307	E	90.2	Very high	91	Very high	26 Å²	26	33.2 Å²	33.2	12%	0.121	18%	0.175	C	C	.	.	H	α-helix	trans	-57.3	-47.6	171.5	-69.5	-166.6	-178.4	0	0	111.8	R256 F257 H303 L304 R305 M310 L311 R407	R256-E307 IonicContact CZ-OE1 3.15Å; R256-E307 IonicContact CZ-OE2 3.98Å; R256-E307 IonicContact NE-OE1 2.68Å; R256-E307 IonicContact NE-OE2 3.06Å; R256-E307 PolarHBondContact NE-OE2 2.8Å; R256-E307 IonicContact NH2-OE1 2.78Å; R256-E307 PolarHBondContact NH2-OE1 2.82Å; R256-E307 IonicContact NH2-OE2 3.14Å; R256-E307 PolarHBondContact NH2-OE2 2.96Å; R256-E307 VanDerWaalsContact NH2-OE2 3.17Å; F257-E307 WeakPolarHBondContact CE2-OE2 3.24Å; H303-E307 PolarHBondContact O-N 2.87Å; L304-E307 PolarHBondContact O-N 3.4Å; R305-E307 VanDerWaalsContact C-N 3.35Å; R305-E307 PolarHBondContact O-N 3.36Å; E307-M310 PolarHBondContact O-N 2.93Å; E307-L311 WeakPolarHBondContact O-CG 3.39Å; E307-L311 PolarHBondContact O-N 3.49Å; E307-R407 IonicContact OE1-NH1 2.72Å
308	F	94	Very high	91.1	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-66.8	-37.6	177.9	-64.6	-63.8	0	0	0	113.2	F257 L260 I261 I285 L289 L304 R305 Y306 L311 G312 I313	F257-F308 HydrophobicContact CB-CD1 4.32Å; F257-F308 HydrophobicContact CB-CE1 3.82Å; F257-F308 AromaticContact CD1-CE1 3.9Å; F257-F308 HydrophobicContact CD1-CE1 3.9Å; F257-F308 HydrophobicContact CD1-CZ 4.05Å; F257-F308 HydrophobicContact CD2-CD1 4.32Å; F257-F308 AromaticContact CD2-CE1 3.65Å; F257-F308 HydrophobicContact CD2-CE1 3.65Å; F257-F308 AromaticContact CD2-CZ 3.77Å; F257-F308 HydrophobicContact CD2-CZ 3.77Å; F257-F308 HydrophobicContact CE1-CE1 4.35Å; F257-F308 HydrophobicContact CE1-CZ 4.03Å; F257-F308 HydrophobicContact CE2-CE1 4.14Å; F257-F308 HydrophobicContact CE2-CE2 4.32Å; F257-F308 AromaticContact CE2-CZ 3.76Å; F257-F308 HydrophobicContact CE2-CZ 3.76Å; F257-F308 HydrophobicContact CG-CD1 4.36Å; F257-F308 AromaticContact CG-CE1 3.53Å; F257-F308 HydrophobicContact CG-CE1 3.53Å; F257-F308 AromaticContact CG-CZ 3.94Å; F257-F308 HydrophobicContact CG-CZ 3.94Å; F257-F308 HydrophobicContact CZ-CE1 4.47Å; F257-F308 AromaticContact CZ-CZ 3.89Å; F257-F308 HydrophobicContact CZ-CZ 3.89Å; L260-F308 HydrophobicContact CD2-CE1 4.29Å; I261-F308 HydrophobicContact CD1-CD1 4.03Å; I261-F308 HydrophobicContact CG1-CD1 4.35Å; I285-F308 HydrophobicContact CD1-CD1 4.42Å; I285-F308 HydrophobicContact CD1-CE1 4.22Å; I285-F308 HydrophobicContact CG1-CE1 3.95Å; I285-F308 HydrophobicContact CG1-CZ 4.1Å; I285-F308 HydrophobicContact CG2-CD2 4.25Å; I285-F308 HydrophobicContact CG2-CE1 4.44Å; I285-F308 HydrophobicContact CG2-CE2 4.07Å; I285-F308 HydrophobicContact CG2-CZ 4.16Å; L289-F308 HydrophobicContact CD1-CD2 4.27Å; L289-F308 HydrophobicContact CD1-CE2 4.39Å; L289-F308 HydrophobicContact CD2-CD2 4.18Å; L289-F308 HydrophobicContact CD2-CE2 4.08Å; L289-F308 HydrophobicContact CG-CD2 4.41Å; L289-F308 HydrophobicContact CG-CE2 4.14Å; L304-F308 WeakPolarHBondContact O-CD2 3.5Å; R305-F308 PolarHBondContact O-N 2.91Å; Y306-F308 PolarHBondContact O-N 3.17Å; F308-L311 PolarHBondContact O-N 3.38Å; F308-G312 PolarHBondContact O-N 2.99Å; F308-I313 HydrophobicContact CB-CB 4.39Å; F308-I313 HydrophobicContact CB-CD1 4.21Å; F308-I313 HydrophobicContact CB-CG2 4.04Å; F308-I313 WeakPolarHBondContact O-CB 3.48Å; F308-I313 VanDerWaalsContact O-CG2 3.27Å; F308-I313 WeakPolarHBondContact O-CG2 3.15Å; F308-I313 PolarHBondContact O-N 3.45Å; F308-I313 VanDerWaalsContact O-N 3.15Å
309	L	90.4	Very high	91.2	Very high	47 Å²	47	39.7 Å²	39.7	25%	0.246	20%	0.203	C	C	.	.	H	α-helix	trans	-66.2	-39.9	175.7	-72.1	170.9	0	0	0	111.9	R305 Y306 L311 G312 I313	R305-L309 HydrophobicContact CG-CD1 4.04Å; R305-L309 HydrophobicContact CG-CG 4.25Å; R305-L309 WeakPolarHBondContact O-CG 3.09Å; R305-L309 PolarHBondContact O-N 3.24Å; Y306-L309 PolarHBondContact O-N 3.05Å; L309-L311 VanDerWaalsContact C-N 3.28Å; L309-L311 PolarHBondContact O-N 3.1Å; L309-G312 PolarHBondContact O-N 3.37Å; L309-I313 HydrophobicContact CD2-CG2 4.19Å
310	M	87.8	Confident	91.2	Very high	127 Å²	127	37.7 Å²	37.7	63%	0.626	19%	0.192	S	C	*	.	H	α-helix	trans	-70.3	-22.8	175.6	-72.1	-58.1	-59.8	0	0	113.4	Y306 E307 G312	Y306-M310 HydrophobicContact CD1-CG 3.92Å; Y306-M310 HydrophobicContact CD2-CG 4.36Å; Y306-M310 HydrophobicContact CE1-CG 3.58Å; Y306-M310 HydrophobicContact CE1-SD 4.21Å; Y306-M310 HydrophobicContact CE2-CG 4.05Å; Y306-M310 HydrophobicContact CE2-SD 4.09Å; Y306-M310 HydrophobicContact CG-CG 4.31Å; Y306-M310 WeakPolarHBondContact O-CB 3.37Å; Y306-M310 VanDerWaalsContact O-CG 3.29Å; Y306-M310 WeakPolarHBondContact O-CG 3.24Å; Y306-M310 PolarHBondContact O-N 2.94Å; E307-M310 PolarHBondContact O-N 2.93Å; M310-G312 VanDerWaalsContact C-N 3.25Å
311	L	92.3	Very high	91.2	Very high	31 Å²	31	41.2 Å²	41.2	16%	0.162	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.6	-2.3	167.5	-74.1	171.5	0	0	0	113.7	F257 Q258 I261 E307 F308 L309	F257-L311 HydrophobicContact CB-CD1 3.67Å; Q258-L311 HydrophobicContact CB-CD2 4.44Å; I261-L311 HydrophobicContact CB-CB 4.38Å; I261-L311 HydrophobicContact CG1-CB 4.09Å; I261-L311 HydrophobicContact CG1-CD1 4.05Å; I261-L311 HydrophobicContact CG2-CB 4.33Å; E307-L311 WeakPolarHBondContact O-CG 3.39Å; E307-L311 PolarHBondContact O-N 3.49Å; F308-L311 PolarHBondContact O-N 3.38Å; L309-L311 VanDerWaalsContact C-N 3.28Å; L309-L311 PolarHBondContact O-N 3.1Å
312	G	90.7	Very high	90.9	Very high	30 Å²	30	47.4 Å²	47.4	31%	0.309	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	83.5	24.8	175.1	0	0	0	0	0	115	F308 L309 M310 Q314 P315	F308-G312 PolarHBondContact O-N 2.99Å; L309-G312 PolarHBondContact O-N 3.37Å; M310-G312 VanDerWaalsContact C-N 3.25Å; G312-Q314 PolarHBondContact O-N 3.06Å; G312-Q314 VanDerWaalsContact O-N 3.15Å; G312-P315 WeakPolarHBondContact O-CD 3.22Å
313	I	94.3	Very high	90.6	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-57.2	-30	-177	-162.6	173.9	0	0	0	114.3	I261 L264 M282 I285 F308 L309 V316 I317 F335	I261-I313 HydrophobicContact CD1-CB 4.31Å; I261-I313 HydrophobicContact CD1-CD1 3.85Å; I261-I313 HydrophobicContact CD1-CG1 3.98Å; L264-I313 HydrophobicContact CD2-CD1 4.39Å; L264-I313 HydrophobicContact CD2-CG1 4.13Å; M282-I313 HydrophobicContact SD-CD1 4.5Å; I285-I313 HydrophobicContact CD1-CD1 3.89Å; I285-I313 HydrophobicContact CG2-CD1 4.45Å; F308-I313 HydrophobicContact CB-CB 4.39Å; F308-I313 HydrophobicContact CB-CD1 4.21Å; F308-I313 HydrophobicContact CB-CG2 4.04Å; F308-I313 WeakPolarHBondContact O-CB 3.48Å; F308-I313 VanDerWaalsContact O-CG2 3.27Å; F308-I313 WeakPolarHBondContact O-CG2 3.15Å; F308-I313 PolarHBondContact O-N 3.45Å; F308-I313 VanDerWaalsContact O-N 3.15Å; L309-I313 HydrophobicContact CD2-CG2 4.19Å; I313-V316 WeakPolarHBondContact O-CB 3.09Å; I313-V316 PolarHBondContact O-N 3.1Å; I313-V316 VanDerWaalsContact O-N 3.14Å; I313-I317 HydrophobicContact CD1-CD1 4.2Å; I313-I317 HydrophobicContact CG1-CD1 3.9Å; I313-I317 HydrophobicContact CG1-CG1 4.15Å; I313-I317 WeakPolarHBondContact O-CG1 3.25Å; I313-I317 PolarHBondContact O-N 2.72Å; I313-F335 HydrophobicContact CD1-CE2 4.13Å; I313-F335 HydrophobicContact CD1-CZ 4.15Å; I313-F335 HydrophobicContact CG2-CZ 4.02Å
314	Q	90.4	Very high	90.2	Very high	36 Å²	36	54.6 Å²	54.6	17%	0.168	27%	0.268	C	S	.	.	H	α-helix	trans	-65.8	-53.5	-174.2	-176.7	70.7	59.3	0	0	112.8	G312 V316 I317 D318	G312-Q314 PolarHBondContact O-N 3.06Å; G312-Q314 VanDerWaalsContact O-N 3.15Å; Q314-V316 PolarHBondContact O-N 3.3Å; Q314-V316 VanDerWaalsContact O-N 3.07Å; Q314-I317 WeakPolarHBondContact O-CB 3.49Å; Q314-I317 PolarHBondContact O-N 3.39Å; Q314-D318 PolarHBondContact NE2-OD1 2.77Å; Q314-D318 PolarHBondContact O-N 2.89Å
315	P	91.1	Very high	90.2	Very high	80 Å²	80	56.4 Å²	56.4	52%	0.519	28%	0.277	S	S	.	.	H	α-helix	trans	-54.1	-23.8	169.8	-30.2	34.2	0	0	0	115.5	G312 K319	G312-P315 WeakPolarHBondContact O-CD 3.22Å; P315-K319 WeakPolarHBondContact O-CG 3.21Å
316	V	93.4	Very high	90	Very high	10 Å²	10	60.1 Å²	60.1	6%	0.061	31%	0.305	C	S	.	.	H	α-helix	trans	-77.3	-49	173.9	-172.8	0	0	0	0	110	L264 D265 I313 Q314 D318 K319 L320	L264-V316 HydrophobicContact CB-CG1 4.21Å; L264-V316 HydrophobicContact CD2-CG1 4.01Å; L264-V316 HydrophobicContact CG-CG1 3.73Å; D265-V316 HydrophobicContact CB-CG1 3.99Å; D265-V316 HydrophobicContact CB-CG2 3.95Å; I313-V316 WeakPolarHBondContact O-CB 3.09Å; I313-V316 PolarHBondContact O-N 3.1Å; I313-V316 VanDerWaalsContact O-N 3.14Å; Q314-V316 PolarHBondContact O-N 3.3Å; Q314-V316 VanDerWaalsContact O-N 3.07Å; V316-D318 PolarHBondContact O-N 3.5Å; V316-K319 WeakPolarHBondContact O-CB 3.22Å; V316-K319 PolarHBondContact O-N 3.42Å; V316-L320 HydrophobicContact CG1-CD1 4.34Å; V316-L320 HydrophobicContact CG1-CG 4.37Å; V316-L320 WeakPolarHBondContact O-CG 3.22Å; V316-L320 PolarHBondContact O-N 3.02Å
317	I	92.8	Very high	90	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-52.6	-43	173.2	-74.2	169.7	0	0	0	111.4	M282 I313 Q314 K319 L320 R321 L332 F335	M282-I317 HydrophobicContact CE-CD1 4.48Å; M282-I317 HydrophobicContact SD-CG1 4.47Å; I313-I317 HydrophobicContact CD1-CD1 4.2Å; I313-I317 HydrophobicContact CG1-CD1 3.9Å; I313-I317 HydrophobicContact CG1-CG1 4.15Å; I313-I317 WeakPolarHBondContact O-CG1 3.25Å; I313-I317 PolarHBondContact O-N 2.72Å; Q314-I317 WeakPolarHBondContact O-CB 3.49Å; Q314-I317 PolarHBondContact O-N 3.39Å; I317-K319 VanDerWaalsContact C-N 3.29Å; I317-K319 PolarHBondContact O-N 3.04Å; I317-L320 PolarHBondContact O-N 3.39Å; I317-L320 VanDerWaalsContact O-N 3.07Å; I317-R321 PolarHBondContact O-N 3.1Å; I317-L332 HydrophobicContact CB-CD2 4.47Å; I317-L332 HydrophobicContact CG1-CD2 4.05Å; I317-L332 HydrophobicContact CG2-CD2 4.19Å; I317-F335 HydrophobicContact CD1-CD1 3.42Å; I317-F335 VanDerWaalsContact CD1-CD1 3.42Å; I317-F335 HydrophobicContact CD1-CE1 3.43Å; I317-F335 VanDerWaalsContact CD1-CE1 3.43Å; I317-F335 HydrophobicContact CD1-CG 4.11Å; I317-F335 HydrophobicContact CD1-CZ 4.13Å
318	D	90.4	Very high	90.1	Very high	86 Å²	86	55.1 Å²	55.1	46%	0.46	29%	0.289	S	S	.	.	H	α-helix	trans	-60.5	-37.3	179.2	-58.9	-24.1	0	0	0	111.7	Q314 V316	Q314-D318 PolarHBondContact NE2-OD1 2.77Å; Q314-D318 PolarHBondContact O-N 2.89Å; V316-D318 PolarHBondContact O-N 3.5Å
319	K	90.3	Very high	89.9	Confident	95 Å²	95	57.1 Å²	57.1	41%	0.413	30%	0.299	S	S	.	.	H	α-helix	trans	-71.9	-38.7	171.5	-60.8	167.7	-166.4	176.5	0	112.5	D265 P315 V316 I317 R321 E322	D265-K319 VanDerWaalsContact OD1-CD 3.32Å; D265-K319 WeakPolarHBondContact OD1-CD 3.43Å; D265-K319 WeakPolarHBondContact OD1-CE 3.48Å; D265-K319 IonicContact OD1-NZ 3.22Å; D265-K319 PolarHBondContact OD1-NZ 3.29Å; D265-K319 IonicContact OD2-NZ 3.62Å; D265-K319 PolarHBondContact OD2-NZ 3.29Å; P315-K319 WeakPolarHBondContact O-CG 3.21Å; V316-K319 WeakPolarHBondContact O-CB 3.22Å; V316-K319 PolarHBondContact O-N 3.42Å; I317-K319 VanDerWaalsContact C-N 3.29Å; I317-K319 PolarHBondContact O-N 3.04Å; K319-R321 PolarHBondContact O-N 2.96Å; K319-R321 VanDerWaalsContact O-N 3.17Å; K319-E322 WeakPolarHBondContact O-CB 3.42Å; K319-E322 PolarHBondContact O-N 3.17Å
320	L	90.6	Very high	89.9	Confident	3 Å²	3	58.9 Å²	58.9	2%	0.016	30%	0.303	C	S	.	.	H	α-helix	trans	-63.2	-21.1	-176.9	-67.8	175.5	0	0	0	113.3	L264 K278 M282 V316 I317 E322 H323 L328 L332	L264-L320 HydrophobicContact CD1-CD1 3.73Å; L264-L320 HydrophobicContact CD2-CD1 4.23Å; L264-L320 HydrophobicContact CG-CD1 3.93Å; K278-L320 HydrophobicContact CB-CD2 4.2Å; K278-L320 HydrophobicContact CD-CD2 3.48Å; K278-L320 VanDerWaalsContact CD-CD2 3.48Å; K278-L320 HydrophobicContact CG-CD2 3.95Å; M282-L320 HydrophobicContact CG-CD1 4.32Å; V316-L320 HydrophobicContact CG1-CD1 4.34Å; V316-L320 HydrophobicContact CG1-CG 4.37Å; V316-L320 WeakPolarHBondContact O-CG 3.22Å; V316-L320 PolarHBondContact O-N 3.02Å; I317-L320 PolarHBondContact O-N 3.39Å; I317-L320 VanDerWaalsContact O-N 3.07Å; L320-E322 PolarHBondContact O-N 3.07Å; L320-H323 PolarHBondContact O-N 2.6Å; L320-L328 HydrophobicContact CB-CD2 4.38Å; L320-L328 HydrophobicContact CD2-CD2 4.41Å; L320-L332 HydrophobicContact CB-CD1 3.82Å; L320-L332 HydrophobicContact CB-CD2 4.21Å; L320-L332 HydrophobicContact CD1-CD2 3.96Å
321	R	90.3	Very high	90.2	Very high	74 Å²	74	52.9 Å²	52.9	28%	0.279	27%	0.273	S	S	.	.	G	3₁₀ helix	trans	-64.9	-18.1	170.9	-66.4	-62.4	-170.8	169.2	9.8	113.6	I317 K319 H323 D329 L332 D333 E336	I317-R321 PolarHBondContact O-N 3.1Å; K319-R321 PolarHBondContact O-N 2.96Å; K319-R321 VanDerWaalsContact O-N 3.17Å; R321-H323 VanDerWaalsContact C-N 3.32Å; R321-D329 WeakPolarHBondContact CD-OD1 3.44Å; R321-D329 IonicContact CZ-OD1 3.09Å; R321-D329 IonicContact NH1-OD1 3.46Å; R321-D329 PolarHBondContact NH1-OD1 3.38Å; R321-L332 HydrophobicContact CG-CD1 4.26Å; R321-D333 IonicContact CZ-OD1 3.08Å; R321-D333 VanDerWaalsContact CZ-OD1 3.29Å; R321-D333 IonicContact NH1-OD1 2.8Å; R321-D333 PolarHBondContact NH1-OD1 2.81Å; R321-D333 IonicContact NH2-OD1 2.84Å; R321-D333 PolarHBondContact NH2-OD1 2.79Å; R321-E336 IonicContact CZ-OE1 3.23Å; R321-E336 IonicContact NE-OE1 3.05Å; R321-E336 PolarHBondContact NE-OE1 3.44Å; R321-E336 IonicContact NH2-OE1 2.86Å; R321-E336 PolarHBondContact NH2-OE1 3.01Å; R321-E336 IonicContact NH2-OE2 2.71Å; R321-E336 PolarHBondContact NH2-OE2 3.42Å; R321-E336 VanDerWaalsContact NH2-OE2 3.17Å
322	E	86.1	Confident	90.3	Very high	160 Å²	160	51.4 Å²	51.4	75%	0.748	27%	0.265	S	S	*	.	G	3₁₀ helix	trans	-82.2	-8.1	176.9	-56.1	-175.2	164.7	0	0	112.9	K319 L320 E324	K319-E322 WeakPolarHBondContact O-CB 3.42Å; K319-E322 PolarHBondContact O-N 3.17Å; L320-E322 PolarHBondContact O-N 3.07Å; E322-E324 VanDerWaalsContact C-N 3.32Å; E322-E324 PolarHBondContact O-N 3.1Å
323	H	83.3	Confident	90.3	Very high	34 Å²	34	51.6 Å²	51.6	16%	0.157	26%	0.259	C	S	.	.	G	3₁₀ helix	trans	-82.3	4.1	-176.7	-75.3	76.7	0	0	0	115.3	Y271 E274 V275 K278 L320 R321 N325 L328	Y271-H323 WeakPolarHBondContact CE2-O 3.31Å; Y271-H323 PolarHBondContact OH-O 3.22Å; E274-H323 IonicContact OE1-CD2 3.6Å; E274-H323 IonicContact OE1-CE1 3.16Å; E274-H323 IonicContact OE1-NE2 2.73Å; E274-H323 PolarHBondContact OE1-NE2 2.94Å; V275-H323 HydrophobicContact CG2-CB 4.41Å; K278-H323 PolarHBondContact NZ-CE1 2.79Å; K278-H323 PolarHBondContact NZ-NE2 3.32Å; L320-H323 PolarHBondContact O-N 2.6Å; R321-H323 VanDerWaalsContact C-N 3.32Å; H323-N325 VanDerWaalsContact C-N 3.26Å; H323-N325 PolarHBondContact O-N 2.9Å; H323-L328 HydrophobicContact CB-CD2 4.16Å
324	E	82.3	Confident	90.1	Very high	179 Å²	179	51.9 Å²	51.9	84%	0.836	26%	0.26	S	S	*	.			trans	46	36.5	174.6	-60.6	-164.5	150.9	0	0	116.1	E322	E322-E324 VanDerWaalsContact C-N 3.32Å; E322-E324 PolarHBondContact O-N 3.1Å
325	N	90.9	Very high	90.2	Very high	38 Å²	38	50.2 Å²	50.2	20%	0.203	25%	0.253	C	S	.	.			trans	-116.4	109.3	-174.9	-171.9	-82.2	0	0	0	113.8	V275 H323 T327 L328 D329	V275-N325 HydrophobicContact CG1-CB 3.89Å; H323-N325 VanDerWaalsContact C-N 3.26Å; H323-N325 PolarHBondContact O-N 2.9Å; N325-T327 PolarHBondContact O-N 3.13Å; N325-T327 WeakPolarHBondContact OD1-CB 3.4Å; N325-T327 PolarHBondContact OD1-N 3.3Å; N325-T327 VanDerWaalsContact OD1-N 3.09Å; N325-L328 HydrophobicContact CB-CB 3.99Å; N325-L328 PolarHBondContact O-N 3.4Å; N325-L328 VanDerWaalsContact O-N 3.08Å; N325-L328 PolarHBondContact OD1-N 2.93Å; N325-D329 WeakPolarHBondContact O-CB 3.13Å; N325-D329 PolarHBondContact O-N 3.18Å
326	S	88.8	Confident	90.3	Very high	85 Å²	85	48.8 Å²	48.8	59%	0.594	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-7.4	-175.9	69.6	0	0	0	0	117	R330	S326-R330 PolarHBondContact O-NH1 3.42Å; S326-R330 VanDerWaalsContact O-NH1 3.08Å
327	T	88.9	Confident	90	Very high	42 Å²	42	48.6 Å²	48.6	26%	0.258	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.7	-44.7	170.9	-53.2	0	0	0	0	110.5	T279 N325 D329 R330 H331 R1041	T279-T327 HydrophobicContact CG2-CG2 3.91Å; N325-T327 PolarHBondContact O-N 3.13Å; N325-T327 WeakPolarHBondContact OD1-CB 3.4Å; N325-T327 PolarHBondContact OD1-N 3.3Å; N325-T327 VanDerWaalsContact OD1-N 3.09Å; T327-D329 VanDerWaalsContact C-N 3.35Å; T327-D329 PolarHBondContact O-N 3.1Å; T327-R330 WeakPolarHBondContact O-CB 3.43Å; T327-R330 PolarHBondContact O-N 3.17Å; T327-H331 PolarHBondContact O-CD2 3.11Å; T327-H331 VanDerWaalsContact O-CD2 3.25Å; T327-H331 PolarHBondContact O-N 2.82Å; T327-R1041 WeakPolarHBondContact CG2-O 3.38Å
328	L	92.3	Very high	89.8	Confident	1 Å²	1	49.7 Å²	49.7	1%	0.005	24%	0.243	C	C	.	.	H	α-helix	trans	-57.5	-48.5	170	-177.4	59.2	0	0	0	110.6	K278 M282 L320 H323 N325 R330 H331 L332	K278-L328 HydrophobicContact CB-CD1 4.3Å; K278-L328 HydrophobicContact CB-CD2 4.4Å; M282-L328 HydrophobicContact CB-CD1 4.26Å; M282-L328 HydrophobicContact CG-CD1 4.01Å; L320-L328 HydrophobicContact CB-CD2 4.38Å; L320-L328 HydrophobicContact CD2-CD2 4.41Å; H323-L328 HydrophobicContact CB-CD2 4.16Å; N325-L328 HydrophobicContact CB-CB 3.99Å; N325-L328 PolarHBondContact O-N 3.4Å; N325-L328 VanDerWaalsContact O-N 3.08Å; N325-L328 PolarHBondContact OD1-N 2.93Å; L328-R330 VanDerWaalsContact C-N 3.26Å; L328-R330 PolarHBondContact O-N 3.41Å; L328-H331 WeakPolarHBondContact O-CA 3.31Å; L328-H331 WeakPolarHBondContact O-CB 3.36Å; L328-H331 PolarHBondContact O-N 3.32Å; L328-L332 HydrophobicContact CD1-CG 4.5Å; L328-L332 HydrophobicContact CG-CD1 4.18Å; L328-L332 HydrophobicContact CG-CG 4.33Å; L328-L332 WeakPolarHBondContact O-CG 3.32Å; L328-L332 PolarHBondContact O-N 3.12Å
329	D	90.8	Very high	89.8	Confident	42 Å²	42	48.1 Å²	48.1	23%	0.225	23%	0.231	C	C	.	.	H	α-helix	trans	-57.4	-32.4	177.5	-83.7	-55.8	0	0	0	113.8	R321 N325 T327 H331 L332 D333	R321-D329 WeakPolarHBondContact CD-OD1 3.44Å; R321-D329 IonicContact CZ-OD1 3.09Å; R321-D329 IonicContact NH1-OD1 3.46Å; R321-D329 PolarHBondContact NH1-OD1 3.38Å; N325-D329 WeakPolarHBondContact O-CB 3.13Å; N325-D329 PolarHBondContact O-N 3.18Å; T327-D329 VanDerWaalsContact C-N 3.35Å; T327-D329 PolarHBondContact O-N 3.1Å; D329-H331 VanDerWaalsContact C-N 3.34Å; D329-L332 PolarHBondContact O-N 3.23Å; D329-D333 VanDerWaalsContact O-CB 3.24Å; D329-D333 WeakPolarHBondContact O-CB 3.44Å; D329-D333 PolarHBondContact O-N 2.76Å
330	R	90.6	Very high	89.7	Confident	84 Å²	84	48 Å²	48	32%	0.317	24%	0.235	S	C	.	.	H	α-helix	trans	-62.8	-41.7	172.1	-86.8	-176.1	176.3	86.5	-18.6	111.7	S326 T327 L328 F334 S1042 D1047	S326-R330 PolarHBondContact O-NH1 3.42Å; S326-R330 VanDerWaalsContact O-NH1 3.08Å; T327-R330 WeakPolarHBondContact O-CB 3.43Å; T327-R330 PolarHBondContact O-N 3.17Å; L328-R330 VanDerWaalsContact C-N 3.26Å; L328-R330 PolarHBondContact O-N 3.41Å; R330-F334 WeakPolarHBondContact O-CB 3.34Å; R330-F334 PolarHBondContact O-N 2.82Å; R330-S1042 WeakPolarHBondContact CD-O 3.26Å; R330-D1047 IonicContact NE-OD2 2.82Å
331	H	93.8	Very high	89.5	Confident	1 Å²	1	51.4 Å²	51.4	1%	0.005	25%	0.251	C	S	.	.	H	α-helix	trans	-74.8	-31	179.5	-68	-64.8	0	0	0	112.4	M282 S283 N286 T327 L328 D329 F335 L1040 F1046	M282-H331 HydrophobicContact CB-CB 3.87Å; S283-H331 PolarHBondContact OG-CE1 3.37Å; S283-H331 VanDerWaalsContact OG-CE1 3.24Å; N286-H331 PolarHBondContact ND2-O 3.27Å; T327-H331 PolarHBondContact O-CD2 3.11Å; T327-H331 VanDerWaalsContact O-CD2 3.25Å; T327-H331 PolarHBondContact O-N 2.82Å; L328-H331 WeakPolarHBondContact O-CA 3.31Å; L328-H331 WeakPolarHBondContact O-CB 3.36Å; L328-H331 PolarHBondContact O-N 3.32Å; D329-H331 VanDerWaalsContact C-N 3.34Å; H331-F335 WeakPolarHBondContact O-CB 3.42Å; H331-F335 PolarHBondContact O-N 3.37Å; H331-L1040 PolarHBondContact CE1-O 3.32Å; H331-L1040 VanDerWaalsContact CE1-O 3.22Å; H331-L1040 PolarHBondContact NE2-O 3.48Å; H331-F1046 AromaticContact CE1-CE2 3.79Å; H331-F1046 AromaticContact ND1-CD2 3.95Å; H331-F1046 AromaticContact ND1-CE2 3.8Å
332	L	93.8	Very high	89.5	Confident	0 Å²	0	48 Å²	48	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-68.4	-49.2	170.3	-57.9	178.3	0	0	0	110.8	M282 I317 L320 R321 L328 D329 F334 F335 E336	M282-L332 HydrophobicContact CE-CD2 4.1Å; M282-L332 HydrophobicContact CG-CD2 3.97Å; M282-L332 HydrophobicContact SD-CD2 4.11Å; I317-L332 HydrophobicContact CB-CD2 4.47Å; I317-L332 HydrophobicContact CG1-CD2 4.05Å; I317-L332 HydrophobicContact CG2-CD2 4.19Å; L320-L332 HydrophobicContact CB-CD1 3.82Å; L320-L332 HydrophobicContact CB-CD2 4.21Å; L320-L332 HydrophobicContact CD1-CD2 3.96Å; R321-L332 HydrophobicContact CG-CD1 4.26Å; L328-L332 HydrophobicContact CD1-CG 4.5Å; L328-L332 HydrophobicContact CG-CD1 4.18Å; L328-L332 HydrophobicContact CG-CG 4.33Å; L328-L332 WeakPolarHBondContact O-CG 3.32Å; L328-L332 PolarHBondContact O-N 3.12Å; D329-L332 PolarHBondContact O-N 3.23Å; L332-F334 VanDerWaalsContact C-N 3.28Å; L332-F334 PolarHBondContact O-N 2.88Å; L332-F335 PolarHBondContact O-N 3.33Å; L332-E336 WeakPolarHBondContact O-CB 3.45Å; L332-E336 WeakPolarHBondContact O-CG 3.48Å; L332-E336 PolarHBondContact O-N 3.01Å
333	D	90.8	Very high	89.6	Confident	33 Å²	33	41.8 Å²	41.8	18%	0.176	21%	0.209	C	C	.	.	H	α-helix	trans	-56.5	-39.9	174.3	-87.2	18.9	0	0	0	112	R321 D329 M337 L1050	R321-D333 IonicContact CZ-OD1 3.08Å; R321-D333 VanDerWaalsContact CZ-OD1 3.29Å; R321-D333 IonicContact NH1-OD1 2.8Å; R321-D333 PolarHBondContact NH1-OD1 2.81Å; R321-D333 IonicContact NH2-OD1 2.84Å; R321-D333 PolarHBondContact NH2-OD1 2.79Å; D329-D333 VanDerWaalsContact O-CB 3.24Å; D329-D333 WeakPolarHBondContact O-CB 3.44Å; D329-D333 PolarHBondContact O-N 2.76Å; D333-M337 VanDerWaalsContact O-CB 3.23Å; D333-M337 WeakPolarHBondContact O-CB 3.38Å; D333-M337 PolarHBondContact O-N 2.86Å; D333-L1050 HydrophobicContact CB-CD2 3.89Å
334	F	91.1	Very high	89.8	Confident	6 Å²	6	43.8 Å²	43.8	3%	0.026	22%	0.221	C	C	.	.	H	α-helix	trans	-71.2	-41.6	178	-178.7	-104.4	0	0	0	112.5	N286 R330 L332 M337 L338 F1046 D1049 L1050	N286-F334 HydrophobicContact CB-CD1 3.86Å; N286-F334 HydrophobicContact CB-CE1 4.06Å; N286-F334 WeakPolarHBondContact OD1-CD1 3.47Å; R330-F334 WeakPolarHBondContact O-CB 3.34Å; R330-F334 PolarHBondContact O-N 2.82Å; L332-F334 VanDerWaalsContact C-N 3.28Å; L332-F334 PolarHBondContact O-N 2.88Å; F334-M337 HydrophobicContact CD2-CE 3.72Å; F334-M337 HydrophobicContact CE2-CE 4.42Å; F334-M337 PolarHBondContact O-N 3.25Å; F334-L338 HydrophobicContact CE1-CD2 4.25Å; F334-L338 HydrophobicContact CZ-CD2 4.23Å; F334-L338 WeakPolarHBondContact O-CB 3.32Å; F334-L338 PolarHBondContact O-N 2.79Å; F334-F1046 HydrophobicContact CD1-CB 4.26Å; F334-F1046 AromaticContact CD1-CD1 3.98Å; F334-F1046 HydrophobicContact CD1-CD1 3.98Å; F334-F1046 HydrophobicContact CD1-CD2 4.29Å; F334-F1046 HydrophobicContact CD1-CE1 4.43Å; F334-F1046 AromaticContact CD1-CG 3.91Å; F334-F1046 HydrophobicContact CD1-CG 3.91Å; F334-F1046 HydrophobicContact CD2-CB 3.66Å; F334-F1046 HydrophobicContact CD2-CD1 4.43Å; F334-F1046 HydrophobicContact CD2-CG 4.18Å; F334-F1046 HydrophobicContact CE1-CB 4.42Å; F334-F1046 AromaticContact CE1-CD1 3.48Å; F334-F1046 HydrophobicContact CE1-CD1 3.48Å; F334-F1046 VanDerWaalsContact CE1-CD1 3.48Å; F334-F1046 AromaticContact CE1-CE1 3.81Å; F334-F1046 HydrophobicContact CE1-CE1 3.81Å; F334-F1046 AromaticContact CE1-CG 3.91Å; F334-F1046 HydrophobicContact CE1-CG 3.91Å; F334-F1046 HydrophobicContact CE1-CZ 4.48Å; F334-F1046 HydrophobicContact CE2-CB 3.83Å; F334-F1046 AromaticContact CE2-CD1 3.99Å; F334-F1046 HydrophobicContact CE2-CD1 3.99Å; F334-F1046 HydrophobicContact CE2-CG 4.17Å; F334-F1046 HydrophobicContact CG-CB 3.89Å; F334-F1046 HydrophobicContact CG-CD1 4.43Å; F334-F1046 HydrophobicContact CG-CG 4.05Å; F334-F1046 HydrophobicContact CZ-CB 4.22Å; F334-F1046 AromaticContact CZ-CD1 3.48Å; F334-F1046 HydrophobicContact CZ-CD1 3.48Å; F334-F1046 VanDerWaalsContact CZ-CD1 3.48Å; F334-F1046 HydrophobicContact CZ-CE1 4.13Å; F334-F1046 HydrophobicContact CZ-CG 4.04Å; F334-D1049 HydrophobicContact CE2-CB 4.14Å; F334-L1050 HydrophobicContact CB-CD2 4.14Å; F334-L1050 HydrophobicContact CB-CG 4.43Å; F334-L1050 HydrophobicContact CD2-CG 4.43Å
335	F	92.8	Very high	90.1	Very high	2 Å²	2	39.4 Å²	39.4	1%	0.009	20%	0.2	C	C	.	.	H	α-helix	trans	-61	-48	175	-179	-86.4	0	0	0	111.3	M282 I285 L289 R305 I313 I317 H331 L332 R339	M282-F335 HydrophobicContact CE-CB 3.85Å; M282-F335 HydrophobicContact CE-CD2 4.1Å; M282-F335 HydrophobicContact CE-CG 4.05Å; I285-F335 HydrophobicContact CG2-CD2 4.15Å; I285-F335 HydrophobicContact CG2-CE2 4.04Å; L289-F335 HydrophobicContact CD1-CD2 3.93Å; L289-F335 HydrophobicContact CD1-CE2 3.63Å; R305-F335 HydrophobicContact CG-CZ 4.37Å; I313-F335 HydrophobicContact CD1-CE2 4.13Å; I313-F335 HydrophobicContact CD1-CZ 4.15Å; I313-F335 HydrophobicContact CG2-CZ 4.02Å; I317-F335 HydrophobicContact CD1-CD1 3.42Å; I317-F335 VanDerWaalsContact CD1-CD1 3.42Å; I317-F335 HydrophobicContact CD1-CE1 3.43Å; I317-F335 VanDerWaalsContact CD1-CE1 3.43Å; I317-F335 HydrophobicContact CD1-CG 4.11Å; I317-F335 HydrophobicContact CD1-CZ 4.13Å; H331-F335 WeakPolarHBondContact O-CB 3.42Å; H331-F335 PolarHBondContact O-N 3.37Å; L332-F335 PolarHBondContact O-N 3.33Å; F335-R339 WeakPolarHBondContact O-CB 3.37Å; F335-R339 PolarHBondContact O-N 3.41Å
336	E	91.4	Very high	90	Very high	50 Å²	50	39.4 Å²	39.4	23%	0.234	20%	0.198	C	C	.	.	H	α-helix	trans	-62.7	-42.5	176.3	-75.1	172.9	-147.3	0	0	111.9	R321 L332 R339 N340	R321-E336 IonicContact CZ-OE1 3.23Å; R321-E336 IonicContact NE-OE1 3.05Å; R321-E336 PolarHBondContact NE-OE1 3.44Å; R321-E336 IonicContact NH2-OE1 2.86Å; R321-E336 PolarHBondContact NH2-OE1 3.01Å; R321-E336 IonicContact NH2-OE2 2.71Å; R321-E336 PolarHBondContact NH2-OE2 3.42Å; R321-E336 VanDerWaalsContact NH2-OE2 3.17Å; L332-E336 WeakPolarHBondContact O-CB 3.45Å; L332-E336 WeakPolarHBondContact O-CG 3.48Å; L332-E336 PolarHBondContact O-N 3.01Å; E336-R339 PolarHBondContact O-N 3.09Å; E336-N340 WeakPolarHBondContact O-CB 3.39Å; E336-N340 PolarHBondContact O-N 3.43Å; E336-N340 PolarHBondContact O-ND2 3.26Å
337	M	88.7	Confident	89.9	Confident	5 Å²	5	35.3 Å²	35.3	3%	0.025	17%	0.17	C	C	.	.	H	α-helix	trans	-57.8	-57.3	175.3	-175.6	-148.6	-42.2	0	0	111.2	D333 F334 R339 N340 E341 D1049 L1050 L1053	D333-M337 VanDerWaalsContact O-CB 3.23Å; D333-M337 WeakPolarHBondContact O-CB 3.38Å; D333-M337 PolarHBondContact O-N 2.86Å; F334-M337 HydrophobicContact CD2-CE 3.72Å; F334-M337 HydrophobicContact CE2-CE 4.42Å; F334-M337 PolarHBondContact O-N 3.25Å; M337-R339 PolarHBondContact O-N 3.42Å; M337-N340 PolarHBondContact O-N 2.94Å; M337-E341 HydrophobicContact CG-CG 4.43Å; M337-E341 PolarHBondContact O-N 2.97Å; M337-D1049 HydrophobicContact CE-CB 4.24Å; M337-D1049 HydrophobicContact SD-CB 4.04Å; M337-L1050 VanDerWaalsContact CE-CA 3.47Å; M337-L1050 HydrophobicContact CE-CB 4.18Å; M337-L1050 HydrophobicContact CE-CD2 3.55Å; M337-L1050 HydrophobicContact CE-CG 3.73Å; M337-L1053 HydrophobicContact CB-CD2 4.06Å; M337-L1053 HydrophobicContact CE-CB 4.16Å; M337-L1053 HydrophobicContact CE-CD2 4.36Å; M337-L1053 HydrophobicContact CG-CB 4.12Å; M337-L1053 HydrophobicContact CG-CD1 4.21Å; M337-L1053 HydrophobicContact CG-CD2 4.1Å; M337-L1053 HydrophobicContact CG-CG 4.36Å; M337-L1053 HydrophobicContact SD-CB 4.3Å
338	L	87.9	Confident	89.9	Confident	24 Å²	24	39.6 Å²	39.6	13%	0.126	19%	0.185	C	C	.	.	H	α-helix	trans	-65	-33.1	-174.4	-166.4	69.5	0	0	0	110.6	R305 F334 D342	R305-L338 PolarHBondContact NH2-O 3.04Å; F334-L338 HydrophobicContact CE1-CD2 4.25Å; F334-L338 HydrophobicContact CZ-CD2 4.23Å; F334-L338 WeakPolarHBondContact O-CB 3.32Å; F334-L338 PolarHBondContact O-N 2.79Å; L338-D342 VanDerWaalsContact O-CB 3.22Å; L338-D342 WeakPolarHBondContact O-CB 3.21Å; L338-D342 PolarHBondContact O-N 3.14Å
339	R	89.9	Confident	89.7	Confident	53 Å²	53	44 Å²	44	20%	0.2	20%	0.201	C	C	.	.	H	α-helix	trans	-61.9	-49.5	169.7	177.5	176.2	172.2	-121.8	-34.9	112	F335 E336 M337 D342 E343	F335-R339 WeakPolarHBondContact O-CB 3.37Å; F335-R339 PolarHBondContact O-N 3.41Å; E336-R339 PolarHBondContact O-N 3.09Å; M337-R339 PolarHBondContact O-N 3.42Å; R339-D342 PolarHBondContact O-N 3.1Å; R339-E343 WeakPolarHBondContact CG-OE1 3.28Å; R339-E343 IonicContact CZ-OE1 3.84Å; R339-E343 IonicContact NE-OE1 3.04Å; R339-E343 PolarHBondContact NE-OE1 3.03Å; R339-E343 IonicContact NH2-OE1 2.59Å; R339-E343 PolarHBondContact NH2-OE1 2.85Å; R339-E343 IonicContact NH2-OE2 2.8Å; R339-E343 PolarHBondContact NH2-OE2 3.49Å; R339-E343 WeakPolarHBondContact O-CB 3.12Å; R339-E343 WeakPolarHBondContact O-CG 3.36Å; R339-E343 PolarHBondContact O-N 3.07Å
340	N	88.6	Confident	89.4	Confident	93 Å²	93	44.1 Å²	44.1	50%	0.497	20%	0.2	S	C	.	.	H	α-helix	trans	-67.9	-36.6	-179.5	-75.5	-59.2	0	0	0	112.5	E336 M337 L344	E336-N340 WeakPolarHBondContact O-CB 3.39Å; E336-N340 PolarHBondContact O-N 3.43Å; E336-N340 PolarHBondContact O-ND2 3.26Å; M337-N340 PolarHBondContact O-N 2.94Å; N340-L344 WeakPolarHBondContact O-CB 3.41Å; N340-L344 PolarHBondContact O-N 3.42Å
341	E	87.4	Confident	89.1	Confident	74 Å²	74	48.7 Å²	48.7	35%	0.346	23%	0.225	S	C	.	.	H	α-helix	trans	-67.7	-43	174.8	-69.4	-167.3	163.4	0	0	111.1	M337 L344 E345	M337-E341 HydrophobicContact CG-CG 4.43Å; M337-E341 PolarHBondContact O-N 2.97Å; E341-L344 PolarHBondContact O-N 3.12Å; E341-E345 WeakPolarHBondContact O-CB 3.43Å; E341-E345 PolarHBondContact O-N 2.76Å
342	D	89.5	Confident	88.4	Confident	3 Å²	3	51.7 Å²	51.7	2%	0.016	24%	0.241	C	C	.	.	H	α-helix	trans	-67.9	-40.9	176.4	-73.5	-15.3	0	0	0	113	L298 R301 L302 R305 L338 R339 L344 E345 F346	L298-D342 HydrophobicContact CD1-CB 3.63Å; L298-D342 VanDerWaalsContact CD1-OD1 3.23Å; L298-D342 WeakPolarHBondContact CD1-OD1 3.44Å; R301-D342 WeakPolarHBondContact CB-OD2 3.43Å; R301-D342 IonicContact CZ-OD1 2.69Å; R301-D342 VanDerWaalsContact NE-CG 3.32Å; R301-D342 IonicContact NE-OD1 2.75Å; R301-D342 PolarHBondContact NE-OD1 3.28Å; R301-D342 IonicContact NE-OD2 3.64Å; R301-D342 PolarHBondContact NE-OD2 3.15Å; R301-D342 IonicContact NH2-OD1 2.65Å; R301-D342 PolarHBondContact NH2-OD1 2.96Å; L302-D342 HydrophobicContact CD2-CB 4.06Å; R305-D342 IonicContact CZ-OD2 2.93Å; R305-D342 IonicContact NH1-OD2 2.67Å; R305-D342 PolarHBondContact NH1-OD2 3.24Å; R305-D342 IonicContact NH2-OD2 2.67Å; R305-D342 PolarHBondContact NH2-OD2 3.01Å; L338-D342 VanDerWaalsContact O-CB 3.22Å; L338-D342 WeakPolarHBondContact O-CB 3.21Å; L338-D342 PolarHBondContact O-N 3.14Å; R339-D342 PolarHBondContact O-N 3.1Å; D342-L344 VanDerWaalsContact C-N 3.33Å; D342-L344 PolarHBondContact O-N 2.92Å; D342-E345 PolarHBondContact O-N 2.75Å; D342-F346 VanDerWaalsContact O-CB 3.3Å; D342-F346 WeakPolarHBondContact O-CB 3.37Å; D342-F346 PolarHBondContact O-N 2.73Å
343	E	88.1	Confident	87.7	Confident	28 Å²	28	58 Å²	58	13%	0.131	28%	0.279	C	S	.	.	H	α-helix	trans	-63.6	-38.5	174.2	-79.4	180	-156.8	0	0	111.5	R339 A347 H354	R339-E343 WeakPolarHBondContact CG-OE1 3.28Å; R339-E343 IonicContact CZ-OE1 3.84Å; R339-E343 IonicContact NE-OE1 3.04Å; R339-E343 PolarHBondContact NE-OE1 3.03Å; R339-E343 IonicContact NH2-OE1 2.59Å; R339-E343 PolarHBondContact NH2-OE1 2.85Å; R339-E343 IonicContact NH2-OE2 2.8Å; R339-E343 PolarHBondContact NH2-OE2 3.49Å; R339-E343 WeakPolarHBondContact O-CB 3.12Å; R339-E343 WeakPolarHBondContact O-CG 3.36Å; R339-E343 PolarHBondContact O-N 3.07Å; E343-A347 VanDerWaalsContact O-CB 3.3Å; E343-A347 WeakPolarHBondContact O-CB 3.39Å; E343-A347 PolarHBondContact O-N 2.79Å; E343-H354 IonicContact OE2-CE1 2.94Å; E343-H354 IonicContact OE2-ND1 3.37Å
344	L	87.2	Confident	87.4	Confident	77 Å²	77	61.1 Å²	61.1	40%	0.403	29%	0.292	S	S	.	.	H	α-helix	trans	-73.1	-35	176	-179.4	62.7	0	0	0	112.5	N340 E341 D342 K348	N340-L344 WeakPolarHBondContact O-CB 3.41Å; N340-L344 PolarHBondContact O-N 3.42Å; E341-L344 PolarHBondContact O-N 3.12Å; D342-L344 VanDerWaalsContact C-N 3.33Å; D342-L344 PolarHBondContact O-N 2.92Å; L344-K348 WeakPolarHBondContact O-CD 3.29Å; L344-K348 WeakPolarHBondContact O-CG 3.37Å; L344-K348 PolarHBondContact O-N 2.76Å
345	E	88.2	Confident	87	Confident	86 Å²	86	61.1 Å²	61.1	40%	0.402	29%	0.292	S	S	.	.	H	α-helix	trans	-67	-40.7	172.6	-160.1	-172.4	142.6	0	0	111.1	L298 R301 E341 D342	L298-E345 HydrophobicContact CD1-CB 4.26Å; L298-E345 HydrophobicContact CD2-CB 3.88Å; L298-E345 HydrophobicContact CD2-CG 3.85Å; R301-E345 IonicContact NH2-OE2 2.59Å; E341-E345 WeakPolarHBondContact O-CB 3.43Å; E341-E345 PolarHBondContact O-N 2.76Å; D342-E345 PolarHBondContact O-N 2.75Å
346	F	89.4	Confident	86.4	Confident	38 Å²	38	64 Å²	64	17%	0.167	31%	0.307	C	S	.	.	H	α-helix	trans	-64.3	-47.5	174.1	-172.9	-111.9	0	0	0	112.1	L302 D342 K348 R349 F350 I355 T357	L302-F346 HydrophobicContact CD1-CB 4.04Å; L302-F346 HydrophobicContact CD1-CD2 3.55Å; L302-F346 HydrophobicContact CD1-CE2 4.24Å; L302-F346 HydrophobicContact CD1-CG 3.95Å; D342-F346 VanDerWaalsContact O-CB 3.3Å; D342-F346 WeakPolarHBondContact O-CB 3.37Å; D342-F346 PolarHBondContact O-N 2.73Å; F346-K348 VanDerWaalsContact C-N 3.32Å; F346-K348 PolarHBondContact O-N 2.61Å; F346-R349 VanDerWaalsContact O-CB 3.28Å; F346-R349 WeakPolarHBondContact O-CB 3.46Å; F346-R349 PolarHBondContact O-N 2.92Å; F346-F350 HydrophobicContact CE1-CE2 4.23Å; F346-F350 HydrophobicContact CE2-CE2 4.05Å; F346-F350 AromaticContact CZ-CE2 3.88Å; F346-F350 HydrophobicContact CZ-CE2 3.88Å; F346-F350 HydrophobicContact CZ-CZ 4.33Å; F346-F350 WeakPolarHBondContact O-CD2 3.34Å; F346-I355 HydrophobicContact CD1-CD1 3.8Å; F346-I355 HydrophobicContact CE1-CD1 3.77Å; F346-I355 HydrophobicContact CE1-CG2 4.33Å; F346-T357 HydrophobicContact CE1-CG2 4.46Å
347	A	87.4	Confident	85.8	Confident	0 Å²	0	64 Å²	64	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-62.3	-36	-179.4	0	0	0	0	0	113.2	E343 R349 F350 E351 L352 I355	E343-A347 VanDerWaalsContact O-CB 3.3Å; E343-A347 WeakPolarHBondContact O-CB 3.39Å; E343-A347 PolarHBondContact O-N 2.79Å; A347-R349 PolarHBondContact O-N 2.97Å; A347-F350 PolarHBondContact O-N 2.85Å; A347-E351 PolarHBondContact O-N 3.37Å; A347-L352 CarbonylContact C-O 3.48Å; A347-L352 VanDerWaalsContact C-O 3.28Å; A347-L352 HydrophobicContact CB-CB 4.47Å; A347-L352 VanDerWaalsContact CB-O 3.27Å; A347-L352 WeakPolarHBondContact CB-O 3.46Å; A347-L352 PolarHBondContact O-N 2.95Å; A347-L352 VanDerWaalsContact O-N 3.09Å; A347-I355 HydrophobicContact CB-CD1 4.35Å; A347-I355 HydrophobicContact CB-CG1 4.18Å
348	K	88.3	Confident	85.4	Confident	131 Å²	131	72.3 Å²	72.3	57%	0.57	35%	0.347	S	S	*	.	H	α-helix	trans	-57.6	-30.7	172.8	-75.3	163.5	-169.3	153.3	0	113.4	L344 F346 F350 E351	L344-K348 WeakPolarHBondContact O-CD 3.29Å; L344-K348 WeakPolarHBondContact O-CG 3.37Å; L344-K348 PolarHBondContact O-N 2.76Å; F346-K348 VanDerWaalsContact C-N 3.32Å; F346-K348 PolarHBondContact O-N 2.61Å; K348-F350 PolarHBondContact O-N 3.23Å; K348-F350 VanDerWaalsContact O-N 3.08Å; K348-E351 PolarHBondContact O-N 2.83Å
349	R	87.1	Confident	85.3	Confident	95 Å²	95	72.8 Å²	72.8	36%	0.358	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64	-11.1	176.2	-60.1	176.9	171.6	-167.2	-2.4	113.3	D299 F346 A347 R370	D299-R349 VanDerWaalsContact CG-NH1 3.33Å; D299-R349 IonicContact OD1-CZ 2.72Å; D299-R349 IonicContact OD1-NH1 3.43Å; D299-R349 PolarHBondContact OD1-NH1 3.01Å; D299-R349 IonicContact OD1-NH2 2.7Å; D299-R349 IonicContact OD2-CZ 2.66Å; D299-R349 IonicContact OD2-NH1 3.54Å; D299-R349 PolarHBondContact OD2-NH1 3.39Å; D299-R349 IonicContact OD2-NH2 3.58Å; D299-R349 PolarHBondContact OD2-NH2 3.38Å; F346-R349 VanDerWaalsContact O-CB 3.28Å; F346-R349 WeakPolarHBondContact O-CB 3.46Å; F346-R349 PolarHBondContact O-N 2.92Å; A347-R349 PolarHBondContact O-N 2.97Å; R349-R370 PolarHBondContact O-NH1 3.24Å
350	F	84.6	Confident	85.1	Confident	43 Å²	43	74.1 Å²	74.1	19%	0.189	38%	0.375	C	S	.	.	T	Hydrogen-bonded Turn	trans	-125.5	12	-179.8	-59.2	-100.1	0	0	0	112.9	F346 A347 K348 L352 I355 L366 R370	F346-F350 HydrophobicContact CE1-CE2 4.23Å; F346-F350 HydrophobicContact CE2-CE2 4.05Å; F346-F350 AromaticContact CZ-CE2 3.88Å; F346-F350 HydrophobicContact CZ-CE2 3.88Å; F346-F350 HydrophobicContact CZ-CZ 4.33Å; F346-F350 WeakPolarHBondContact O-CD2 3.34Å; A347-F350 PolarHBondContact O-N 2.85Å; K348-F350 PolarHBondContact O-N 3.23Å; K348-F350 VanDerWaalsContact O-N 3.08Å; F350-L352 HydrophobicContact CB-CG 4.46Å; F350-L352 PolarHBondContact O-N 2.82Å; F350-I355 HydrophobicContact CB-CD1 4.23Å; F350-I355 HydrophobicContact CD2-CD1 3.48Å; F350-I355 VanDerWaalsContact CD2-CD1 3.48Å; F350-I355 HydrophobicContact CE2-CD1 3.99Å; F350-I355 HydrophobicContact CG-CD1 3.98Å; F350-L366 HydrophobicContact CB-CD2 4.43Å; F350-L366 HydrophobicContact CD1-CB 4.15Å; F350-L366 HydrophobicContact CD1-CD2 4.16Å; F350-L366 HydrophobicContact CE1-CB 4.12Å; F350-R370 HydrophobicContact CD1-CG 3.96Å; F350-R370 HydrophobicContact CE1-CG 3.73Å
351	E	84.5	Confident	85.1	Confident	181 Å²	181	74.7 Å²	74.7	85%	0.846	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.8	25.6	-176.2	-58.6	167.5	177.8	0	0	114	A347 K348	A347-E351 PolarHBondContact O-N 3.37Å; K348-E351 PolarHBondContact O-N 2.83Å
352	L	80.8	Confident	85.2	Confident	64 Å²	64	74.2 Å²	74.2	34%	0.335	38%	0.38	S	S	.	.			trans	-108	156.8	179.5	-66.5	-177.5	0	0	0	112.7	A347 F350 I355 L366	A347-L352 CarbonylContact C-O 3.48Å; A347-L352 VanDerWaalsContact C-O 3.28Å; A347-L352 HydrophobicContact CB-CB 4.47Å; A347-L352 VanDerWaalsContact CB-O 3.27Å; A347-L352 WeakPolarHBondContact CB-O 3.46Å; A347-L352 PolarHBondContact O-N 2.95Å; A347-L352 VanDerWaalsContact O-N 3.09Å; F350-L352 HydrophobicContact CB-CG 4.46Å; F350-L352 PolarHBondContact O-N 2.82Å; L352-I355 HydrophobicContact CB-CG1 4.48Å; L352-I355 HydrophobicContact CD1-CG1 4.08Å; L352-L366 HydrophobicContact CD1-CD1 4.43Å; L352-L366 HydrophobicContact CD1-CD2 3.73Å
353	V	78.3	Confident	85.2	Confident	131 Å²	131	77.1 Å²	77.1	79%	0.794	39%	0.394	S	S	*	.	S	Bend	trans	-79.5	-32.9	173.4	-178.8	0	0	0	0	111.5
354	H	83.5	Confident	85.3	Confident	100 Å²	100	79.7 Å²	79.7	46%	0.463	41%	0.405	S	S	.	.			trans	-152.4	153.8	179.3	178.7	65.7	0	0	0	110.3	E343	E343-H354 IonicContact OE2-CE1 2.94Å; E343-H354 IonicContact OE2-ND1 3.37Å
355	I	84	Confident	85.4	Confident	5 Å²	5	79.5 Å²	79.5	3%	0.026	40%	0.402	C	S	.	.			trans	-129.7	121.7	170.8	-64.3	172	0	0	0	107	F346 A347 F350 L352 T357 M363 L366	F346-I355 HydrophobicContact CD1-CD1 3.8Å; F346-I355 HydrophobicContact CE1-CD1 3.77Å; F346-I355 HydrophobicContact CE1-CG2 4.33Å; A347-I355 HydrophobicContact CB-CD1 4.35Å; A347-I355 HydrophobicContact CB-CG1 4.18Å; F350-I355 HydrophobicContact CB-CD1 4.23Å; F350-I355 HydrophobicContact CD2-CD1 3.48Å; F350-I355 VanDerWaalsContact CD2-CD1 3.48Å; F350-I355 HydrophobicContact CE2-CD1 3.99Å; F350-I355 HydrophobicContact CG-CD1 3.98Å; L352-I355 HydrophobicContact CB-CG1 4.48Å; L352-I355 HydrophobicContact CD1-CG1 4.08Å; I355-T357 HydrophobicContact CG2-CG2 4.32Å; I355-T357 PolarHBondContact O-N 3.28Å; I355-T357 VanDerWaalsContact O-N 3.1Å; I355-M363 HydrophobicContact CG2-SD 3.81Å; I355-L366 HydrophobicContact CB-CD1 4.39Å; I355-L366 HydrophobicContact CD1-CD1 3.89Å; I355-L366 HydrophobicContact CG1-CD1 3.88Å; I355-L366 HydrophobicContact CG2-CD1 3.64Å
356	D	80.3	Confident	85.5	Confident	62 Å²	62	76.4 Å²	76.4	33%	0.332	39%	0.388	S	S	.	.			trans	-77.6	93.9	170.6	176.5	18.3	0	0	0	109.2	K358 S359	D356-K358 PolarHBondContact O-N 2.92Å; D356-K358 VanDerWaalsContact O-N 3.09Å; D356-K358 VanDerWaalsContact OD1-CB 3.24Å; D356-K358 WeakPolarHBondContact OD1-CB 3.48Å; D356-K358 PolarHBondContact OD1-N 3.29Å; D356-S359 PolarHBondContact O-N 3.47Å; D356-S359 VanDerWaalsContact OD2-CB 3.3Å; D356-S359 WeakPolarHBondContact OD2-CB 3.44Å; D356-S359 PolarHBondContact OD2-N 3.42Å
357	T	79	Confident	85.5	Confident	52 Å²	52	77.2 Å²	77.2	32%	0.319	40%	0.396	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-6.5	177.6	54.6	0	0	0	0	113.9	F346 I355 M363	F346-T357 HydrophobicContact CE1-CG2 4.46Å; I355-T357 HydrophobicContact CG2-CG2 4.32Å; I355-T357 PolarHBondContact O-N 3.28Å; I355-T357 VanDerWaalsContact O-N 3.1Å; T357-M363 HydrophobicContact CG2-SD 4.38Å
358	K	79.5	Confident	85.7	Confident	178 Å²	178	81.7 Å²	81.7	77%	0.774	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.6	-21.4	172.7	-51.3	176.1	-177.6	177.5	0	112.3	D356 A360	D356-K358 PolarHBondContact O-N 2.92Å; D356-K358 VanDerWaalsContact O-N 3.09Å; D356-K358 VanDerWaalsContact OD1-CB 3.24Å; D356-K358 WeakPolarHBondContact OD1-CB 3.48Å; D356-K358 PolarHBondContact OD1-N 3.29Å; K358-A360 PolarHBondContact O-N 3.11Å
359	S	86.3	Confident	85.7	Confident	35 Å²	35	82.5 Å²	82.5	25%	0.245	42%	0.417	C	S	.	.			trans	-81.1	98	178.7	-179.6	0	0	0	0	111	D356 T361 Q362 M363	D356-S359 PolarHBondContact O-N 3.47Å; D356-S359 VanDerWaalsContact OD2-CB 3.3Å; D356-S359 WeakPolarHBondContact OD2-CB 3.44Å; D356-S359 PolarHBondContact OD2-N 3.42Å; S359-T361 PolarHBondContact O-N 3.37Å; S359-T361 VanDerWaalsContact O-N 3.16Å; S359-Q362 PolarHBondContact O-N 2.86Å; S359-Q362 PolarHBondContact OG-N 3.25Å; S359-Q362 VanDerWaalsContact OG-N 3.15Å; S359-M363 WeakPolarHBondContact O-CG 3.22Å; S359-M363 PolarHBondContact O-N 3.4Å
360	A	85.4	Confident	85.7	Confident	81 Å²	81	85.3 Å²	85.3	67%	0.669	43%	0.427	S	S	*	.	H	α-helix	trans	-52.4	-36.3	173.2	0	0	0	0	0	112.2	K358 F364	K358-A360 PolarHBondContact O-N 3.11Å; A360-F364 VanDerWaalsContact O-CB 3.25Å; A360-F364 WeakPolarHBondContact O-CB 3.32Å; A360-F364 PolarHBondContact O-N 3.23Å
361	T	88.6	Confident	86	Confident	104 Å²	104	85.4 Å²	85.4	64%	0.638	43%	0.43	S	S	*	.	H	α-helix	trans	-65.6	-44.2	175.3	-49	0	0	0	0	112.2	S359 F364 E365	S359-T361 PolarHBondContact O-N 3.37Å; S359-T361 VanDerWaalsContact O-N 3.16Å; T361-F364 PolarHBondContact O-N 3.34Å; T361-E365 WeakPolarHBondContact O-CB 3.37Å; T361-E365 WeakPolarHBondContact O-CG 3.4Å; T361-E365 PolarHBondContact O-N 3.27Å
362	Q	89.4	Confident	86.2	Confident	64 Å²	64	79.4 Å²	79.4	30%	0.299	41%	0.405	S	S	.	.	H	α-helix	trans	-69.7	-42.1	178.6	-163.6	-175.9	37.7	0	0	111.4	S359 F364 E365 L366	S359-Q362 PolarHBondContact O-N 2.86Å; S359-Q362 PolarHBondContact OG-N 3.25Å; S359-Q362 VanDerWaalsContact OG-N 3.15Å; Q362-F364 VanDerWaalsContact C-N 3.3Å; Q362-F364 PolarHBondContact O-N 3.41Å; Q362-E365 PolarHBondContact O-N 3.4Å; Q362-L366 HydrophobicContact CG-CD1 4.07Å; Q362-L366 HydrophobicContact CG-CG 4.32Å; Q362-L366 WeakPolarHBondContact O-CB 3.46Å; Q362-L366 VanDerWaalsContact O-CG 3.28Å; Q362-L366 WeakPolarHBondContact O-CG 3.29Å; Q362-L366 PolarHBondContact O-N 2.87Å
363	M	89.3	Confident	86.4	Confident	64 Å²	64	85.1 Å²	85.1	32%	0.315	43%	0.43	S	S	.	.	H	α-helix	trans	-60.9	-39.9	175.6	-66.7	-60.2	-68.5	0	0	111.7	I355 T357 S359 T367	I355-M363 HydrophobicContact CG2-SD 3.81Å; T357-M363 HydrophobicContact CG2-SD 4.38Å; S359-M363 WeakPolarHBondContact O-CG 3.22Å; S359-M363 PolarHBondContact O-N 3.4Å; M363-T367 WeakPolarHBondContact O-CB 3.48Å; M363-T367 PolarHBondContact O-N 3.47Å; M363-T367 VanDerWaalsContact O-N 3.12Å; M363-T367 PolarHBondContact O-OG1 3.41Å
364	F	91.2	Very high	86.9	Confident	83 Å²	83	81 Å²	81	36%	0.364	41%	0.407	S	S	.	.	H	α-helix	trans	-62.3	-50.4	171.9	176	-94.4	0	0	0	112.1	A360 T361 Q362 L366 T367 R368 F380 L384	A360-F364 VanDerWaalsContact O-CB 3.25Å; A360-F364 WeakPolarHBondContact O-CB 3.32Å; A360-F364 PolarHBondContact O-N 3.23Å; T361-F364 PolarHBondContact O-N 3.34Å; Q362-F364 VanDerWaalsContact C-N 3.3Å; Q362-F364 PolarHBondContact O-N 3.41Å; F364-L366 PolarHBondContact O-N 3.32Å; F364-T367 PolarHBondContact O-N 2.82Å; F364-R368 WeakPolarHBondContact O-CB 3.45Å; F364-R368 PolarHBondContact O-N 3.26Å; F364-F380 HydrophobicContact CD2-CZ 4.33Å; F364-F380 HydrophobicContact CE2-CE1 4.47Å; F364-F380 HydrophobicContact CE2-CZ 4.16Å; F364-L384 HydrophobicContact CD2-CD2 4.25Å; F364-L384 HydrophobicContact CE2-CD1 3.68Å; F364-L384 HydrophobicContact CE2-CD2 3.83Å; F364-L384 HydrophobicContact CE2-CG 4.43Å; F364-L384 HydrophobicContact CZ-CD1 4.3Å
365	E	88.9	Confident	87	Confident	73 Å²	73	85 Å²	85	34%	0.341	43%	0.426	S	S	.	.	H	α-helix	trans	-65.1	-37.7	-177.7	-79.7	-60.3	128.8	0	0	113.2	T361 Q362 R368 K369	T361-E365 WeakPolarHBondContact O-CB 3.37Å; T361-E365 WeakPolarHBondContact O-CG 3.4Å; T361-E365 PolarHBondContact O-N 3.27Å; Q362-E365 PolarHBondContact O-N 3.4Å; E365-R368 PolarHBondContact O-N 2.89Å; E365-R368 IonicContact OE1-CZ 3.39Å; E365-R368 IonicContact OE1-NE 3.63Å; E365-R368 PolarHBondContact OE1-NE 3.39Å; E365-R368 IonicContact OE1-NH2 3.53Å; E365-R368 PolarHBondContact OE1-NH2 3.2Å; E365-R368 IonicContact OE2-CZ 2.96Å; E365-R368 IonicContact OE2-NE 2.77Å; E365-R368 PolarHBondContact OE2-NE 3.4Å; E365-R368 VanDerWaalsContact OE2-NE 3.14Å; E365-R368 IonicContact OE2-NH2 3.2Å; E365-R368 PolarHBondContact OE2-NH2 3.39Å; E365-K369 VanDerWaalsContact O-CB 3.32Å; E365-K369 WeakPolarHBondContact O-CB 3.5Å; E365-K369 PolarHBondContact O-N 3.19Å
366	L	89.6	Confident	87.1	Confident	20 Å²	20	86.9 Å²	86.9	11%	0.105	44%	0.442	C	S	.	.	H	α-helix	trans	-65.3	-41.8	173.5	-69.1	172.3	0	0	0	111.8	F350 L352 I355 Q362 F364 R370	F350-L366 HydrophobicContact CB-CD2 4.43Å; F350-L366 HydrophobicContact CD1-CB 4.15Å; F350-L366 HydrophobicContact CD1-CD2 4.16Å; F350-L366 HydrophobicContact CE1-CB 4.12Å; L352-L366 HydrophobicContact CD1-CD1 4.43Å; L352-L366 HydrophobicContact CD1-CD2 3.73Å; I355-L366 HydrophobicContact CB-CD1 4.39Å; I355-L366 HydrophobicContact CD1-CD1 3.89Å; I355-L366 HydrophobicContact CG1-CD1 3.88Å; I355-L366 HydrophobicContact CG2-CD1 3.64Å; Q362-L366 HydrophobicContact CG-CD1 4.07Å; Q362-L366 HydrophobicContact CG-CG 4.32Å; Q362-L366 WeakPolarHBondContact O-CB 3.46Å; Q362-L366 VanDerWaalsContact O-CG 3.28Å; Q362-L366 WeakPolarHBondContact O-CG 3.29Å; Q362-L366 PolarHBondContact O-N 2.87Å; F364-L366 PolarHBondContact O-N 3.32Å; L366-R370 WeakPolarHBondContact O-CB 3.31Å; L366-R370 WeakPolarHBondContact O-CG 3.36Å; L366-R370 PolarHBondContact O-N 3.23Å; L366-R370 VanDerWaalsContact O-N 3.08Å
367	T	90.5	Very high	87.6	Confident	56 Å²	56	87.1 Å²	87.1	34%	0.344	44%	0.439	S	S	.	.	H	α-helix	trans	-64.7	-44.5	175.2	-54.7	0	0	0	0	110.9	M363 F364 R370 L371 F380	M363-T367 WeakPolarHBondContact O-CB 3.48Å; M363-T367 PolarHBondContact O-N 3.47Å; M363-T367 VanDerWaalsContact O-N 3.12Å; M363-T367 PolarHBondContact O-OG1 3.41Å; F364-T367 PolarHBondContact O-N 2.82Å; T367-R370 PolarHBondContact O-N 3Å; T367-L371 HydrophobicContact CG2-CD1 3.89Å; T367-L371 VanDerWaalsContact O-CG 3.31Å; T367-L371 WeakPolarHBondContact O-CG 3.4Å; T367-L371 PolarHBondContact O-N 2.95Å; T367-L371 VanDerWaalsContact O-N 3.16Å; T367-F380 HydrophobicContact CG2-CD2 4.21Å; T367-F380 HydrophobicContact CG2-CE1 4.44Å; T367-F380 HydrophobicContact CG2-CE2 3.53Å; T367-F380 HydrophobicContact CG2-CZ 3.66Å
368	R	90.3	Very high	88	Confident	94 Å²	94	88.7 Å²	88.7	36%	0.355	45%	0.45	S	S	.	.	H	α-helix	trans	-58.3	-56.1	175.5	-169.9	173.6	74.8	95.2	-1	110.7	F364 E365 R370 L371 T372 Y377 F380	F364-R368 WeakPolarHBondContact O-CB 3.45Å; F364-R368 PolarHBondContact O-N 3.26Å; E365-R368 PolarHBondContact O-N 2.89Å; E365-R368 IonicContact OE1-CZ 3.39Å; E365-R368 IonicContact OE1-NE 3.63Å; E365-R368 PolarHBondContact OE1-NE 3.39Å; E365-R368 IonicContact OE1-NH2 3.53Å; E365-R368 PolarHBondContact OE1-NH2 3.2Å; E365-R368 IonicContact OE2-CZ 2.96Å; E365-R368 IonicContact OE2-NE 2.77Å; E365-R368 PolarHBondContact OE2-NE 3.4Å; E365-R368 VanDerWaalsContact OE2-NE 3.14Å; E365-R368 IonicContact OE2-NH2 3.2Å; E365-R368 PolarHBondContact OE2-NH2 3.39Å; R368-R370 VanDerWaalsContact C-N 3.28Å; R368-R370 PolarHBondContact O-N 3.47Å; R368-L371 PolarHBondContact O-N 3.44Å; R368-T372 PolarHBondContact O-N 2.94Å; R368-T372 PolarHBondContact O-OG1 3.44Å; R368-Y377 HydrophobicContact CG-CE2 4.3Å; R368-F380 HydrophobicContact CB-CE1 4.39Å
369	K	89.3	Confident	88.5	Confident	147 Å²	147	86.5 Å²	86.5	64%	0.639	44%	0.442	S	S	*	.	H	α-helix	trans	-53.3	-42.5	179	-174.2	-173.3	176.5	-167.9	0	112.4	E365 L371	E365-K369 VanDerWaalsContact O-CB 3.32Å; E365-K369 WeakPolarHBondContact O-CB 3.5Å; E365-K369 PolarHBondContact O-N 3.19Å; K369-L371 VanDerWaalsContact C-N 3.32Å; K369-L371 PolarHBondContact O-N 2.88Å
370	R	87.4	Confident	88.8	Confident	155 Å²	155	86.1 Å²	86.1	59%	0.585	44%	0.436	S	S	*	.	H	α-helix	trans	-65.4	-31.9	177.5	-74.5	-79.9	-70.8	-139	-1.6	113.4	R349 F350 L366 T367 R368	R349-R370 PolarHBondContact O-NH1 3.24Å; F350-R370 HydrophobicContact CD1-CG 3.96Å; F350-R370 HydrophobicContact CE1-CG 3.73Å; L366-R370 WeakPolarHBondContact O-CB 3.31Å; L366-R370 WeakPolarHBondContact O-CG 3.36Å; L366-R370 PolarHBondContact O-N 3.23Å; L366-R370 VanDerWaalsContact O-N 3.08Å; T367-R370 PolarHBondContact O-N 3Å; R368-R370 VanDerWaalsContact C-N 3.28Å; R368-R370 PolarHBondContact O-N 3.47Å
371	L	90.8	Very high	89.1	Confident	45 Å²	45	86.6 Å²	86.6	24%	0.236	43%	0.426	C	S	.	.	H	α-helix	trans	-100.2	-22.4	-171.4	-63.5	178.5	0	0	0	114.3	T367 R368 K369 H373 S374 A376 Y377 F380	T367-L371 HydrophobicContact CG2-CD1 3.89Å; T367-L371 VanDerWaalsContact O-CG 3.31Å; T367-L371 WeakPolarHBondContact O-CG 3.4Å; T367-L371 PolarHBondContact O-N 2.95Å; T367-L371 VanDerWaalsContact O-N 3.16Å; R368-L371 PolarHBondContact O-N 3.44Å; K369-L371 VanDerWaalsContact C-N 3.32Å; K369-L371 PolarHBondContact O-N 2.88Å; L371-H373 PolarHBondContact O-N 2.93Å; L371-S374 WeakPolarHBondContact O-CB 3.5Å; L371-S374 PolarHBondContact O-N 3.05Å; L371-S374 PolarHBondContact O-OG 3.49Å; L371-A376 HydrophobicContact CD2-CB 4.16Å; L371-Y377 HydrophobicContact CB-CD2 4.09Å; L371-Y377 WeakPolarHBondContact O-CB 3.45Å; L371-F380 HydrophobicContact CD1-CB 3.76Å; L371-F380 HydrophobicContact CD1-CD1 4.03Å; L371-F380 HydrophobicContact CD1-CD2 3.88Å; L371-F380 HydrophobicContact CD1-CE2 4.48Å; L371-F380 HydrophobicContact CD1-CG 3.62Å
372	T	87.7	Confident	89.2	Confident	54 Å²	54	84.2 Å²	84.2	33%	0.331	41%	0.413	S	S	.	.	T	Hydrogen-bonded Turn	trans	-46.2	-34.6	-174.3	-58.2	0	0	0	0	115.2	R368	R368-T372 PolarHBondContact O-N 2.94Å; R368-T372 PolarHBondContact O-OG1 3.44Å
373	H	84.3	Confident	89.4	Confident	185 Å²	185	85.7 Å²	85.7	86%	0.856	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.8	27.5	-177.6	-56.1	-66.4	0	0	0	113.2	L371	L371-H373 PolarHBondContact O-N 2.93Å
374	S	89.6	Confident	89.6	Confident	44 Å²	44	84.8 Å²	84.8	31%	0.308	42%	0.418	S	S	.	.	S	Bend	trans	-123.6	153.3	-179.4	73.2	0	0	0	0	112.3	L371 A376 Y377	L371-S374 WeakPolarHBondContact O-CB 3.5Å; L371-S374 PolarHBondContact O-N 3.05Å; L371-S374 PolarHBondContact O-OG 3.49Å; S374-A376 PolarHBondContact O-N 3.07Å; S374-A376 VanDerWaalsContact O-N 3.07Å; S374-A376 PolarHBondContact OG-N 3.22Å; S374-Y377 WeakPolarHBondContact O-CB 3.2Å; S374-Y377 PolarHBondContact O-N 3.37Å
375	E	85.1	Confident	89.6	Confident	185 Å²	185	85.5 Å²	85.5	86%	0.864	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-15.2	172.8	-59.1	-172.7	140	0	0	113	Y377 P378 H379	E375-Y377 VanDerWaalsContact C-N 3.33Å; E375-P378 WeakPolarHBondContact O-CD 3.49Å; E375-H379 PolarHBondContact O-CD2 3.02Å
376	A	87.2	Confident	89.8	Confident	44 Å²	44	86.9 Å²	86.9	36%	0.364	43%	0.429	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77	-12.1	173.4	0	0	0	0	0	113.8	L371 S374 H379 F380	L371-A376 HydrophobicContact CD2-CB 4.16Å; S374-A376 PolarHBondContact O-N 3.07Å; S374-A376 VanDerWaalsContact O-N 3.07Å; S374-A376 PolarHBondContact OG-N 3.22Å; A376-H379 WeakPolarHBondContact O-CB 3.43Å; A376-H379 PolarHBondContact O-N 3.48Å; A376-F380 PolarHBondContact O-N 2.94Å
377	Y	89.8	Confident	89.8	Confident	66 Å²	66	87.7 Å²	87.7	26%	0.259	44%	0.436	S	S	.	.	H	α-helix	trans	-60.4	-44.5	-177.4	-164.8	-109.4	0	0	0	114.5	R368 L371 S374 E375 H379 F380 M381	R368-Y377 HydrophobicContact CG-CE2 4.3Å; L371-Y377 HydrophobicContact CB-CD2 4.09Å; L371-Y377 WeakPolarHBondContact O-CB 3.45Å; S374-Y377 WeakPolarHBondContact O-CB 3.2Å; S374-Y377 PolarHBondContact O-N 3.37Å; E375-Y377 VanDerWaalsContact C-N 3.33Å; Y377-H379 VanDerWaalsContact C-N 3.28Å; Y377-H379 PolarHBondContact O-N 3.1Å; Y377-F380 HydrophobicContact CD2-CD1 4.4Å; Y377-F380 HydrophobicContact CE2-CD1 4.37Å; Y377-F380 PolarHBondContact O-N 3.32Å; Y377-M381 HydrophobicContact CD1-CG 4.23Å; Y377-M381 HydrophobicContact CE1-CG 3.92Å; Y377-M381 HydrophobicContact CE1-SD 4.39Å; Y377-M381 WeakPolarHBondContact O-CG 3.47Å; Y377-M381 PolarHBondContact O-N 2.89Å
378	P	88.8	Confident	89.7	Confident	85 Å²	85	92.3 Å²	92.3	55%	0.552	46%	0.457	S	S	*	.	H	α-helix	trans	-64.1	-34.2	175.7	-20.5	34.7	0	0	0	112.1	E375 S382	E375-P378 WeakPolarHBondContact O-CD 3.49Å; P378-S382 WeakPolarHBondContact O-CB 3.46Å; P378-S382 PolarHBondContact O-N 3.08Å
379	H	88.8	Confident	89.5	Confident	133 Å²	133	93.7 Å²	93.7	62%	0.616	47%	0.468	S	S	*	.	H	α-helix	trans	-68.6	-40.3	175.1	-62.8	-72.1	0	0	0	111.6	E375 A376 Y377 S382 I383	E375-H379 PolarHBondContact O-CD2 3.02Å; A376-H379 WeakPolarHBondContact O-CB 3.43Å; A376-H379 PolarHBondContact O-N 3.48Å; Y377-H379 VanDerWaalsContact C-N 3.28Å; Y377-H379 PolarHBondContact O-N 3.1Å; H379-S382 WeakPolarHBondContact O-CB 3.4Å; H379-S382 PolarHBondContact O-N 2.94Å; H379-I383 WeakPolarHBondContact O-CG1 3.41Å; H379-I383 PolarHBondContact O-N 3.37Å
380	F	92.4	Very high	89.4	Confident	27 Å²	27	89 Å²	89	12%	0.118	45%	0.449	C	S	.	.	H	α-helix	trans	-62.4	-45.9	172.7	177.5	-120.4	0	0	0	112.2	F364 T367 R368 L371 A376 Y377 S382 I383 L384	F364-F380 HydrophobicContact CD2-CZ 4.33Å; F364-F380 HydrophobicContact CE2-CE1 4.47Å; F364-F380 HydrophobicContact CE2-CZ 4.16Å; T367-F380 HydrophobicContact CG2-CD2 4.21Å; T367-F380 HydrophobicContact CG2-CE1 4.44Å; T367-F380 HydrophobicContact CG2-CE2 3.53Å; T367-F380 HydrophobicContact CG2-CZ 3.66Å; R368-F380 HydrophobicContact CB-CE1 4.39Å; L371-F380 HydrophobicContact CD1-CB 3.76Å; L371-F380 HydrophobicContact CD1-CD1 4.03Å; L371-F380 HydrophobicContact CD1-CD2 3.88Å; L371-F380 HydrophobicContact CD1-CE2 4.48Å; L371-F380 HydrophobicContact CD1-CG 3.62Å; A376-F380 PolarHBondContact O-N 2.94Å; Y377-F380 HydrophobicContact CD2-CD1 4.4Å; Y377-F380 HydrophobicContact CE2-CD1 4.37Å; Y377-F380 PolarHBondContact O-N 3.32Å; F380-S382 VanDerWaalsContact C-N 3.28Å; F380-S382 PolarHBondContact O-N 3.25Å; F380-I383 PolarHBondContact O-N 3.5Å; F380-I383 VanDerWaalsContact O-N 3.16Å; F380-L384 HydrophobicContact CD1-CD1 4.02Å; F380-L384 HydrophobicContact CD2-CG 4.45Å; F380-L384 HydrophobicContact CE1-CD1 3.69Å; F380-L384 HydrophobicContact CE2-CD1 4.2Å; F380-L384 HydrophobicContact CE2-CD2 4.24Å; F380-L384 HydrophobicContact CE2-CG 4.18Å; F380-L384 HydrophobicContact CG-CD1 4.43Å; F380-L384 HydrophobicContact CZ-CD1 3.79Å; F380-L384 HydrophobicContact CZ-CD2 4.26Å; F380-L384 HydrophobicContact CZ-CG 4.23Å; F380-L384 WeakPolarHBondContact O-CG 3.45Å; F380-L384 PolarHBondContact O-N 3.44Å
381	M	91.3	Very high	89.2	Confident	91 Å²	91	84.4 Å²	84.4	45%	0.448	44%	0.439	S	S	.	.	H	α-helix	trans	-60.1	-37.5	173.5	-70.6	-58.3	-57	0	0	112.4	Y377 L384 H385	Y377-M381 HydrophobicContact CD1-CG 4.23Å; Y377-M381 HydrophobicContact CE1-CG 3.92Å; Y377-M381 HydrophobicContact CE1-SD 4.39Å; Y377-M381 WeakPolarHBondContact O-CG 3.47Å; Y377-M381 PolarHBondContact O-N 2.89Å; M381-L384 HydrophobicContact SD-CD1 4.07Å; M381-H385 WeakPolarHBondContact O-CB 3.48Å; M381-H385 PolarHBondContact O-N 2.92Å
382	S	92.6	Very high	88.6	Confident	53 Å²	53	90.7 Å²	90.7	37%	0.371	46%	0.461	S	S	.	.	H	α-helix	trans	-65.5	-43.2	173.2	-171.2	0	0	0	0	112.2	P378 H379 F380 L384 H385 H386	P378-S382 WeakPolarHBondContact O-CB 3.46Å; P378-S382 PolarHBondContact O-N 3.08Å; H379-S382 WeakPolarHBondContact O-CB 3.4Å; H379-S382 PolarHBondContact O-N 2.94Å; F380-S382 VanDerWaalsContact C-N 3.28Å; F380-S382 PolarHBondContact O-N 3.25Å; S382-L384 PolarHBondContact O-N 2.99Å; S382-H385 PolarHBondContact O-N 2.74Å; S382-H386 PolarHBondContact O-N 3.22Å; S382-H386 PolarHBondContact O-ND1 3.38Å; S382-H386 PolarHBondContact OG-CE1 3.49Å
383	I	93.4	Very high	88	Confident	95 Å²	95	95.2 Å²	95.2	49%	0.487	48%	0.476	S	S	.	.	H	α-helix	trans	-59.3	-47.9	175	-70.4	162	0	0	0	110.4	H379 F380 H385 H386 C387	H379-I383 WeakPolarHBondContact O-CG1 3.41Å; H379-I383 PolarHBondContact O-N 3.37Å; F380-I383 PolarHBondContact O-N 3.5Å; F380-I383 VanDerWaalsContact O-N 3.16Å; I383-H385 VanDerWaalsContact C-N 3.34Å; I383-H385 PolarHBondContact O-N 3.25Å; I383-H386 PolarHBondContact O-N 3Å; I383-C387 PolarHBondContact O-N 3.08Å; I383-C387 PolarHBondContact O-SG 3.09Å
384	L	92.4	Very high	87	Confident	45 Å²	45	98.7 Å²	98.7	24%	0.236	48%	0.482	C	S	.	.	H	α-helix	trans	-58.8	-43.1	177.2	-67.5	169.1	0	0	0	112.4	F364 F380 M381 S382 C387 L388	F364-L384 HydrophobicContact CD2-CD2 4.25Å; F364-L384 HydrophobicContact CE2-CD1 3.68Å; F364-L384 HydrophobicContact CE2-CD2 3.83Å; F364-L384 HydrophobicContact CE2-CG 4.43Å; F364-L384 HydrophobicContact CZ-CD1 4.3Å; F380-L384 HydrophobicContact CD1-CD1 4.02Å; F380-L384 HydrophobicContact CD2-CG 4.45Å; F380-L384 HydrophobicContact CE1-CD1 3.69Å; F380-L384 HydrophobicContact CE2-CD1 4.2Å; F380-L384 HydrophobicContact CE2-CD2 4.24Å; F380-L384 HydrophobicContact CE2-CG 4.18Å; F380-L384 HydrophobicContact CG-CD1 4.43Å; F380-L384 HydrophobicContact CZ-CD1 3.79Å; F380-L384 HydrophobicContact CZ-CD2 4.26Å; F380-L384 HydrophobicContact CZ-CG 4.23Å; F380-L384 WeakPolarHBondContact O-CG 3.45Å; F380-L384 PolarHBondContact O-N 3.44Å; M381-L384 HydrophobicContact SD-CD1 4.07Å; S382-L384 PolarHBondContact O-N 2.99Å; L384-C387 WeakPolarHBondContact O-CB 3.42Å; L384-C387 PolarHBondContact O-N 2.71Å; L384-L388 WeakPolarHBondContact O-CG 3.23Å; L384-L388 PolarHBondContact O-N 3.05Å; L384-L388 VanDerWaalsContact O-N 3.07Å
385	H	91.9	Very high	85.9	Confident	99 Å²	99	100 Å²	100	46%	0.458	49%	0.491	S	S	.	.	H	α-helix	trans	-60.7	-44.8	175.9	174.9	-102.6	0	0	0	112.1	M381 S382 I383 L388 Q389	M381-H385 WeakPolarHBondContact O-CB 3.48Å; M381-H385 PolarHBondContact O-N 2.92Å; S382-H385 PolarHBondContact O-N 2.74Å; I383-H385 VanDerWaalsContact C-N 3.34Å; I383-H385 PolarHBondContact O-N 3.25Å; H385-L388 PolarHBondContact O-N 2.7Å; H385-Q389 PolarHBondContact CE1-NE2 2.82Å; H385-Q389 PolarHBondContact NE2-NE2 2.9Å; H385-Q389 PolarHBondContact O-N 3.47Å
386	H	91.6	Very high	85.1	Confident	101 Å²	101	94.7 Å²	94.7	47%	0.468	49%	0.486	S	S	.	.	H	α-helix	trans	-67.6	-36.3	175.7	-66.9	100.3	0	0	0	112.2	S382 I383 L388 Q389 M390	S382-H386 PolarHBondContact O-N 3.22Å; S382-H386 PolarHBondContact O-ND1 3.38Å; S382-H386 PolarHBondContact OG-CE1 3.49Å; I383-H386 PolarHBondContact O-N 3Å; H386-L388 VanDerWaalsContact C-N 3.25Å; H386-L388 PolarHBondContact O-N 2.85Å; H386-Q389 CarbonylContact O-C 3.58Å; H386-Q389 WeakPolarHBondContact O-CA 3.44Å; H386-Q389 WeakPolarHBondContact O-CB 3.44Å; H386-Q389 PolarHBondContact O-N 3.06Å; H386-M390 WeakPolarHBondContact O-CG 3.46Å; H386-M390 PolarHBondContact O-N 2.88Å
387	C	90.5	Very high	84.5	Confident	38 Å²	38	97.6 Å²	97.6	26%	0.257	50%	0.495	S	S	.	.	H	α-helix	trans	-60.5	-31.9	172.7	-71.8	0	0	0	0	113	I383 L384 Q389 W402	I383-C387 PolarHBondContact O-N 3.08Å; I383-C387 PolarHBondContact O-SG 3.09Å; L384-C387 WeakPolarHBondContact O-CB 3.42Å; L384-C387 PolarHBondContact O-N 2.71Å; C387-Q389 VanDerWaalsContact C-N 3.32Å; C387-W402 HydrophobicContact CB-CH2 4.27Å; C387-W402 WeakPolarHBondContact O-CH2 3.41Å
388	L	88.4	Confident	84.1	Confident	152 Å²	152	94.9 Å²	94.9	80%	0.796	49%	0.485	S	S	*	.	H	α-helix	trans	-72.7	-22.9	172.1	-67.8	170.2	0	0	0	113.3	L384 H385 H386	L384-L388 WeakPolarHBondContact O-CG 3.23Å; L384-L388 PolarHBondContact O-N 3.05Å; L384-L388 VanDerWaalsContact O-N 3.07Å; H385-L388 PolarHBondContact O-N 2.7Å; H386-L388 VanDerWaalsContact C-N 3.25Å; H386-L388 PolarHBondContact O-N 2.85Å
389	Q	86.6	Confident	83.8	Confident	124 Å²	124	94.6 Å²	94.6	58%	0.579	48%	0.482	S	S	*	.	H	α-helix	trans	-88.5	-16.1	176.3	-65.3	-178	-21.5	0	0	113.4	H385 H386 C387	H385-Q389 PolarHBondContact CE1-NE2 2.82Å; H385-Q389 PolarHBondContact NE2-NE2 2.9Å; H385-Q389 PolarHBondContact O-N 3.47Å; H386-Q389 CarbonylContact O-C 3.58Å; H386-Q389 WeakPolarHBondContact O-CA 3.44Å; H386-Q389 WeakPolarHBondContact O-CB 3.44Å; H386-Q389 PolarHBondContact O-N 3.06Å; C387-Q389 VanDerWaalsContact C-N 3.32Å
390	M	85.9	Confident	83.5	Confident	48 Å²	48	93.8 Å²	93.8	24%	0.236	48%	0.478	C	S	.	.	S	Bend	trans	-60.5	144.2	-179	-77.7	-80.8	-85.9	0	0	112.1	H386 Y392 Y401 W402 L405	H386-M390 WeakPolarHBondContact O-CG 3.46Å; H386-M390 PolarHBondContact O-N 2.88Å; M390-Y392 PolarHBondContact O-N 2.67Å; M390-Y401 WeakPolarHBondContact CE-O 3.35Å; M390-W402 HydrophobicContact CB-CH2 3.88Å; M390-W402 HydrophobicContact CB-CZ2 3.38Å; M390-W402 HydrophobicContact CE-CD2 4.3Å; M390-W402 HydrophobicContact CG-CH2 4.39Å; M390-W402 HydrophobicContact CG-CZ2 4.28Å; M390-L405 HydrophobicContact CE-CD2 4.47Å
391	P	83.3	Confident	83.1	Confident	58 Å²	58	97.8 Å²	97.8	38%	0.377	49%	0.493	S	S	.	.			trans	-56.3	128.3	177.2	-25.9	35.1	0	0	0	112	T398 Y401 W402	P391-T398 HydrophobicContact CB-CG2 4.2Å; P391-T398 VanDerWaalsContact O-CG2 3.23Å; P391-T398 WeakPolarHBondContact O-CG2 3.23Å; P391-Y401 HydrophobicContact CG-CD2 4.17Å; P391-Y401 HydrophobicContact CG-CE2 4.41Å; P391-W402 PolarHBondContact O-NE1 3.04Å
392	Y	79.4	Confident	82.9	Confident	177 Å²	177	98.1 Å²	98.1	69%	0.694	49%	0.49	S	S	*	.			trans	-122.8	-24.7	179.5	70.3	-84.7	0	0	0	113.7	M390	M390-Y392 PolarHBondContact O-N 2.67Å
393	K	75.2	Confident	82.5	Confident	149 Å²	149	99 Å²	99	65%	0.648	49%	0.49	S	S	*	.	S	Bend	trans	-69.2	142.9	174.5	-61.3	-178.3	-177.2	177.2	0	109.6	S395 T398	K393-S395 PolarHBondContact O-N 2.89Å; K393-T398 WeakPolarHBondContact O-CB 3.5Å; K393-T398 VanDerWaalsContact O-CG2 3.29Å; K393-T398 WeakPolarHBondContact O-CG2 3.49Å; K393-T398 PolarHBondContact O-OG1 3.22Å
394	R	62.1	Low	82.2	Confident	259 Å²	259	98.6 Å²	98.6	98%	0.977	49%	0.488	S	S	*	.			trans	-65.9	88.8	-179.9	-74.6	-174.4	177.3	177.3	-0.5	112.2
395	S	67.8	Low	82	Confident	71 Å²	71	98.7 Å²	98.7	50%	0.497	49%	0.489	S	S	.	.			trans	-100.8	160.1	154.2	82.5	0	0	0	0	108.6	K393 N397 T398	K393-S395 PolarHBondContact O-N 2.89Å; S395-N397 PolarHBondContact O-N 3.49Å; S395-N397 VanDerWaalsContact O-N 3.15Å; S395-T398 WeakPolarHBondContact CB-OG1 3.48Å; S395-T398 PolarHBondContact N-OG1 2.88Å; S395-T398 WeakPolarHBondContact O-CB 3.4Å; S395-T398 PolarHBondContact O-N 3.17Å; S395-T398 VanDerWaalsContact O-N 3.13Å; S395-T398 PolarHBondContact O-OG1 3.34Å; S395-T398 PolarHBondContact OG-N 3.46Å; S395-T398 PolarHBondContact OG-OG1 3.48Å
396	G	67.9	Low	81.7	Confident	74 Å²	74	97 Å²	97	76%	0.763	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55	-34.9	-176.8	0	0	0	0	0	114.1
397	N	74	Confident	81.5	Confident	104 Å²	104	95.2 Å²	95.2	56%	0.556	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95	-6.7	-176.8	-63.9	-2.3	0	0	0	113.6	S395 V399 Q400 Y401	S395-N397 PolarHBondContact O-N 3.49Å; S395-N397 VanDerWaalsContact O-N 3.15Å; N397-V399 VanDerWaalsContact C-N 3.3Å; N397-V399 PolarHBondContact O-N 2.72Å; N397-Q400 WeakPolarHBondContact O-CB 3.45Å; N397-Q400 PolarHBondContact O-N 2.7Å; N397-Y401 HydrophobicContact CB-CE2 4.1Å; N397-Y401 VanDerWaalsContact O-CD2 3.28Å; N397-Y401 WeakPolarHBondContact O-CD2 3.44Å
398	T	82.2	Confident	81.4	Confident	9 Å²	9	96 Å²	96	6%	0.055	47%	0.473	C	S	.	.	H	α-helix	trans	-51.1	-47	-175	-63.7	0	0	0	0	112.5	P391 K393 S395 Q400 Y401	P391-T398 HydrophobicContact CB-CG2 4.2Å; P391-T398 VanDerWaalsContact O-CG2 3.23Å; P391-T398 WeakPolarHBondContact O-CG2 3.23Å; K393-T398 WeakPolarHBondContact O-CB 3.5Å; K393-T398 VanDerWaalsContact O-CG2 3.29Å; K393-T398 WeakPolarHBondContact O-CG2 3.49Å; K393-T398 PolarHBondContact O-OG1 3.22Å; S395-T398 WeakPolarHBondContact CB-OG1 3.48Å; S395-T398 PolarHBondContact N-OG1 2.88Å; S395-T398 WeakPolarHBondContact O-CB 3.4Å; S395-T398 PolarHBondContact O-N 3.17Å; S395-T398 VanDerWaalsContact O-N 3.13Å; S395-T398 PolarHBondContact O-OG1 3.34Å; S395-T398 PolarHBondContact OG-N 3.46Å; S395-T398 PolarHBondContact OG-OG1 3.48Å; T398-Q400 VanDerWaalsContact C-N 3.28Å; T398-Q400 PolarHBondContact O-N 3.28Å; T398-Y401 PolarHBondContact O-N 3.23Å
399	V	81.2	Confident	81.4	Confident	80 Å²	80	93 Å²	93	49%	0.485	46%	0.457	S	S	.	.	H	α-helix	trans	-67.6	-29.4	-177.7	-178	0	0	0	0	112	N397 Y401 W402 L403	N397-V399 VanDerWaalsContact C-N 3.3Å; N397-V399 PolarHBondContact O-N 2.72Å; V399-Y401 VanDerWaalsContact C-N 3.34Å; V399-Y401 PolarHBondContact O-N 3.19Å; V399-W402 PolarHBondContact O-N 3.41Å; V399-L403 HydrophobicContact CG1-CD1 3.94Å; V399-L403 HydrophobicContact CG1-CG 4.19Å; V399-L403 WeakPolarHBondContact O-CG 3.28Å; V399-L403 PolarHBondContact O-N 3.16Å
400	Q	83.6	Confident	81.4	Confident	115 Å²	115	88.1 Å²	88.1	54%	0.537	44%	0.435	S	S	.	.	H	α-helix	trans	-68.9	-32.1	-176.9	-54.1	-61.8	-6.2	0	0	112.3	N397 T398 L403 L404	N397-Q400 WeakPolarHBondContact O-CB 3.45Å; N397-Q400 PolarHBondContact O-N 2.7Å; T398-Q400 VanDerWaalsContact C-N 3.28Å; T398-Q400 PolarHBondContact O-N 3.28Å; Q400-L403 PolarHBondContact O-N 3.49Å; Q400-L404 WeakPolarHBondContact O-CB 3.36Å; Q400-L404 PolarHBondContact O-N 2.88Å
401	Y	84.6	Confident	81.4	Confident	111 Å²	111	86 Å²	86	44%	0.435	42%	0.424	S	S	.	.	H	α-helix	trans	-65.9	-39.9	174.3	-61.4	-71.1	0	0	0	112.3	M390 P391 N397 T398 V399 L404 L405	M390-Y401 WeakPolarHBondContact CE-O 3.35Å; P391-Y401 HydrophobicContact CG-CD2 4.17Å; P391-Y401 HydrophobicContact CG-CE2 4.41Å; N397-Y401 HydrophobicContact CB-CE2 4.1Å; N397-Y401 VanDerWaalsContact O-CD2 3.28Å; N397-Y401 WeakPolarHBondContact O-CD2 3.44Å; T398-Y401 PolarHBondContact O-N 3.23Å; V399-Y401 VanDerWaalsContact C-N 3.34Å; V399-Y401 PolarHBondContact O-N 3.19Å; Y401-L404 PolarHBondContact O-N 2.98Å; Y401-L405 PolarHBondContact O-N 2.87Å; Y401-L405 VanDerWaalsContact O-N 3.12Å
402	W	87.2	Confident	81.6	Confident	98 Å²	98	88.1 Å²	88.1	37%	0.371	43%	0.431	S	S	.	.	H	α-helix	trans	-71.2	-38.4	175.7	-68.7	98.2	0	0	0	112.2	C387 M390 P391 V399 L404 L405 D406	C387-W402 HydrophobicContact CB-CH2 4.27Å; C387-W402 WeakPolarHBondContact O-CH2 3.41Å; M390-W402 HydrophobicContact CB-CH2 3.88Å; M390-W402 HydrophobicContact CB-CZ2 3.38Å; M390-W402 HydrophobicContact CE-CD2 4.3Å; M390-W402 HydrophobicContact CG-CH2 4.39Å; M390-W402 HydrophobicContact CG-CZ2 4.28Å; P391-W402 PolarHBondContact O-NE1 3.04Å; V399-W402 PolarHBondContact O-N 3.41Å; W402-L404 VanDerWaalsContact C-N 3.34Å; W402-L405 HydrophobicContact CE3-CD2 4.23Å; W402-L405 HydrophobicContact CZ3-CD2 4.26Å; W402-L405 PolarHBondContact O-N 2.84Å; W402-D406 WeakPolarHBondContact O-CB 3.41Å; W402-D406 PolarHBondContact O-N 3.04Å
403	L	84.3	Confident	82	Confident	71 Å²	71	83.6 Å²	83.6	37%	0.372	42%	0.422	S	S	.	.	H	α-helix	trans	-63.7	-37.3	172	-71.8	171.5	0	0	0	112.1	V399 Q400 D406 R407	V399-L403 HydrophobicContact CG1-CD1 3.94Å; V399-L403 HydrophobicContact CG1-CG 4.19Å; V399-L403 WeakPolarHBondContact O-CG 3.28Å; V399-L403 PolarHBondContact O-N 3.16Å; Q400-L403 PolarHBondContact O-N 3.49Å; L403-D406 PolarHBondContact O-N 2.94Å; L403-R407 WeakPolarHBondContact O-CG 3.46Å; L403-R407 PolarHBondContact O-N 2.94Å
404	L	85.8	Confident	82.5	Confident	87 Å²	87	77 Å²	77	46%	0.455	39%	0.393	S	S	.	.	H	α-helix	trans	-64.2	-44.2	175	178.8	60.1	0	0	0	111.6	Q400 Y401 W402 R407 I408 L427	Q400-L404 WeakPolarHBondContact O-CB 3.36Å; Q400-L404 PolarHBondContact O-N 2.88Å; Y401-L404 PolarHBondContact O-N 2.98Å; W402-L404 VanDerWaalsContact C-N 3.34Å; L404-R407 PolarHBondContact O-N 3Å; L404-I408 HydrophobicContact CD1-CD1 3.95Å; L404-I408 HydrophobicContact CD1-CG1 4.28Å; L404-I408 HydrophobicContact CG-CD1 3.92Å; L404-I408 VanDerWaalsContact O-CG1 3.27Å; L404-I408 WeakPolarHBondContact O-CG1 3.46Å; L404-I408 PolarHBondContact O-N 3.37Å; L404-L427 HydrophobicContact CD1-CD2 4.31Å
405	L	88.6	Confident	83.7	Confident	48 Å²	48	66.2 Å²	66.2	25%	0.251	35%	0.354	S	S	.	.	H	α-helix	trans	-60.7	-46.9	175.2	177.8	59.9	0	0	0	111.6	M390 Y401 W402 I408 I409	M390-L405 HydrophobicContact CE-CD2 4.47Å; Y401-L405 PolarHBondContact O-N 2.87Å; Y401-L405 VanDerWaalsContact O-N 3.12Å; W402-L405 HydrophobicContact CE3-CD2 4.23Å; W402-L405 HydrophobicContact CZ3-CD2 4.26Å; W402-L405 PolarHBondContact O-N 2.84Å; L405-I408 PolarHBondContact O-N 3.12Å; L405-I409 HydrophobicContact CD1-CD1 3.89Å; L405-I409 HydrophobicContact CD1-CG1 4.27Å; L405-I409 HydrophobicContact CG-CD1 3.94Å; L405-I409 WeakPolarHBondContact O-CG1 3.45Å; L405-I409 PolarHBondContact O-N 2.71Å
406	D	86.2	Confident	84.3	Confident	63 Å²	63	66 Å²	66	34%	0.337	35%	0.347	S	S	.	.	H	α-helix	trans	-55.9	-50.1	174.7	170.9	55.8	0	0	0	111.9	W402 L403 I408 I409 Q410	W402-D406 WeakPolarHBondContact O-CB 3.41Å; W402-D406 PolarHBondContact O-N 3.04Å; L403-D406 PolarHBondContact O-N 2.94Å; D406-I408 PolarHBondContact O-N 2.81Å; D406-I409 PolarHBondContact O-N 2.76Å; D406-Q410 VanDerWaalsContact O-CG 3.29Å; D406-Q410 WeakPolarHBondContact O-CG 3.23Å; D406-Q410 PolarHBondContact O-N 2.99Å; D406-Q410 PolarHBondContact OD1-NE2 3.42Å; D406-Q410 PolarHBondContact OD2-NE2 2.96Å
407	R	86.2	Confident	84.7	Confident	63 Å²	63	69 Å²	69	24%	0.238	35%	0.346	C	S	.	.	H	α-helix	trans	-64.4	-36.5	177.2	-65.1	-45.4	-172	174.3	-0.4	113.1	E307 L403 L404 Q410 Q411 L427	E307-R407 IonicContact OE1-NH1 2.72Å; L403-R407 WeakPolarHBondContact O-CG 3.46Å; L403-R407 PolarHBondContact O-N 2.94Å; L404-R407 PolarHBondContact O-N 3Å; R407-Q410 PolarHBondContact O-N 3.04Å; R407-Q411 WeakPolarHBondContact O-CG 3.4Å; R407-Q411 PolarHBondContact O-N 2.87Å; R407-L427 HydrophobicContact CB-CD1 3.67Å; R407-L427 HydrophobicContact CB-CG 4.22Å; R407-L427 WeakPolarHBondContact O-CD1 3.34Å
408	I	87.9	Confident	84.7	Confident	54 Å²	54	72 Å²	72	28%	0.277	35%	0.354	S	S	.	.	H	α-helix	trans	-64.9	-44	175.2	-70.9	166.1	0	0	0	110.7	L404 L405 D406 Q411 I412 L427 F430	L404-I408 HydrophobicContact CD1-CD1 3.95Å; L404-I408 HydrophobicContact CD1-CG1 4.28Å; L404-I408 HydrophobicContact CG-CD1 3.92Å; L404-I408 VanDerWaalsContact O-CG1 3.27Å; L404-I408 WeakPolarHBondContact O-CG1 3.46Å; L404-I408 PolarHBondContact O-N 3.37Å; L405-I408 PolarHBondContact O-N 3.12Å; D406-I408 PolarHBondContact O-N 2.81Å; I408-Q411 PolarHBondContact O-N 3.34Å; I408-I412 HydrophobicContact CG2-CD1 3.99Å; I408-I412 WeakPolarHBondContact O-CG1 3.46Å; I408-I412 PolarHBondContact O-N 3.13Å; I408-I412 VanDerWaalsContact O-N 3.11Å; I408-L427 HydrophobicContact CG1-CD1 4.09Å; I408-F430 HydrophobicContact CG2-CE1 4.46Å; I408-F430 HydrophobicContact CG2-CZ 4.27Å
409	I	89.6	Confident	84.2	Confident	89 Å²	89	72 Å²	72	46%	0.456	36%	0.355	S	S	.	.	H	α-helix	trans	-63.2	-43.6	176.6	-68.7	167.7	0	0	0	110.7	L405 D406 Q411 I412 V413	L405-I409 HydrophobicContact CD1-CD1 3.89Å; L405-I409 HydrophobicContact CD1-CG1 4.27Å; L405-I409 HydrophobicContact CG-CD1 3.94Å; L405-I409 WeakPolarHBondContact O-CG1 3.45Å; L405-I409 PolarHBondContact O-N 2.71Å; D406-I409 PolarHBondContact O-N 2.76Å; I409-Q411 PolarHBondContact O-N 3.04Å; I409-I412 WeakPolarHBondContact O-CB 3.34Å; I409-I412 PolarHBondContact O-N 3.34Å; I409-I412 VanDerWaalsContact O-N 3.17Å; I409-V413 WeakPolarHBondContact O-CG2 3.27Å; I409-V413 PolarHBondContact O-N 3.11Å; I409-V413 VanDerWaalsContact O-N 3.13Å
410	Q	86.8	Confident	84.1	Confident	23 Å²	23	73.3 Å²	73.3	11%	0.107	36%	0.356	C	S	.	.	H	α-helix	trans	-56.6	-48.3	175.2	-72.7	164.6	18	0	0	111.4	D406 R407 I412 V413 I414	D406-Q410 VanDerWaalsContact O-CG 3.29Å; D406-Q410 WeakPolarHBondContact O-CG 3.23Å; D406-Q410 PolarHBondContact O-N 2.99Å; D406-Q410 PolarHBondContact OD1-NE2 3.42Å; D406-Q410 PolarHBondContact OD2-NE2 2.96Å; R407-Q410 PolarHBondContact O-N 3.04Å; Q410-I412 VanDerWaalsContact C-N 3.31Å; Q410-I412 PolarHBondContact O-N 3.17Å; Q410-V413 PolarHBondContact O-N 3.43Å; Q410-I414 VanDerWaalsContact O-CG1 3.29Å; Q410-I414 WeakPolarHBondContact O-CG1 3.46Å; Q410-I414 PolarHBondContact O-N 3.06Å
411	Q	85.4	Confident	84	Confident	2 Å²	2	68.7 Å²	68.7	1%	0.009	34%	0.336	C	S	.	.	H	α-helix	trans	-59.6	-39.3	177.3	-67.5	-63.7	-43.7	0	0	112.6	R407 I408 I409 V413 Q415 D421 L427 F430 I432	R407-Q411 WeakPolarHBondContact O-CG 3.4Å; R407-Q411 PolarHBondContact O-N 2.87Å; I408-Q411 PolarHBondContact O-N 3.34Å; I409-Q411 PolarHBondContact O-N 3.04Å; Q411-V413 PolarHBondContact O-N 3.34Å; Q411-Q415 WeakPolarHBondContact O-CB 3.47Å; Q411-Q415 WeakPolarHBondContact O-CG 3.24Å; Q411-Q415 PolarHBondContact O-N 3.15Å; Q411-D421 PolarHBondContact NE2-OD2 2.87Å; Q411-L427 HydrophobicContact CG-CB 4.07Å; Q411-L427 HydrophobicContact CG-CD1 3.73Å; Q411-L427 HydrophobicContact CG-CG 4.47Å; Q411-F430 HydrophobicContact CB-CD1 3.95Å; Q411-F430 HydrophobicContact CB-CE1 4.16Å; Q411-F430 HydrophobicContact CG-CD1 4.24Å; Q411-I432 VanDerWaalsContact C-CD1 3.49Å; Q411-I432 HydrophobicContact CB-CD1 3.67Å; Q411-I432 WeakPolarHBondContact O-CD1 3.44Å
412	I	86.9	Confident	83.9	Confident	104 Å²	104	64.5 Å²	64.5	53%	0.533	32%	0.322	S	S	.	.	H	α-helix	trans	-61.7	-31.9	176	-68.5	162	0	0	0	111.9	I408 I409 Q410 I432	I408-I412 HydrophobicContact CG2-CD1 3.99Å; I408-I412 WeakPolarHBondContact O-CG1 3.46Å; I408-I412 PolarHBondContact O-N 3.13Å; I408-I412 VanDerWaalsContact O-N 3.11Å; I409-I412 WeakPolarHBondContact O-CB 3.34Å; I409-I412 PolarHBondContact O-N 3.34Å; I409-I412 VanDerWaalsContact O-N 3.17Å; Q410-I412 VanDerWaalsContact C-N 3.31Å; Q410-I412 PolarHBondContact O-N 3.17Å; I412-I432 HydrophobicContact CG1-CD1 4.36Å; I412-I432 HydrophobicContact CG1-CG1 3.83Å
413	V	87.5	Confident	83.6	Confident	82 Å²	82	59.9 Å²	59.9	50%	0.497	30%	0.304	S	S	.	.	H	α-helix	trans	-89.3	-40.1	-177.8	174.7	0	0	0	0	113.1	D299 I409 Q410 Q411	D299-V413 HydrophobicContact CB-CG1 4.24Å; I409-V413 WeakPolarHBondContact O-CG2 3.27Å; I409-V413 PolarHBondContact O-N 3.11Å; I409-V413 VanDerWaalsContact O-N 3.13Å; Q410-V413 PolarHBondContact O-N 3.43Å; Q411-V413 PolarHBondContact O-N 3.34Å
414	I	87.6	Confident	83.1	Confident	10 Å²	10	57.8 Å²	57.8	5%	0.051	30%	0.296	C	S	.	.	H	α-helix	trans	-97.3	-13.8	-167.9	75.6	-169.4	0	0	0	115	H303 Q410 N416 D421 P422 D423	H303-I414 HydrophobicContact CB-CG2 4.2Å; Q410-I414 VanDerWaalsContact O-CG1 3.29Å; Q410-I414 WeakPolarHBondContact O-CG1 3.46Å; Q410-I414 PolarHBondContact O-N 3.06Å; I414-N416 PolarHBondContact O-N 2.81Å; I414-D421 WeakPolarHBondContact CD1-OD1 3.49Å; I414-P422 WeakPolarHBondContact O-CD 3.36Å; I414-P422 WeakPolarHBondContact O-CG 3.41Å; I414-D423 HydrophobicContact CD1-CB 4.09Å
415	Q	86.3	Confident	82.5	Confident	33 Å²	33	54 Å²	54	15%	0.154	28%	0.276	C	S	.	.			trans	-66.2	130.6	-178.6	-81	-170.2	10.1	0	0	112.4	Q411 F430 I432	Q411-Q415 WeakPolarHBondContact O-CB 3.47Å; Q411-Q415 WeakPolarHBondContact O-CG 3.24Å; Q411-Q415 PolarHBondContact O-N 3.15Å; Q415-F430 PolarHBondContact NE2-O 3.39Å; Q415-I432 HydrophobicContact CG-CD1 4.2Å; Q415-I432 VanDerWaalsContact OE1-N 3.1Å
416	N	81	Confident	81.3	Confident	66 Å²	66	55.4 Å²	55.4	35%	0.353	29%	0.288	S	S	.	.			trans	-73.7	179	-179.7	73.9	20.1	0	0	0	112.7	I414 K418 G419 Q420	I414-N416 PolarHBondContact O-N 2.81Å; N416-K418 PolarHBondContact O-N 3.17Å; N416-K418 WeakPolarHBondContact OD1-CA 3.49Å; N416-K418 WeakPolarHBondContact OD1-CB 3.34Å; N416-K418 PolarHBondContact OD1-N 2.82Å; N416-G419 WeakPolarHBondContact O-CA 3.33Å; N416-G419 PolarHBondContact O-N 2.81Å; N416-G419 PolarHBondContact OD1-N 2.64Å; N416-Q420 PolarHBondContact N-O 2.8Å; N416-Q420 PolarHBondContact OD1-N 3.39Å; N416-Q420 VanDerWaalsContact OD1-N 3.15Å; N416-Q420 PolarHBondContact OD1-O 3.43Å
417	D	74.9	Confident	80.6	Confident	137 Å²	137	54.5 Å²	54.5	73%	0.733	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-15.7	-176.5	-98.9	-46.9	0	0	0	115.8	K433	D417-K433 WeakPolarHBondContact O-CD 3.3Å; D417-K433 VanDerWaalsContact O-CE 3.31Å; D417-K433 WeakPolarHBondContact O-CE 3.38Å; D417-K433 PolarHBondContact O-NZ 2.92Å; D417-K433 IonicContact OD1-NZ 2.74Å; D417-K433 PolarHBondContact OD1-NZ 2.77Å
418	K	74.2	Confident	79.6	Confident	167 Å²	167	59.1 Å²	59.1	73%	0.726	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95	4	175.9	-59.7	175.9	-176.1	173.9	0	112.3	N416 Q420	N416-K418 PolarHBondContact O-N 3.17Å; N416-K418 WeakPolarHBondContact OD1-CA 3.49Å; N416-K418 WeakPolarHBondContact OD1-CB 3.34Å; N416-K418 PolarHBondContact OD1-N 2.82Å; K418-Q420 VanDerWaalsContact C-N 3.3Å; K418-Q420 HydrophobicContact CB-CG 4.18Å
419	G	73.2	Confident	78.6	Confident	8 Å²	8	64.4 Å²	64.4	8%	0.082	34%	0.336	C	S	.	.	S	Bend	trans	63.5	36.8	-173.5	0	0	0	0	0	112.2	N416 N431	N416-G419 WeakPolarHBondContact O-CA 3.33Å; N416-G419 PolarHBondContact O-N 2.81Å; N416-G419 PolarHBondContact OD1-N 2.64Å; G419-N431 WeakPolarHBondContact CA-ND2 3.37Å; G419-N431 PolarHBondContact O-ND2 3.46Å
420	Q	79.2	Confident	78.2	Confident	108 Å²	108	63.5 Å²	63.5	51%	0.505	33%	0.329	S	S	.	.			trans	-109.7	136.2	175.2	-61.9	178.6	-16.1	0	0	109.5	N416 K418 P422	N416-Q420 PolarHBondContact N-O 2.8Å; N416-Q420 PolarHBondContact OD1-N 3.39Å; N416-Q420 VanDerWaalsContact OD1-N 3.15Å; N416-Q420 PolarHBondContact OD1-O 3.43Å; K418-Q420 VanDerWaalsContact C-N 3.3Å; K418-Q420 HydrophobicContact CB-CG 4.18Å; Q420-P422 WeakPolarHBondContact O-CD 3.42Å
421	D	80.8	Confident	77.9	Confident	19 Å²	19	64.1 Å²	64.1	10%	0.102	33%	0.333	C	S	.	.			trans	-74.8	122.1	171.8	-174.9	-0.1	0	0	0	110.6	K238 Q411 I414 D423 S424 T425	K238-D421 PolarHBondContact NZ-O 3.18Å; Q411-D421 PolarHBondContact NE2-OD2 2.87Å; I414-D421 WeakPolarHBondContact CD1-OD1 3.49Å; D421-D423 VanDerWaalsContact C-N 3.35Å; D421-D423 WeakPolarHBondContact OD1-CA 3.48Å; D421-D423 WeakPolarHBondContact OD1-CB 3.4Å; D421-D423 PolarHBondContact OD1-N 2.85Å; D421-S424 PolarHBondContact OD2-N 3.26Å; D421-T425 WeakPolarHBondContact OD2-CB 3.29Å; D421-T425 PolarHBondContact OD2-N 2.88Å
422	P	82.3	Confident	77.8	Confident	23 Å²	23	65.4 Å²	65.4	15%	0.149	34%	0.34	C	S	.	.	S	Bend	trans	-67.5	-32.2	170.3	28.1	-34.8	0	0	0	113	A293 F300 I414 Q420	A293-P422 HydrophobicContact CB-CB 3.64Å; F300-P422 HydrophobicContact CD2-CB 3.92Å; F300-P422 HydrophobicContact CD2-CG 3.5Å; F300-P422 HydrophobicContact CE2-CB 3.77Å; F300-P422 HydrophobicContact CE2-CG 3.76Å; F300-P422 HydrophobicContact CG-CG 4.43Å; F300-P422 HydrophobicContact CZ-CB 4.49Å; I414-P422 WeakPolarHBondContact O-CD 3.36Å; I414-P422 WeakPolarHBondContact O-CG 3.41Å; Q420-P422 WeakPolarHBondContact O-CD 3.42Å
423	D	81.8	Confident	77.5	Confident	0 Å²	0	64.9 Å²	64.9	0%	0	33%	0.334	C	S	.	.	S	Bend	trans	-81.5	-18.4	-173.5	-162	25.9	0	0	0	113.5	R256 F300 H303 I414 D421 T425	R256-D423 IonicContact CZ-OD1 3.73Å; R256-D423 VanDerWaalsContact CZ-OD1 3.31Å; R256-D423 IonicContact CZ-OD2 2.75Å; R256-D423 IonicContact NH1-OD1 2.67Å; R256-D423 PolarHBondContact NH1-OD1 3.34Å; R256-D423 IonicContact NH1-OD2 2.74Å; R256-D423 VanDerWaalsContact NH2-CG 3.29Å; R256-D423 IonicContact NH2-OD1 2.74Å; R256-D423 PolarHBondContact NH2-OD1 2.82Å; R256-D423 IonicContact NH2-OD2 2.65Å; R256-D423 PolarHBondContact NH2-OD2 3.14Å; F300-D423 HydrophobicContact CE2-CB 3.87Å; H303-D423 IonicContact CD2-OD2 3.64Å; H303-D423 IonicContact CE1-OD2 2.66Å; H303-D423 IonicContact NE2-OD2 2.68Å; H303-D423 PolarHBondContact NE2-OD2 3.31Å; I414-D423 HydrophobicContact CD1-CB 4.09Å; D421-D423 VanDerWaalsContact C-N 3.35Å; D421-D423 WeakPolarHBondContact OD1-CA 3.48Å; D421-D423 WeakPolarHBondContact OD1-CB 3.4Å; D421-D423 PolarHBondContact OD1-N 2.85Å; D423-T425 VanDerWaalsContact C-N 3.34Å; D423-T425 PolarHBondContact OD2-OG1 2.97Å
424	S	73.9	Confident	77.3	Confident	27 Å²	27	64.4 Å²	64.4	19%	0.189	33%	0.328	C	S	.	.			trans	62.3	34.2	-174.4	-40.8	0	0	0	0	114.2	K238 Q242 L245 D421	K238-S424 WeakPolarHBondContact CE-OG 3.42Å; Q242-S424 WeakPolarHBondContact CG-OG 3.48Å; Q242-S424 PolarHBondContact NE2-OG 2.99Å; L245-S424 VanDerWaalsContact CD1-O 3.29Å; L245-S424 WeakPolarHBondContact CD1-O 3.18Å; D421-S424 PolarHBondContact OD2-N 3.26Å
425	T	72.3	Confident	77	Confident	9 Å²	9	66.9 Å²	66.9	6%	0.055	34%	0.344	C	S	.	.			trans	-67.6	144.7	179.1	-80.1	0	0	0	0	110.8	D421 D423 L427	D421-T425 WeakPolarHBondContact OD2-CB 3.29Å; D421-T425 PolarHBondContact OD2-N 2.88Å; D423-T425 VanDerWaalsContact C-N 3.34Å; D423-T425 PolarHBondContact OD2-OG1 2.97Å; T425-L427 PolarHBondContact O-N 3.39Å
426	P	63.1	Low	76.7	Confident	77 Å²	77	68.9 Å²	68.9	50%	0.5	36%	0.358	S	S	.	.	S	Bend	trans	-71.2	21.8	-163.8	-22.3	36.2	0	0	0	118.9	E428	P426-E428 PolarHBondContact O-N 2.91Å
427	L	71.3	Confident	76.7	Confident	44 Å²	44	72.4 Å²	72.4	23%	0.23	37%	0.366	C	S	.	.			trans	-82.4	62.2	169.2	-74.6	-179.8	0	0	0	110.3	L404 R407 I408 Q411 T425 F430	L404-L427 HydrophobicContact CD1-CD2 4.31Å; R407-L427 HydrophobicContact CB-CD1 3.67Å; R407-L427 HydrophobicContact CB-CG 4.22Å; R407-L427 WeakPolarHBondContact O-CD1 3.34Å; I408-L427 HydrophobicContact CG1-CD1 4.09Å; Q411-L427 HydrophobicContact CG-CB 4.07Å; Q411-L427 HydrophobicContact CG-CD1 3.73Å; Q411-L427 HydrophobicContact CG-CG 4.47Å; T425-L427 PolarHBondContact O-N 3.39Å; L427-F430 HydrophobicContact CB-CB 4.2Å; L427-F430 WeakPolarHBondContact O-CB 3.19Å; L427-F430 PolarHBondContact O-N 3.32Å
428	E	65.7	Low	76.6	Confident	159 Å²	159	72.3 Å²	72.3	74%	0.743	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.2	138.1	-177.8	-65.8	177.5	-161.4	0	0	111.7	P426 F430	P426-E428 PolarHBondContact O-N 2.91Å; E428-F430 PolarHBondContact O-N 2.94Å; E428-F430 VanDerWaalsContact O-N 3.15Å
429	N	67.5	Low	76.7	Confident	165 Å²	165	69.3 Å²	69.3	88%	0.882	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.8	1.5	-177.8	-49.9	-65.9	0	0	0	116.7	N431	N429-N431 PolarHBondContact O-N 3.15Å
430	F	79.6	Confident	76.6	Confident	71 Å²	71	72.2 Å²	72.2	31%	0.311	37%	0.371	S	S	.	.			trans	-78.6	105	173.7	-169.1	-106.9	0	0	0	110.9	I408 Q411 Q415 L427 E428 I432	I408-F430 HydrophobicContact CG2-CE1 4.46Å; I408-F430 HydrophobicContact CG2-CZ 4.27Å; Q411-F430 HydrophobicContact CB-CD1 3.95Å; Q411-F430 HydrophobicContact CB-CE1 4.16Å; Q411-F430 HydrophobicContact CG-CD1 4.24Å; Q415-F430 PolarHBondContact NE2-O 3.39Å; L427-F430 HydrophobicContact CB-CB 4.2Å; L427-F430 WeakPolarHBondContact O-CB 3.19Å; L427-F430 PolarHBondContact O-N 3.32Å; E428-F430 PolarHBondContact O-N 2.94Å; E428-F430 VanDerWaalsContact O-N 3.15Å; F430-I432 HydrophobicContact CD1-CD1 3.68Å; F430-I432 HydrophobicContact CD1-CG1 4.42Å; F430-I432 HydrophobicContact CE1-CD1 3.5Å; F430-I432 VanDerWaalsContact CE1-CD1 3.5Å; F430-I432 HydrophobicContact CE1-CG1 3.85Å
431	N	81.3	Confident	75.9	Confident	36 Å²	36	71.1 Å²	71.1	19%	0.193	37%	0.368	C	S	.	.			trans	-116.3	109.4	-179.5	-179.5	-69.4	0	0	0	110.8	G419 N429 K433 N434 V435	G419-N431 WeakPolarHBondContact CA-ND2 3.37Å; G419-N431 PolarHBondContact O-ND2 3.46Å; N429-N431 PolarHBondContact O-N 3.15Å; N431-K433 VanDerWaalsContact C-N 3.34Å; N431-K433 PolarHBondContact O-N 3.24Å; N431-K433 PolarHBondContact OD1-N 2.87Å; N431-N434 HydrophobicContact CB-CB 4.29Å; N431-N434 PolarHBondContact O-N 3.06Å; N431-N434 VanDerWaalsContact OD1-CG 3.32Å; N431-N434 PolarHBondContact OD1-N 3.08Å; N431-N434 PolarHBondContact OD1-ND2 2.96Å; N431-V435 PolarHBondContact O-N 3.1Å
432	I	83.9	Confident	75.2	Confident	28 Å²	28	76.8 Å²	76.8	14%	0.144	39%	0.394	C	S	.	.	H	α-helix	trans	-64	-38.1	-173.9	-75.4	88.1	0	0	0	111.8	Q411 I412 Q415 F430 N434 V435 V436	Q411-I432 VanDerWaalsContact C-CD1 3.49Å; Q411-I432 HydrophobicContact CB-CD1 3.67Å; Q411-I432 WeakPolarHBondContact O-CD1 3.44Å; I412-I432 HydrophobicContact CG1-CD1 4.36Å; I412-I432 HydrophobicContact CG1-CG1 3.83Å; Q415-I432 HydrophobicContact CG-CD1 4.2Å; Q415-I432 VanDerWaalsContact OE1-N 3.1Å; F430-I432 HydrophobicContact CD1-CD1 3.68Å; F430-I432 HydrophobicContact CD1-CG1 4.42Å; F430-I432 HydrophobicContact CE1-CD1 3.5Å; F430-I432 VanDerWaalsContact CE1-CD1 3.5Å; F430-I432 HydrophobicContact CE1-CG1 3.85Å; I432-N434 VanDerWaalsContact C-N 3.28Å; I432-N434 PolarHBondContact O-N 2.92Å; I432-V435 PolarHBondContact O-N 3.22Å; I432-V435 VanDerWaalsContact O-N 3.12Å; I432-V436 HydrophobicContact CG2-CG2 3.81Å; I432-V436 WeakPolarHBondContact O-CG2 2.74Å; I432-V436 PolarHBondContact O-N 3.3Å
433	K	81	Confident	74.5	Confident	94 Å²	94	80 Å²	80	41%	0.409	41%	0.41	S	S	.	.	H	α-helix	trans	-63.6	-33.6	-179.3	-67.7	-161.2	172.1	-163.3	0	112.6	D417 N431 R437	D417-K433 WeakPolarHBondContact O-CD 3.3Å; D417-K433 VanDerWaalsContact O-CE 3.31Å; D417-K433 WeakPolarHBondContact O-CE 3.38Å; D417-K433 PolarHBondContact O-NZ 2.92Å; D417-K433 IonicContact OD1-NZ 2.74Å; D417-K433 PolarHBondContact OD1-NZ 2.77Å; N431-K433 VanDerWaalsContact C-N 3.34Å; N431-K433 PolarHBondContact O-N 3.24Å; N431-K433 PolarHBondContact OD1-N 2.87Å; K433-R437 WeakPolarHBondContact O-CB 3.2Å; K433-R437 PolarHBondContact O-N 3.25Å
434	N	82.1	Confident	73.9	Confident	71 Å²	71	84.5 Å²	84.5	38%	0.38	43%	0.431	S	S	.	.	H	α-helix	trans	-68.9	-43.7	171.8	-72	-25.2	0	0	0	111.9	N431 I432 R437 M438	N431-N434 HydrophobicContact CB-CB 4.29Å; N431-N434 PolarHBondContact O-N 3.06Å; N431-N434 VanDerWaalsContact OD1-CG 3.32Å; N431-N434 PolarHBondContact OD1-N 3.08Å; N431-N434 PolarHBondContact OD1-ND2 2.96Å; I432-N434 VanDerWaalsContact C-N 3.28Å; I432-N434 PolarHBondContact O-N 2.92Å; N434-R437 PolarHBondContact O-N 3.28Å; N434-R437 PolarHBondContact OD1-NH1 3.19Å; N434-R437 PolarHBondContact OD1-NH2 3.15Å; N434-M438 PolarHBondContact O-N 3.44Å; N434-M438 VanDerWaalsContact O-N 3.14Å
435	V	81.6	Confident	73.5	Confident	62 Å²	62	86.6 Å²	86.6	38%	0.376	44%	0.443	S	S	.	.	H	α-helix	trans	-64	-47.3	178.4	175.8	0	0	0	0	111.5	N431 I432 R437 M438 L439	N431-V435 PolarHBondContact O-N 3.1Å; I432-V435 PolarHBondContact O-N 3.22Å; I432-V435 VanDerWaalsContact O-N 3.12Å; V435-R437 VanDerWaalsContact C-N 3.33Å; V435-R437 PolarHBondContact O-N 2.97Å; V435-M438 WeakPolarHBondContact O-CB 3.45Å; V435-M438 PolarHBondContact O-N 3.47Å; V435-M438 VanDerWaalsContact O-N 3.12Å; V435-L439 HydrophobicContact CG1-CD1 4.28Å; V435-L439 PolarHBondContact O-N 3.25Å; V435-L439 VanDerWaalsContact O-N 3.1Å
436	V	80.7	Confident	73.5	Confident	76 Å²	76	91.7 Å²	91.7	46%	0.461	46%	0.464	S	S	.	.	H	α-helix	trans	-61	-41.2	177.4	172.2	0	0	0	0	111.1	I432 M438 L439 V440	I432-V436 HydrophobicContact CG2-CG2 3.81Å; I432-V436 WeakPolarHBondContact O-CG2 2.74Å; I432-V436 PolarHBondContact O-N 3.3Å; V436-M438 VanDerWaalsContact C-N 3.3Å; V436-M438 PolarHBondContact O-N 2.86Å; V436-L439 PolarHBondContact O-N 3.4Å; V436-V440 HydrophobicContact CG1-CG2 4.35Å; V436-V440 WeakPolarHBondContact O-CG2 3.36Å; V436-V440 PolarHBondContact O-N 2.85Å
437	R	79.8	Confident	74	Confident	139 Å²	139	93.5 Å²	93.5	53%	0.525	47%	0.466	S	S	.	.	H	α-helix	trans	-61.7	-36	175.1	-173.4	176	64	-119.5	-9.5	112.5	K433 N434 V435 N441	K433-R437 WeakPolarHBondContact O-CB 3.2Å; K433-R437 PolarHBondContact O-N 3.25Å; N434-R437 PolarHBondContact O-N 3.28Å; N434-R437 PolarHBondContact OD1-NH1 3.19Å; N434-R437 PolarHBondContact OD1-NH2 3.15Å; V435-R437 VanDerWaalsContact C-N 3.33Å; V435-R437 PolarHBondContact O-N 2.97Å; R437-N441 WeakPolarHBondContact O-CB 3.44Å; R437-N441 PolarHBondContact O-N 3.3Å; R437-N441 VanDerWaalsContact O-N 3.11Å; R437-N441 PolarHBondContact O-OD1 2.87Å; R437-N441 VanDerWaalsContact O-OD1 3.1Å
438	M	73.7	Confident	73.7	Confident	136 Å²	136	100 Å²	100	67%	0.67	49%	0.488	S	S	*	.	H	α-helix	trans	-65	-43.9	173.6	-70.3	175.4	63.1	0	0	111.8	N434 V435 V436 N441 E442	N434-M438 PolarHBondContact O-N 3.44Å; N434-M438 VanDerWaalsContact O-N 3.14Å; V435-M438 WeakPolarHBondContact O-CB 3.45Å; V435-M438 PolarHBondContact O-N 3.47Å; V435-M438 VanDerWaalsContact O-N 3.12Å; V436-M438 VanDerWaalsContact C-N 3.3Å; V436-M438 PolarHBondContact O-N 2.86Å; M438-N441 PolarHBondContact O-N 3.05Å; M438-E442 PolarHBondContact O-N 3.36Å
439	L	74.9	Confident	74	Confident	103 Å²	103	99.2 Å²	99.2	54%	0.539	48%	0.481	S	S	.	.	H	α-helix	trans	-65.5	-39.7	179.2	-66.1	170.1	0	0	0	112.8	V435 V436 E442 N443	V435-L439 HydrophobicContact CG1-CD1 4.28Å; V435-L439 PolarHBondContact O-N 3.25Å; V435-L439 VanDerWaalsContact O-N 3.1Å; V436-L439 PolarHBondContact O-N 3.4Å; L439-E442 PolarHBondContact O-N 3.01Å; L439-N443 PolarHBondContact O-N 2.68Å
440	V	71.1	Confident	74.7	Confident	70 Å²	70	96.6 Å²	96.6	42%	0.424	46%	0.464	S	S	.	.	H	α-helix	trans	-62.9	-49.7	174.3	172.5	0	0	0	0	110.4	V436 E442 N443 E444	V436-V440 HydrophobicContact CG1-CG2 4.35Å; V436-V440 WeakPolarHBondContact O-CG2 3.36Å; V436-V440 PolarHBondContact O-N 2.85Å; V440-E442 VanDerWaalsContact C-N 3.28Å; V440-E442 PolarHBondContact O-N 2.93Å; V440-N443 PolarHBondContact O-N 2.99Å; V440-N443 VanDerWaalsContact O-N 3.13Å; V440-E444 HydrophobicContact CG1-CG 4.47Å; V440-E444 PolarHBondContact O-N 3.43Å
441	N	64.6	Low	74.5	Confident	85 Å²	85	98.1 Å²	98.1	46%	0.455	47%	0.472	S	S	.	.	H	α-helix	trans	-58.6	-38.5	177.6	-70.7	12.5	0	0	0	112.3	R437 M438 V445	R437-N441 WeakPolarHBondContact O-CB 3.44Å; R437-N441 PolarHBondContact O-N 3.3Å; R437-N441 VanDerWaalsContact O-N 3.11Å; R437-N441 PolarHBondContact O-OD1 2.87Å; R437-N441 VanDerWaalsContact O-OD1 3.1Å; M438-N441 PolarHBondContact O-N 3.05Å; N441-V445 VanDerWaalsContact O-CB 3.32Å; N441-V445 WeakPolarHBondContact O-CB 3.38Å; N441-V445 WeakPolarHBondContact O-CG2 3.36Å; N441-V445 PolarHBondContact O-N 2.94Å
442	E	66.6	Low	74.1	Confident	137 Å²	137	98.6 Å²	98.6	64%	0.64	48%	0.481	S	S	*	.	H	α-helix	trans	-66.6	-40.7	176.9	-174	170.5	-169.4	0	0	112	M438 L439 V440 V445 K446	M438-E442 PolarHBondContact O-N 3.36Å; L439-E442 PolarHBondContact O-N 3.01Å; V440-E442 VanDerWaalsContact C-N 3.28Å; V440-E442 PolarHBondContact O-N 2.93Å; E442-V445 PolarHBondContact O-N 2.83Å; E442-K446 WeakPolarHBondContact O-CB 3.31Å; E442-K446 PolarHBondContact O-N 3.41Å
443	N	66.9	Low	74	Confident	90 Å²	90	102.1 Å²	102.1	48%	0.481	50%	0.497	S	S	.	.	H	α-helix	trans	-68.7	-41.1	177.3	-161.7	33	0	0	0	112.1	L439 V440 K446 Q447	L439-N443 PolarHBondContact O-N 2.68Å; V440-N443 PolarHBondContact O-N 2.99Å; V440-N443 VanDerWaalsContact O-N 3.13Å; N443-K446 WeakPolarHBondContact O-CB 3.3Å; N443-K446 PolarHBondContact O-N 3.01Å; N443-Q447 WeakPolarHBondContact O-CG 3.45Å; N443-Q447 PolarHBondContact O-N 3.15Å
444	E	71.1	Confident	74.3	Confident	95 Å²	95	102.9 Å²	102.9	44%	0.444	50%	0.5	S	S	.	.	H	α-helix	trans	-59.1	-50.3	170.8	-73.1	-178	-171.5	0	0	111	V440 K446 Q447 W448	V440-E444 HydrophobicContact CG1-CG 4.47Å; V440-E444 PolarHBondContact O-N 3.43Å; E444-K446 PolarHBondContact O-N 2.95Å; E444-Q447 PolarHBondContact O-N 2.92Å; E444-Q447 VanDerWaalsContact O-N 3.08Å; E444-W448 PolarHBondContact O-N 3.31Å
445	V	65	Low	74	Confident	72 Å²	72	104.7 Å²	104.7	44%	0.436	51%	0.508	S	S	.	.	H	α-helix	trans	-58.9	-32.6	177.2	164.8	0	0	0	0	111.8	N441 E442 K449	N441-V445 VanDerWaalsContact O-CB 3.32Å; N441-V445 WeakPolarHBondContact O-CB 3.38Å; N441-V445 WeakPolarHBondContact O-CG2 3.36Å; N441-V445 PolarHBondContact O-N 2.94Å; E442-V445 PolarHBondContact O-N 2.83Å; V445-K449 HydrophobicContact CG1-CD 4.21Å; V445-K449 WeakPolarHBondContact O-CB 3.11Å; V445-K449 WeakPolarHBondContact O-CD 3.44Å; V445-K449 VanDerWaalsContact O-CG 3.23Å; V445-K449 WeakPolarHBondContact O-CG 3.07Å; V445-K449 PolarHBondContact O-N 3.01Å; V445-K449 VanDerWaalsContact O-N 3.1Å
446	K	73	Confident	74	Confident	115 Å²	115	110.4 Å²	110.4	50%	0.5	52%	0.522	S	S	.	.	H	α-helix	trans	-68.1	-47.8	172.9	-171.2	-174.3	170.7	-162.4	0	111.7	E442 N443 E444 W448 K449 E450	E442-K446 WeakPolarHBondContact O-CB 3.31Å; E442-K446 PolarHBondContact O-N 3.41Å; N443-K446 WeakPolarHBondContact O-CB 3.3Å; N443-K446 PolarHBondContact O-N 3.01Å; E444-K446 PolarHBondContact O-N 2.95Å; K446-W448 PolarHBondContact O-N 2.86Å; K446-K449 WeakPolarHBondContact O-CB 3.23Å; K446-K449 PolarHBondContact O-N 3.14Å; K446-K449 VanDerWaalsContact O-N 3.15Å; K446-E450 WeakPolarHBondContact CE-OE1 3.44Å; K446-E450 IonicContact NZ-OE1 2.64Å; K446-E450 PolarHBondContact O-N 3.46Å
447	Q	72.1	Confident	74.3	Confident	115 Å²	115	112.3 Å²	112.3	54%	0.537	52%	0.524	S	S	.	.	H	α-helix	trans	-59.9	-44	176.2	-69.3	178.2	9.4	0	0	111.9	N443 E444 K449 E450 Q451	N443-Q447 WeakPolarHBondContact O-CG 3.45Å; N443-Q447 PolarHBondContact O-N 3.15Å; E444-Q447 PolarHBondContact O-N 2.92Å; E444-Q447 VanDerWaalsContact O-N 3.08Å; Q447-K449 VanDerWaalsContact C-N 3.31Å; Q447-K449 PolarHBondContact O-N 3.18Å; Q447-E450 PolarHBondContact O-N 2.85Å; Q447-Q451 VanDerWaalsContact O-CB 3.3Å; Q447-Q451 WeakPolarHBondContact O-CB 3.46Å; Q447-Q451 PolarHBondContact O-N 2.89Å
448	W	66.5	Low	74.6	Confident	182 Å²	182	109.7 Å²	109.7	69%	0.689	52%	0.518	S	S	*	.	H	α-helix	trans	-61.5	-36.5	175	-71.4	116.5	0	0	0	112.7	E444 K446 A452	E444-W448 PolarHBondContact O-N 3.31Å; K446-W448 PolarHBondContact O-N 2.86Å; W448-A452 VanDerWaalsContact O-CB 3.23Å; W448-A452 WeakPolarHBondContact O-CB 3.42Å; W448-A452 PolarHBondContact O-N 3.33Å
449	K	71.6	Confident	75.2	Confident	141 Å²	141	108.6 Å²	108.6	61%	0.613	51%	0.511	S	S	*	.	H	α-helix	trans	-67.4	-47.4	174	-77.1	167.5	-178.6	173.1	0	112.3	V445 K446 Q447 A452 E453	V445-K449 HydrophobicContact CG1-CD 4.21Å; V445-K449 WeakPolarHBondContact O-CB 3.11Å; V445-K449 WeakPolarHBondContact O-CD 3.44Å; V445-K449 VanDerWaalsContact O-CG 3.23Å; V445-K449 WeakPolarHBondContact O-CG 3.07Å; V445-K449 PolarHBondContact O-N 3.01Å; V445-K449 VanDerWaalsContact O-N 3.1Å; K446-K449 WeakPolarHBondContact O-CB 3.23Å; K446-K449 PolarHBondContact O-N 3.14Å; K446-K449 VanDerWaalsContact O-N 3.15Å; Q447-K449 VanDerWaalsContact C-N 3.31Å; Q447-K449 PolarHBondContact O-N 3.18Å; K449-A452 PolarHBondContact O-N 3.43Å; K449-E453 PolarHBondContact O-N 2.94Å
450	E	81.5	Confident	75.6	Confident	110 Å²	110	108.1 Å²	108.1	51%	0.514	51%	0.509	S	S	.	.	H	α-helix	trans	-64.2	-41.7	179.8	-71.9	177.5	177.7	0	0	111.3	K446 Q447 E453 K454	K446-E450 WeakPolarHBondContact CE-OE1 3.44Å; K446-E450 IonicContact NZ-OE1 2.64Å; K446-E450 PolarHBondContact O-N 3.46Å; Q447-E450 PolarHBondContact O-N 2.85Å; E450-E453 PolarHBondContact O-N 3.37Å; E450-K454 WeakPolarHBondContact O-CB 3.23Å; E450-K454 PolarHBondContact O-N 2.92Å
451	Q	75.6	Confident	76.5	Confident	104 Å²	104	109.7 Å²	109.7	49%	0.486	51%	0.512	S	S	.	.	H	α-helix	trans	-63.2	-42.1	173.5	-172.1	70	-7.4	0	0	111.8	Q447 K454 M455	Q447-Q451 VanDerWaalsContact O-CB 3.3Å; Q447-Q451 WeakPolarHBondContact O-CB 3.46Å; Q447-Q451 PolarHBondContact O-N 2.89Å; Q451-K454 PolarHBondContact O-N 3.3Å; Q451-M455 VanDerWaalsContact O-CG 3.31Å; Q451-M455 WeakPolarHBondContact O-CG 3.47Å; Q451-M455 PolarHBondContact O-N 3.35Å
452	A	73.1	Confident	77.5	Confident	45 Å²	45	111 Å²	111	37%	0.372	52%	0.518	S	S	.	.	H	α-helix	trans	-66.8	-34.9	175.6	0	0	0	0	0	112.9	W448 K449 R456	W448-A452 VanDerWaalsContact O-CB 3.23Å; W448-A452 WeakPolarHBondContact O-CB 3.42Å; W448-A452 PolarHBondContact O-N 3.33Å; K449-A452 PolarHBondContact O-N 3.43Å; A452-R456 VanDerWaalsContact O-CG 3.3Å; A452-R456 WeakPolarHBondContact O-CG 3.41Å; A452-R456 PolarHBondContact O-N 3.34Å
453	E	82.4	Confident	78.3	Confident	103 Å²	103	109.3 Å²	109.3	48%	0.481	51%	0.51	S	S	.	.	H	α-helix	trans	-69.9	-38.9	174.7	-162.5	-173.6	130.9	0	0	111.8	K449 E450 R456 K457	K449-E453 PolarHBondContact O-N 2.94Å; E450-E453 PolarHBondContact O-N 3.37Å; E453-R456 PolarHBondContact O-N 2.87Å; E453-K457 WeakPolarHBondContact O-CG 3.46Å; E453-K457 PolarHBondContact O-N 3.39Å; E453-K457 WeakPolarHBondContact OE1-CE 3.28Å; E453-K457 IonicContact OE1-NZ 2.72Å; E453-K457 PolarHBondContact OE1-NZ 3.37Å
454	K	87	Confident	79.2	Confident	109 Å²	109	111.4 Å²	111.4	47%	0.474	52%	0.517	S	S	.	.	H	α-helix	trans	-59.4	-51.3	171.6	179.5	177.7	170.4	-179.6	0	111.4	E450 Q451 R456 K457 E458	E450-K454 WeakPolarHBondContact O-CB 3.23Å; E450-K454 PolarHBondContact O-N 2.92Å; Q451-K454 PolarHBondContact O-N 3.3Å; K454-R456 PolarHBondContact O-N 3.17Å; K454-K457 PolarHBondContact O-N 3.38Å; K454-E458 WeakPolarHBondContact CE-OE1 3.48Å; K454-E458 IonicContact NZ-OE1 3.99Å; K454-E458 PolarHBondContact O-N 2.83Å
455	M	75.8	Confident	80	Confident	110 Å²	110	112.3 Å²	112.3	54%	0.542	52%	0.52	S	S	.	.	H	α-helix	trans	-57.6	-36.3	176.4	-70.5	-63	-60.4	0	0	112.5	Q451 H459	Q451-M455 VanDerWaalsContact O-CG 3.31Å; Q451-M455 WeakPolarHBondContact O-CG 3.47Å; Q451-M455 PolarHBondContact O-N 3.35Å; M455-H459 VanDerWaalsContact O-CB 3.28Å; M455-H459 WeakPolarHBondContact O-CB 3.44Å; M455-H459 PolarHBondContact O-N 2.8Å
456	R	81	Confident	80.9	Confident	182 Å²	182	114.1 Å²	114.1	69%	0.687	53%	0.526	S	S	*	.	H	α-helix	trans	-66.9	-39.4	174	-76.8	170.6	175.7	176.9	-1	113	A452 E453 K454 N460	A452-R456 VanDerWaalsContact O-CG 3.3Å; A452-R456 WeakPolarHBondContact O-CG 3.41Å; A452-R456 PolarHBondContact O-N 3.34Å; E453-R456 PolarHBondContact O-N 2.87Å; K454-R456 PolarHBondContact O-N 3.17Å; R456-N460 WeakPolarHBondContact O-CB 3.44Å; R456-N460 VanDerWaalsContact O-CG 3.22Å; R456-N460 PolarHBondContact O-N 3.24Å
457	K	87.8	Confident	81.5	Confident	116 Å²	116	112.9 Å²	112.9	50%	0.504	52%	0.522	S	S	.	.	H	α-helix	trans	-65.9	-46.1	175.9	-71.7	169.7	-174.7	166.8	0	111	E453 K454 H459 N460 E461	E453-K457 WeakPolarHBondContact O-CG 3.46Å; E453-K457 PolarHBondContact O-N 3.39Å; E453-K457 WeakPolarHBondContact OE1-CE 3.28Å; E453-K457 IonicContact OE1-NZ 2.72Å; E453-K457 PolarHBondContact OE1-NZ 3.37Å; K454-K457 PolarHBondContact O-N 3.38Å; K457-H459 PolarHBondContact O-N 3.43Å; K457-N460 PolarHBondContact O-N 2.87Å; K457-E461 PolarHBondContact O-N 3.33Å
458	E	86.4	Confident	82.2	Confident	84 Å²	84	114.7 Å²	114.7	39%	0.393	53%	0.529	S	S	.	.	H	α-helix	trans	-62.4	-40.9	176.4	-69.3	174.8	-176	0	0	112.1	K454 E461 L462	K454-E458 WeakPolarHBondContact CE-OE1 3.48Å; K454-E458 IonicContact NZ-OE1 3.99Å; K454-E458 PolarHBondContact O-N 2.83Å; E458-E461 PolarHBondContact O-N 2.82Å; E458-L462 WeakPolarHBondContact O-CG 3.3Å; E458-L462 PolarHBondContact O-N 3.29Å
459	H	85.3	Confident	83	Confident	112 Å²	112	111.8 Å²	111.8	52%	0.519	52%	0.521	S	S	.	.	H	α-helix	trans	-62.8	-45.9	173.5	-180	55.6	0	0	0	112.4	M455 K457 E461 L462 Q463	M455-H459 VanDerWaalsContact O-CB 3.28Å; M455-H459 WeakPolarHBondContact O-CB 3.44Å; M455-H459 PolarHBondContact O-N 2.8Å; K457-H459 PolarHBondContact O-N 3.43Å; H459-E461 VanDerWaalsContact C-N 3.34Å; H459-E461 PolarHBondContact O-N 3.05Å; H459-L462 PolarHBondContact O-N 3.02Å; H459-Q463 WeakPolarHBondContact O-CB 3.3Å; H459-Q463 PolarHBondContact O-N 3.42Å
460	N	83.8	Confident	83.5	Confident	94 Å²	94	110.7 Å²	110.7	50%	0.503	52%	0.518	S	S	.	.	H	α-helix	trans	-62.6	-39	177.1	-73.4	-9	0	0	0	112.3	R456 K457 Q463 Q464	R456-N460 WeakPolarHBondContact O-CB 3.44Å; R456-N460 VanDerWaalsContact O-CG 3.22Å; R456-N460 PolarHBondContact O-N 3.24Å; K457-N460 PolarHBondContact O-N 2.87Å; N460-Q463 PolarHBondContact O-N 3.48Å; N460-Q464 WeakPolarHBondContact O-CG 3.48Å; N460-Q464 PolarHBondContact O-N 3.43Å
461	E	88.6	Confident	83.6	Confident	102 Å²	102	112.8 Å²	112.8	48%	0.477	52%	0.521	S	S	.	.	H	α-helix	trans	-63.6	-41.5	173.1	-84.5	-165.9	-142.3	0	0	112.6	K457 E458 H459 Q464 K465	K457-E461 PolarHBondContact O-N 3.33Å; E458-E461 PolarHBondContact O-N 2.82Å; H459-E461 VanDerWaalsContact C-N 3.34Å; H459-E461 PolarHBondContact O-N 3.05Å; E461-Q464 PolarHBondContact O-N 3.23Å; E461-K465 WeakPolarHBondContact O-CB 3.42Å; E461-K465 VanDerWaalsContact O-CD 3.3Å; E461-K465 WeakPolarHBondContact O-CD 3.21Å; E461-K465 WeakPolarHBondContact O-CG 3.46Å; E461-K465 PolarHBondContact O-N 2.98Å; E461-K465 IonicContact OE2-NZ 3.31Å; E461-K465 PolarHBondContact OE2-NZ 3.4Å
462	L	86.1	Confident	83.9	Confident	112 Å²	112	110.9 Å²	110.9	59%	0.586	51%	0.512	S	S	*	.	H	α-helix	trans	-66	-39.6	175.8	-74.2	168	0	0	0	111.4	E458 H459 K465 L466	E458-L462 WeakPolarHBondContact O-CG 3.3Å; E458-L462 PolarHBondContact O-N 3.29Å; H459-L462 PolarHBondContact O-N 3.02Å; L462-K465 PolarHBondContact O-N 2.92Å; L462-L466 WeakPolarHBondContact O-CB 3.36Å; L462-L466 PolarHBondContact O-N 3.07Å
463	Q	83	Confident	84.1	Confident	103 Å²	103	112.4 Å²	112.4	48%	0.481	52%	0.519	S	S	.	.	H	α-helix	trans	-59.2	-46.9	174.8	-162	74	16.4	0	0	111.3	H459 N460 K465 L466 E467	H459-Q463 WeakPolarHBondContact O-CB 3.3Å; H459-Q463 PolarHBondContact O-N 3.42Å; N460-Q463 PolarHBondContact O-N 3.48Å; Q463-K465 PolarHBondContact O-N 3.1Å; Q463-L466 PolarHBondContact O-N 2.86Å; Q463-E467 WeakPolarHBondContact O-CB 3.38Å; Q463-E467 PolarHBondContact O-N 3.32Å
464	Q	87.8	Confident	84.1	Confident	133 Å²	133	112.1 Å²	112.1	62%	0.621	52%	0.521	S	S	*	.	H	α-helix	trans	-66	-35.9	176.2	-71	178.2	9.7	0	0	112.9	N460 E461 K468	N460-Q464 WeakPolarHBondContact O-CG 3.48Å; N460-Q464 PolarHBondContact O-N 3.43Å; E461-Q464 PolarHBondContact O-N 3.23Å; Q464-K468 VanDerWaalsContact O-CB 3.28Å; Q464-K468 WeakPolarHBondContact O-CB 3.47Å; Q464-K468 PolarHBondContact O-N 2.85Å
465	K	87.4	Confident	84	Confident	115 Å²	115	109.2 Å²	109.2	50%	0.5	52%	0.517	S	S	.	.	H	α-helix	trans	-67.9	-36.5	175.2	-71.7	160.2	-166.1	163.9	0	111.4	E461 L462 Q463 K469	E461-K465 WeakPolarHBondContact O-CB 3.42Å; E461-K465 VanDerWaalsContact O-CD 3.3Å; E461-K465 WeakPolarHBondContact O-CD 3.21Å; E461-K465 WeakPolarHBondContact O-CG 3.46Å; E461-K465 PolarHBondContact O-N 2.98Å; E461-K465 IonicContact OE2-NZ 3.31Å; E461-K465 PolarHBondContact OE2-NZ 3.4Å; L462-K465 PolarHBondContact O-N 2.92Å; Q463-K465 PolarHBondContact O-N 3.1Å; K465-K469 PolarHBondContact O-N 3.32Å
466	L	83.1	Confident	84.3	Confident	110 Å²	110	109.1 Å²	109.1	58%	0.576	51%	0.514	S	S	*	.	H	α-helix	trans	-67.3	-53	174.6	-174.3	69.2	0	0	0	111.1	L462 Q463 K468 K469 E470	L462-L466 WeakPolarHBondContact O-CB 3.36Å; L462-L466 PolarHBondContact O-N 3.07Å; Q463-L466 PolarHBondContact O-N 2.86Å; L466-K468 VanDerWaalsContact C-N 3.27Å; L466-K468 PolarHBondContact O-N 3.11Å; L466-K469 CarbonylContact O-C 3.19Å; L466-K469 WeakPolarHBondContact O-CA 3.27Å; L466-K469 WeakPolarHBondContact O-CB 3.38Å; L466-K469 PolarHBondContact O-N 2.99Å; L466-E470 PolarHBondContact O-N 3.14Å
467	E	84.9	Confident	84.2	Confident	89 Å²	89	103.8 Å²	103.8	42%	0.416	50%	0.501	S	S	.	.	H	α-helix	trans	-59.3	-38	179	-170.3	-172.3	-168.3	0	0	111.8	Q463 K469 E470 R471	Q463-E467 WeakPolarHBondContact O-CB 3.38Å; Q463-E467 PolarHBondContact O-N 3.32Å; E467-K469 VanDerWaalsContact C-N 3.32Å; E467-K469 PolarHBondContact O-N 2.95Å; E467-E470 PolarHBondContact O-N 3.01Å; E467-R471 WeakPolarHBondContact O-CG 3.32Å; E467-R471 PolarHBondContact O-N 3.46Å; E467-R471 VanDerWaalsContact O-N 3.14Å; E467-R471 IonicContact OE1-CZ 3.93Å; E467-R471 IonicContact OE1-NE 2.76Å; E467-R471 IonicContact OE1-NH2 2.92Å; E467-R471 PolarHBondContact OE1-NH2 2.89Å; E467-R471 IonicContact OE2-NH2 3.18Å
468	K	86.9	Confident	84	Confident	153 Å²	153	103.6 Å²	103.6	67%	0.665	50%	0.502	S	S	*	.	H	α-helix	trans	-64	-35.4	172.2	-175.8	175.1	179.6	178.8	0	112.5	Q464 L466 E472	Q464-K468 VanDerWaalsContact O-CB 3.28Å; Q464-K468 WeakPolarHBondContact O-CB 3.47Å; Q464-K468 PolarHBondContact O-N 2.85Å; L466-K468 VanDerWaalsContact C-N 3.27Å; L466-K468 PolarHBondContact O-N 3.11Å; K468-E472 WeakPolarHBondContact O-CB 3.45Å; K468-E472 PolarHBondContact O-N 3.48Å
469	K	84.3	Confident	83.8	Confident	120 Å²	120	105.4 Å²	105.4	52%	0.522	51%	0.511	S	S	.	.	H	α-helix	trans	-77.5	-31.3	178.1	-84.8	-70.1	176.6	-162.2	0	113.4	K465 L466 E467 E472 C473	K465-K469 PolarHBondContact O-N 3.32Å; L466-K469 CarbonylContact O-C 3.19Å; L466-K469 WeakPolarHBondContact O-CA 3.27Å; L466-K469 WeakPolarHBondContact O-CB 3.38Å; L466-K469 PolarHBondContact O-N 2.99Å; E467-K469 VanDerWaalsContact C-N 3.32Å; E467-K469 PolarHBondContact O-N 2.95Å; K469-E472 WeakPolarHBondContact CE-OE2 3.23Å; K469-E472 IonicContact NZ-OE1 2.57Å; K469-E472 PolarHBondContact NZ-OE1 3.44Å; K469-E472 IonicContact NZ-OE2 3.27Å; K469-E472 PolarHBondContact NZ-OE2 3.17Å; K469-E472 PolarHBondContact O-N 2.88Å; K469-C473 WeakPolarHBondContact O-CB 3.37Å; K469-C473 PolarHBondContact O-N 2.95Å
470	E	82.3	Confident	83.5	Confident	119 Å²	119	107.2 Å²	107.2	56%	0.556	52%	0.517	S	S	*	.	H	α-helix	trans	-61.1	-54.5	171.5	-166.3	163.7	-149.8	0	0	109.9	L466 E467 E472 C473 D474	L466-E470 PolarHBondContact O-N 3.14Å; E467-E470 PolarHBondContact O-N 3.01Å; E470-E472 VanDerWaalsContact C-N 3.25Å; E470-E472 PolarHBondContact O-N 3.48Å; E470-C473 WeakPolarHBondContact O-CA 3.5Å; E470-C473 VanDerWaalsContact O-CB 3.23Å; E470-C473 WeakPolarHBondContact O-CB 3.46Å; E470-C473 PolarHBondContact O-N 3.2Å; E470-D474 PolarHBondContact O-N 2.91Å
471	R	82.4	Confident	83.5	Confident	153 Å²	153	108.1 Å²	108.1	58%	0.577	52%	0.518	S	S	*	.	H	α-helix	trans	-58.4	-32.2	174.3	-62.4	173.1	-167	-179.2	4.4	113.9	E467 C473 A475	E467-R471 WeakPolarHBondContact O-CG 3.32Å; E467-R471 PolarHBondContact O-N 3.46Å; E467-R471 VanDerWaalsContact O-N 3.14Å; E467-R471 IonicContact OE1-CZ 3.93Å; E467-R471 IonicContact OE1-NE 2.76Å; E467-R471 IonicContact OE1-NH2 2.92Å; E467-R471 PolarHBondContact OE1-NH2 2.89Å; E467-R471 IonicContact OE2-NH2 3.18Å; R471-C473 VanDerWaalsContact C-N 3.34Å; R471-A475 WeakPolarHBondContact O-CB 3.44Å; R471-A475 PolarHBondContact O-N 3.06Å; R471-A475 VanDerWaalsContact O-N 3.13Å
472	E	83.1	Confident	83.3	Confident	65 Å²	65	108.4 Å²	108.4	30%	0.304	52%	0.52	S	S	.	.	H	α-helix	trans	-72.8	-26.5	174.1	-164.4	-165.1	124.6	0	0	112.5	K468 K469 E470 K476	K468-E472 WeakPolarHBondContact O-CB 3.45Å; K468-E472 PolarHBondContact O-N 3.48Å; K469-E472 WeakPolarHBondContact CE-OE2 3.23Å; K469-E472 IonicContact NZ-OE1 2.57Å; K469-E472 PolarHBondContact NZ-OE1 3.44Å; K469-E472 IonicContact NZ-OE2 3.27Å; K469-E472 PolarHBondContact NZ-OE2 3.17Å; K469-E472 PolarHBondContact O-N 2.88Å; E470-E472 VanDerWaalsContact C-N 3.25Å; E470-E472 PolarHBondContact O-N 3.48Å; E472-K476 WeakPolarHBondContact O-CD 3.4Å; E472-K476 WeakPolarHBondContact O-CG 3.29Å; E472-K476 PolarHBondContact O-N 3.48Å; E472-K476 IonicContact OE1-NZ 3.02Å; E472-K476 PolarHBondContact OE1-NZ 3.48Å
473	C	76.6	Confident	83.1	Confident	77 Å²	77	109.4 Å²	109.4	52%	0.52	52%	0.523	S	S	.	.	H	α-helix	trans	-78.6	-41.9	174.6	-160.4	0	0	0	0	111.2	K469 E470 R471 K476 T477	K469-C473 WeakPolarHBondContact O-CB 3.37Å; K469-C473 PolarHBondContact O-N 2.95Å; E470-C473 WeakPolarHBondContact O-CA 3.5Å; E470-C473 VanDerWaalsContact O-CB 3.23Å; E470-C473 WeakPolarHBondContact O-CB 3.46Å; E470-C473 PolarHBondContact O-N 3.2Å; R471-C473 VanDerWaalsContact C-N 3.34Å; C473-K476 PolarHBondContact O-N 3.07Å; C473-T477 PolarHBondContact O-N 2.86Å; C473-T477 PolarHBondContact O-OG1 3.47Å
474	D	82.4	Confident	82.9	Confident	96 Å²	96	110.2 Å²	110.2	51%	0.513	53%	0.528	S	S	.	.	H	α-helix	trans	-60.3	-48.2	175.4	-61.4	-30.9	0	0	0	110.7	E470 K476 T477 Q478	E470-D474 PolarHBondContact O-N 2.91Å; D474-K476 VanDerWaalsContact C-N 3.33Å; D474-K476 PolarHBondContact O-N 2.96Å; D474-T477 WeakPolarHBondContact O-CA 3.28Å; D474-T477 WeakPolarHBondContact O-CB 3.49Å; D474-T477 PolarHBondContact O-N 3.38Å; D474-Q478 PolarHBondContact O-N 3.13Å
475	A	84.3	Confident	82.6	Confident	49 Å²	49	109 Å²	109	41%	0.405	52%	0.523	S	S	.	.	H	α-helix	trans	-57	-43.4	176.5	0	0	0	0	0	112.7	R471 T477 Q478 E479	R471-A475 WeakPolarHBondContact O-CB 3.44Å; R471-A475 PolarHBondContact O-N 3.06Å; R471-A475 VanDerWaalsContact O-N 3.13Å; A475-T477 VanDerWaalsContact C-N 3.28Å; A475-T477 PolarHBondContact O-N 3.19Å; A475-Q478 WeakPolarHBondContact O-CB 3.38Å; A475-Q478 PolarHBondContact O-N 3.3Å; A475-E479 WeakPolarHBondContact O-CG 3.5Å; A475-E479 PolarHBondContact O-N 3.34Å
476	K	83.9	Confident	82.3	Confident	108 Å²	108	106.8 Å²	106.8	47%	0.47	52%	0.519	S	S	.	.	H	α-helix	trans	-70.8	-23.8	176.5	-71.3	169.9	-173	170.8	0	113.1	E472 C473 D474 K480	E472-K476 WeakPolarHBondContact O-CD 3.4Å; E472-K476 WeakPolarHBondContact O-CG 3.29Å; E472-K476 PolarHBondContact O-N 3.48Å; E472-K476 IonicContact OE1-NZ 3.02Å; E472-K476 PolarHBondContact OE1-NZ 3.48Å; C473-K476 PolarHBondContact O-N 3.07Å; D474-K476 VanDerWaalsContact C-N 3.33Å; D474-K476 PolarHBondContact O-N 2.96Å; K476-K480 VanDerWaalsContact O-CB 3.27Å; K476-K480 WeakPolarHBondContact O-CB 3.48Å; K476-K480 PolarHBondContact O-N 3.29Å; K476-K480 VanDerWaalsContact O-N 3.15Å
477	T	78.2	Confident	82	Confident	69 Å²	69	107 Å²	107	42%	0.423	52%	0.52	S	S	.	.	H	α-helix	trans	-74.8	-43	173.1	-56.2	0	0	0	0	110.2	C473 D474 A475 K480 E481	C473-T477 PolarHBondContact O-N 2.86Å; C473-T477 PolarHBondContact O-OG1 3.47Å; D474-T477 WeakPolarHBondContact O-CA 3.28Å; D474-T477 WeakPolarHBondContact O-CB 3.49Å; D474-T477 PolarHBondContact O-N 3.38Å; A475-T477 VanDerWaalsContact C-N 3.28Å; A475-T477 PolarHBondContact O-N 3.19Å; T477-K480 WeakPolarHBondContact O-CB 3.47Å; T477-K480 PolarHBondContact O-N 2.87Å; T477-E481 PolarHBondContact O-N 2.95Å
478	Q	82.5	Confident	81.8	Confident	112 Å²	112	106.5 Å²	106.5	52%	0.523	52%	0.52	S	S	.	.	H	α-helix	trans	-56.5	-52.7	171	-166.1	81.9	40	0	0	111.5	D474 A475 K480 E481 E482	D474-Q478 PolarHBondContact O-N 3.13Å; A475-Q478 WeakPolarHBondContact O-CB 3.38Å; A475-Q478 PolarHBondContact O-N 3.3Å; Q478-K480 VanDerWaalsContact C-N 3.27Å; Q478-K480 PolarHBondContact O-N 2.88Å; Q478-E481 PolarHBondContact O-N 3.42Å; Q478-E481 VanDerWaalsContact O-N 3.13Å; Q478-E482 PolarHBondContact O-N 3.32Å
479	E	83.4	Confident	81.7	Confident	123 Å²	123	105.2 Å²	105.2	58%	0.575	52%	0.515	S	S	*	.	H	α-helix	trans	-55.7	-40.2	176.1	-73.9	173.4	173	0	0	112.3	A475 M483	A475-E479 WeakPolarHBondContact O-CG 3.5Å; A475-E479 PolarHBondContact O-N 3.34Å; E479-M483 VanDerWaalsContact O-CB 3.27Å; E479-M483 WeakPolarHBondContact O-CB 3.5Å; E479-M483 PolarHBondContact O-N 2.99Å
480	K	79.2	Confident	81.4	Confident	150 Å²	150	101.8 Å²	101.8	65%	0.652	50%	0.501	S	S	*	.	H	α-helix	trans	-67.9	-39	178.3	-179.8	-172.8	172.9	-166.4	0	112.2	K476 T477 Q478 M484	K476-K480 VanDerWaalsContact O-CB 3.27Å; K476-K480 WeakPolarHBondContact O-CB 3.48Å; K476-K480 PolarHBondContact O-N 3.29Å; K476-K480 VanDerWaalsContact O-N 3.15Å; T477-K480 WeakPolarHBondContact O-CB 3.47Å; T477-K480 PolarHBondContact O-N 2.87Å; Q478-K480 VanDerWaalsContact C-N 3.27Å; Q478-K480 PolarHBondContact O-N 2.88Å; K480-M484 WeakPolarHBondContact O-CB 3.4Å; K480-M484 PolarHBondContact O-N 3.36Å
481	E	83.7	Confident	81.4	Confident	112 Å²	112	101.2 Å²	101.2	52%	0.523	50%	0.497	S	S	.	.	H	α-helix	trans	-68.1	-43.2	175.2	-71.3	-167	164.3	0	0	111.8	T477 Q478 M483 M484 Q485	T477-E481 PolarHBondContact O-N 2.95Å; Q478-E481 PolarHBondContact O-N 3.42Å; Q478-E481 VanDerWaalsContact O-N 3.13Å; E481-M483 VanDerWaalsContact C-N 3.34Å; E481-M483 PolarHBondContact O-N 2.97Å; E481-M484 PolarHBondContact O-N 2.88Å; E481-Q485 WeakPolarHBondContact O-CG 3.29Å; E481-Q485 PolarHBondContact O-N 2.91Å
482	E	84.9	Confident	81.4	Confident	108 Å²	108	100.3 Å²	100.3	51%	0.505	50%	0.499	S	S	.	.	H	α-helix	trans	-62.5	-40.5	175.3	-70.5	179.7	-167.9	0	0	112.1	Q478 Q485 T486	Q478-E482 PolarHBondContact O-N 3.32Å; E482-Q485 PolarHBondContact O-N 3.12Å; E482-T486 WeakPolarHBondContact O-CB 3.44Å; E482-T486 PolarHBondContact O-N 3.25Å; E482-T486 PolarHBondContact O-OG1 3.17Å
483	M	79.9	Confident	81.4	Confident	133 Å²	133	101.1 Å²	101.1	66%	0.655	50%	0.502	S	S	*	.	H	α-helix	trans	-63.3	-42.9	172.7	-171.6	179.3	-63.3	0	0	111.6	E479 E481 T486 L487	E479-M483 VanDerWaalsContact O-CB 3.27Å; E479-M483 WeakPolarHBondContact O-CB 3.5Å; E479-M483 PolarHBondContact O-N 2.99Å; E481-M483 VanDerWaalsContact C-N 3.34Å; E481-M483 PolarHBondContact O-N 2.97Å; M483-T486 PolarHBondContact O-N 3.28Å; M483-L487 WeakPolarHBondContact O-CB 3.16Å; M483-L487 PolarHBondContact O-N 3.5Å
484	M	79.6	Confident	81.5	Confident	121 Å²	121	102.6 Å²	102.6	60%	0.596	50%	0.504	S	S	*	.	H	α-helix	trans	-66.1	-40	178	-174.4	170.5	175.2	0	0	112.3	K480 E481 T486 L487 N488	K480-M484 WeakPolarHBondContact O-CB 3.4Å; K480-M484 PolarHBondContact O-N 3.36Å; E481-M484 PolarHBondContact O-N 2.88Å; M484-T486 VanDerWaalsContact C-N 3.34Å; M484-L487 PolarHBondContact O-N 3.46Å; M484-N488 PolarHBondContact O-N 2.94Å
485	Q	81.9	Confident	81.4	Confident	107 Å²	107	102.9 Å²	102.9	50%	0.5	50%	0.502	S	S	.	.	H	α-helix	trans	-62.4	-40.5	171.9	-71.4	-176.1	34.8	0	0	112	E481 E482 N488 K489	E481-Q485 WeakPolarHBondContact O-CG 3.29Å; E481-Q485 PolarHBondContact O-N 2.91Å; E482-Q485 PolarHBondContact O-N 3.12Å; Q485-N488 PolarHBondContact O-N 3.2Å; Q485-K489 WeakPolarHBondContact O-CG 3.46Å; Q485-K489 PolarHBondContact O-N 2.79Å
486	T	80.5	Confident	81.3	Confident	69 Å²	69	106.4 Å²	106.4	42%	0.423	51%	0.508	S	S	.	.	H	α-helix	trans	-65.5	-41.7	177.2	-59	0	0	0	0	111.4	E482 M483 M484 K489 M490	E482-T486 WeakPolarHBondContact O-CB 3.44Å; E482-T486 PolarHBondContact O-N 3.25Å; E482-T486 PolarHBondContact O-OG1 3.17Å; M483-T486 PolarHBondContact O-N 3.28Å; M484-T486 VanDerWaalsContact C-N 3.34Å; T486-K489 PolarHBondContact O-N 3.5Å; T486-M490 PolarHBondContact O-N 3.18Å
487	L	77.7	Confident	81	Confident	113 Å²	113	107 Å²	107	59%	0.592	51%	0.512	S	S	*	.	H	α-helix	trans	-67.6	-37.8	178.5	-155.6	155.8	0	0	0	111.5	M483 M484 M490 K491	M483-L487 WeakPolarHBondContact O-CB 3.16Å; M483-L487 PolarHBondContact O-N 3.5Å; M484-L487 PolarHBondContact O-N 3.46Å; L487-M490 PolarHBondContact O-N 2.84Å; L487-K491 PolarHBondContact O-N 2.74Å
488	N	80.1	Confident	81.1	Confident	79 Å²	79	106.7 Å²	106.7	42%	0.422	51%	0.511	S	S	.	.	H	α-helix	trans	-62.3	-45.4	170.9	-76.1	-20.8	0	0	0	112.3	M484 Q485 M490 K491 E492	M484-N488 PolarHBondContact O-N 2.94Å; Q485-N488 PolarHBondContact O-N 3.2Å; N488-M490 VanDerWaalsContact C-N 3.27Å; N488-M490 PolarHBondContact O-N 3.25Å; N488-K491 WeakPolarHBondContact O-CB 3.49Å; N488-K491 PolarHBondContact O-N 2.86Å; N488-E492 PolarHBondContact O-N 3.23Å
489	K	84.7	Confident	81	Confident	126 Å²	126	104.7 Å²	104.7	55%	0.548	51%	0.506	S	S	.	.	H	α-helix	trans	-61.8	-33.6	174.9	-72.8	168.1	-178.8	166	0	112.6	Q485 T486 K493	Q485-K489 WeakPolarHBondContact O-CG 3.46Å; Q485-K489 PolarHBondContact O-N 2.79Å; T486-K489 PolarHBondContact O-N 3.5Å; K489-K493 WeakPolarHBondContact O-CG 3.42Å; K489-K493 PolarHBondContact O-N 3.42Å; K489-K493 VanDerWaalsContact O-N 3.17Å
490	M	78.7	Confident	80.8	Confident	48 Å²	48	102.9 Å²	102.9	24%	0.236	50%	0.498	C	S	.	.	H	α-helix	trans	-69.8	-38	171.6	-74.1	-177.7	171	0	0	112.3	T486 L487 N488 K493 L494 P552 P553 P554	T486-M490 PolarHBondContact O-N 3.18Å; L487-M490 PolarHBondContact O-N 2.84Å; N488-M490 VanDerWaalsContact C-N 3.27Å; N488-M490 PolarHBondContact O-N 3.25Å; M490-K493 PolarHBondContact O-N 3.04Å; M490-L494 WeakPolarHBondContact O-CB 3.4Å; M490-L494 PolarHBondContact O-N 3.05Å; M490-P552 HydrophobicContact CE-CG 4.22Å; M490-P553 WeakPolarHBondContact CE-O 3.3Å; M490-P554 HydrophobicContact CE-CB 4.07Å; M490-P554 HydrophobicContact CE-CG 4.34Å; M490-P554 HydrophobicContact SD-CB 3.82Å; M490-P554 HydrophobicContact SD-CG 4.19Å
491	K	80.9	Confident	80.7	Confident	108 Å²	108	101.9 Å²	101.9	47%	0.47	50%	0.495	S	S	.	.	H	α-helix	trans	-62.6	-46.2	174.3	-177.8	-179.4	176.7	-71.2	0	111.8	L487 N488 K493 L494 E495	L487-K491 PolarHBondContact O-N 2.74Å; N488-K491 WeakPolarHBondContact O-CB 3.49Å; N488-K491 PolarHBondContact O-N 2.86Å; K491-K493 PolarHBondContact O-N 2.93Å; K491-L494 PolarHBondContact O-N 3.3Å; K491-E495 VanDerWaalsContact CE-OE1 3.29Å; K491-E495 WeakPolarHBondContact CE-OE1 3.48Å; K491-E495 IonicContact NZ-OE1 2.69Å; K491-E495 PolarHBondContact NZ-OE1 3.11Å; K491-E495 IonicContact NZ-OE2 3.29Å; K491-E495 WeakPolarHBondContact O-CG 3.46Å; K491-E495 PolarHBondContact O-N 3.08Å
492	E	83.6	Confident	80.5	Confident	134 Å²	134	103.3 Å²	103.3	63%	0.626	50%	0.5	S	S	*	.	H	α-helix	trans	-59.6	-45	176.1	-70.1	175.9	156.3	0	0	111.9	N488 E495 K496	N488-E492 PolarHBondContact O-N 3.23Å; E492-E495 PolarHBondContact O-N 3.41Å; E492-K496 WeakPolarHBondContact O-CB 3.5Å; E492-K496 PolarHBondContact O-N 3.35Å
493	K	81.8	Confident	80.3	Confident	82 Å²	82	104.2 Å²	104.2	36%	0.357	50%	0.504	S	S	.	.	H	α-helix	trans	-57.6	-48.1	172	-83.7	-178.8	158.9	-150.6	0	112.2	K489 M490 K491 E495 K496 E497 P551	K489-K493 WeakPolarHBondContact O-CG 3.42Å; K489-K493 PolarHBondContact O-N 3.42Å; K489-K493 VanDerWaalsContact O-N 3.17Å; M490-K493 PolarHBondContact O-N 3.04Å; K491-K493 PolarHBondContact O-N 2.93Å; K493-E495 VanDerWaalsContact C-N 3.35Å; K493-E495 PolarHBondContact O-N 2.94Å; K493-K496 CarbonylContact O-C 3.57Å; K493-K496 WeakPolarHBondContact O-CA 3.39Å; K493-K496 WeakPolarHBondContact O-CB 3.42Å; K493-K496 PolarHBondContact O-N 2.69Å; K493-K496 VanDerWaalsContact O-N 3.14Å; K493-E497 PolarHBondContact O-N 2.9Å; K493-P551 PolarHBondContact NZ-O 2.92Å
494	L	79.5	Confident	80.3	Confident	107 Å²	107	101.5 Å²	101.5	56%	0.56	50%	0.495	S	S	*	.	H	α-helix	trans	-67.5	-35	-176.8	-174.6	63.9	0	0	0	112	M490 K491 K496 T498	M490-L494 WeakPolarHBondContact O-CB 3.4Å; M490-L494 PolarHBondContact O-N 3.05Å; K491-L494 PolarHBondContact O-N 3.3Å; L494-K496 VanDerWaalsContact C-N 3.35Å; L494-T498 WeakPolarHBondContact O-CB 3.28Å; L494-T498 PolarHBondContact O-N 3.31Å; L494-T498 PolarHBondContact O-OG1 2.92Å
495	E	80.4	Confident	80.2	Confident	102 Å²	102	102.7 Å²	102.7	48%	0.477	50%	0.497	S	S	.	.	H	α-helix	trans	-67.2	-35.5	171.6	-75.1	175.7	-175.6	0	0	111.8	K491 E492 K493 T499	K491-E495 VanDerWaalsContact CE-OE1 3.29Å; K491-E495 WeakPolarHBondContact CE-OE1 3.48Å; K491-E495 IonicContact NZ-OE1 2.69Å; K491-E495 PolarHBondContact NZ-OE1 3.11Å; K491-E495 IonicContact NZ-OE2 3.29Å; K491-E495 WeakPolarHBondContact O-CG 3.46Å; K491-E495 PolarHBondContact O-N 3.08Å; E492-E495 PolarHBondContact O-N 3.41Å; K493-E495 VanDerWaalsContact C-N 3.35Å; K493-E495 PolarHBondContact O-N 2.94Å; E495-T499 WeakPolarHBondContact O-CG2 3.45Å; E495-T499 PolarHBondContact O-N 3.39Å; E495-T499 PolarHBondContact O-OG1 2.97Å
496	K	82.3	Confident	80	Confident	124 Å²	124	102.9 Å²	102.9	54%	0.539	50%	0.497	S	S	.	.	H	α-helix	trans	-67.4	-50.6	172.5	-167.8	172.5	-175.3	-81.2	0	112	E492 K493 L494 T498 T499 E500	E492-K496 WeakPolarHBondContact O-CB 3.5Å; E492-K496 PolarHBondContact O-N 3.35Å; K493-K496 CarbonylContact O-C 3.57Å; K493-K496 WeakPolarHBondContact O-CA 3.39Å; K493-K496 WeakPolarHBondContact O-CB 3.42Å; K493-K496 PolarHBondContact O-N 2.69Å; K493-K496 VanDerWaalsContact O-N 3.14Å; L494-K496 VanDerWaalsContact C-N 3.35Å; K496-T498 VanDerWaalsContact C-N 3.26Å; K496-T498 PolarHBondContact O-N 3.5Å; K496-T499 WeakPolarHBondContact CA-OG1 3.19Å; K496-T499 PolarHBondContact O-N 3.27Å; K496-T499 VanDerWaalsContact O-N 3.11Å; K496-T499 PolarHBondContact O-OG1 2.9Å; K496-E500 WeakPolarHBondContact CE-OE1 3.21Å; K496-E500 IonicContact NZ-OE1 2.65Å; K496-E500 PolarHBondContact NZ-OE1 3.27Å; K496-E500 WeakPolarHBondContact O-CB 3.5Å; K496-E500 WeakPolarHBondContact O-CG 3.49Å; K496-E500 PolarHBondContact O-N 3.02Å
497	E	77.8	Confident	79.8	Confident	119 Å²	119	105 Å²	105	56%	0.556	50%	0.503	S	S	*	.	H	α-helix	trans	-61	-35.7	175.1	-73.3	179.9	173.9	0	0	111.7	K493 H501	K493-E497 PolarHBondContact O-N 2.9Å; E497-H501 WeakPolarHBondContact O-CB 3.49Å; E497-H501 PolarHBondContact O-N 3.39Å
498	T	79.8	Confident	79.7	Confident	63 Å²	63	103.5 Å²	103.5	39%	0.387	50%	0.498	S	S	.	.	H	α-helix	trans	-67.4	-35.3	175.1	-62.7	0	0	0	0	112.5	L494 K496 K502	L494-T498 WeakPolarHBondContact O-CB 3.28Å; L494-T498 PolarHBondContact O-N 3.31Å; L494-T498 PolarHBondContact O-OG1 2.92Å; K496-T498 VanDerWaalsContact C-N 3.26Å; K496-T498 PolarHBondContact O-N 3.5Å; T498-K502 WeakPolarHBondContact O-CB 3.24Å; T498-K502 VanDerWaalsContact O-CG 3.29Å; T498-K502 WeakPolarHBondContact O-CG 3.3Å; T498-K502 PolarHBondContact O-N 2.87Å; T498-K502 VanDerWaalsContact O-N 3.07Å
499	T	80.1	Confident	79.5	Confident	71 Å²	71	102.1 Å²	102.1	44%	0.436	50%	0.497	S	S	.	.	H	α-helix	trans	-78.2	-38.3	176.6	45.3	0	0	0	0	112	E495 K496 K502 Q503	E495-T499 WeakPolarHBondContact O-CG2 3.45Å; E495-T499 PolarHBondContact O-N 3.39Å; E495-T499 PolarHBondContact O-OG1 2.97Å; K496-T499 WeakPolarHBondContact CA-OG1 3.19Å; K496-T499 PolarHBondContact O-N 3.27Å; K496-T499 VanDerWaalsContact O-N 3.11Å; K496-T499 PolarHBondContact O-OG1 2.9Å; T499-K502 WeakPolarHBondContact O-CB 3.5Å; T499-K502 PolarHBondContact O-N 3.06Å; T499-Q503 WeakPolarHBondContact O-CG 3.35Å; T499-Q503 PolarHBondContact O-N 3.06Å
500	E	79.8	Confident	79.1	Confident	84 Å²	84	99.4 Å²	99.4	39%	0.393	49%	0.489	S	S	.	.	H	α-helix	trans	-62.7	-45.5	170.8	-71.3	173.9	-176.8	0	0	111.4	K496 K502 Q503 V504	K496-E500 WeakPolarHBondContact CE-OE1 3.21Å; K496-E500 IonicContact NZ-OE1 2.65Å; K496-E500 PolarHBondContact NZ-OE1 3.27Å; K496-E500 WeakPolarHBondContact O-CB 3.5Å; K496-E500 WeakPolarHBondContact O-CG 3.49Å; K496-E500 PolarHBondContact O-N 3.02Å; E500-K502 VanDerWaalsContact C-N 3.33Å; E500-K502 PolarHBondContact O-N 3.42Å; E500-Q503 WeakPolarHBondContact O-CB 3.26Å; E500-Q503 PolarHBondContact O-N 3.23Å; E500-Q503 VanDerWaalsContact O-N 3.1Å; E500-V504 WeakPolarHBondContact O-CG2 3.4Å; E500-V504 PolarHBondContact O-N 3.02Å
501	H	77.9	Confident	78.9	Confident	130 Å²	130	102 Å²	102	60%	0.602	50%	0.503	S	S	*	.	H	α-helix	trans	-64.5	-34.3	175.2	-179.5	-135.3	0	0	0	112.6	E497 K505	E497-H501 WeakPolarHBondContact O-CB 3.49Å; E497-H501 PolarHBondContact O-N 3.39Å; H501-K505 WeakPolarHBondContact O-CB 3.32Å; H501-K505 PolarHBondContact O-N 3.05Å
502	K	79.4	Confident	78.4	Confident	141 Å²	141	100.2 Å²	100.2	61%	0.613	50%	0.501	S	S	*	.	H	α-helix	trans	-63.3	-42.5	169.7	-81.3	174.1	-179.5	178.6	0	111.9	T498 T499 E500 K505 Q506	T498-K502 WeakPolarHBondContact O-CB 3.24Å; T498-K502 VanDerWaalsContact O-CG 3.29Å; T498-K502 WeakPolarHBondContact O-CG 3.3Å; T498-K502 PolarHBondContact O-N 2.87Å; T498-K502 VanDerWaalsContact O-N 3.07Å; T499-K502 WeakPolarHBondContact O-CB 3.5Å; T499-K502 PolarHBondContact O-N 3.06Å; E500-K502 VanDerWaalsContact C-N 3.33Å; E500-K502 PolarHBondContact O-N 3.42Å; K502-K505 PolarHBondContact O-N 2.99Å; K502-Q506 WeakPolarHBondContact O-CB 3.49Å; K502-Q506 PolarHBondContact O-N 2.82Å
503	Q	79.4	Confident	77.9	Confident	127 Å²	127	96.6 Å²	96.6	59%	0.593	49%	0.494	S	S	*	.	H	α-helix	trans	-64.8	-45.4	176.4	-71.2	178	9.7	0	0	111.8	T499 E500 K505 Q506 Q507	T499-Q503 WeakPolarHBondContact O-CG 3.35Å; T499-Q503 PolarHBondContact O-N 3.06Å; E500-Q503 WeakPolarHBondContact O-CB 3.26Å; E500-Q503 PolarHBondContact O-N 3.23Å; E500-Q503 VanDerWaalsContact O-N 3.1Å; Q503-K505 PolarHBondContact O-N 3.47Å; Q503-Q506 PolarHBondContact O-N 2.77Å; Q503-Q507 WeakPolarHBondContact O-CG 3.47Å; Q503-Q507 PolarHBondContact O-N 3.18Å
504	V	80.6	Confident	77.3	Confident	77 Å²	77	98.2 Å²	98.2	47%	0.467	50%	0.503	S	S	.	.	H	α-helix	trans	-61.9	-42.8	175.1	172.2	0	0	0	0	111	E500 Q506 Q507 V508	E500-V504 WeakPolarHBondContact O-CG2 3.4Å; E500-V504 PolarHBondContact O-N 3.02Å; V504-Q506 VanDerWaalsContact C-N 3.31Å; V504-Q506 PolarHBondContact O-N 2.88Å; V504-Q507 PolarHBondContact O-N 2.83Å; V504-V508 HydrophobicContact CG1-CG2 4.47Å; V504-V508 WeakPolarHBondContact O-CG2 3.05Å; V504-V508 PolarHBondContact O-N 3.37Å
505	K	77.4	Confident	76.5	Confident	146 Å²	146	99 Å²	99	64%	0.635	51%	0.507	S	S	*	.	H	α-helix	trans	-64.3	-35.4	176.5	-171.1	172.1	-177.3	176.7	0	112.3	H501 K502 Q503 A509	H501-K505 WeakPolarHBondContact O-CB 3.32Å; H501-K505 PolarHBondContact O-N 3.05Å; K502-K505 PolarHBondContact O-N 2.99Å; Q503-K505 PolarHBondContact O-N 3.47Å; K505-A509 WeakPolarHBondContact O-CB 3.23Å; K505-A509 PolarHBondContact O-N 3.39Å
506	Q	78.1	Confident	75.7	Confident	110 Å²	110	100.6 Å²	100.6	51%	0.514	51%	0.514	S	S	.	.	H	α-helix	trans	-66.9	-47.1	171.9	-171.1	62	49.6	0	0	111.1	K502 Q503 V504 V508 A509 D510	K502-Q506 WeakPolarHBondContact O-CB 3.49Å; K502-Q506 PolarHBondContact O-N 2.82Å; Q503-Q506 PolarHBondContact O-N 2.77Å; V504-Q506 VanDerWaalsContact C-N 3.31Å; V504-Q506 PolarHBondContact O-N 2.88Å; Q506-V508 VanDerWaalsContact C-N 3.3Å; Q506-V508 PolarHBondContact O-N 3.2Å; Q506-A509 CarbonylContact O-C 3.28Å; Q506-A509 WeakPolarHBondContact O-CA 3.42Å; Q506-A509 WeakPolarHBondContact O-CB 3.43Å; Q506-A509 PolarHBondContact O-N 3.44Å; Q506-D510 PolarHBondContact NE2-OD1 3.08Å; Q506-D510 WeakPolarHBondContact O-CB 3.47Å; Q506-D510 PolarHBondContact O-N 2.83Å
507	Q	76.3	Confident	74.7	Confident	114 Å²	114	97 Å²	97	53%	0.533	50%	0.5	S	S	.	.	H	α-helix	trans	-58.6	-39.5	175.9	-72.3	174.3	-1.4	0	0	112.5	Q503 V504 D510 L511	Q503-Q507 WeakPolarHBondContact O-CG 3.47Å; Q503-Q507 PolarHBondContact O-N 3.18Å; V504-Q507 PolarHBondContact O-N 2.83Å; Q507-D510 PolarHBondContact O-N 3.05Å; Q507-L511 VanDerWaalsContact O-CB 3.29Å; Q507-L511 WeakPolarHBondContact O-CB 3.37Å; Q507-L511 VanDerWaalsContact O-CG 3.26Å; Q507-L511 WeakPolarHBondContact O-CG 3.3Å; Q507-L511 PolarHBondContact O-N 3.05Å
508	V	76.3	Confident	73.8	Confident	82 Å²	82	98 Å²	98	50%	0.497	51%	0.508	S	S	.	.	H	α-helix	trans	-66.5	-38.9	174.1	170.2	0	0	0	0	111.5	V504 Q506 T512	V504-V508 HydrophobicContact CG1-CG2 4.47Å; V504-V508 WeakPolarHBondContact O-CG2 3.05Å; V504-V508 PolarHBondContact O-N 3.37Å; Q506-V508 VanDerWaalsContact C-N 3.3Å; Q506-V508 PolarHBondContact O-N 3.2Å; V508-T512 VanDerWaalsContact O-CB 3.26Å; V508-T512 WeakPolarHBondContact O-CB 3.21Å; V508-T512 PolarHBondContact O-N 2.92Å; V508-T512 PolarHBondContact O-OG1 2.76Å
509	A	75.6	Confident	72.3	Confident	49 Å²	49	99.8 Å²	99.8	41%	0.405	52%	0.523	S	S	.	.	H	α-helix	trans	-65.6	-42.9	174	0	0	0	0	0	111.7	K505 Q506 T512 A513	K505-A509 WeakPolarHBondContact O-CB 3.23Å; K505-A509 PolarHBondContact O-N 3.39Å; Q506-A509 CarbonylContact O-C 3.28Å; Q506-A509 WeakPolarHBondContact O-CA 3.42Å; Q506-A509 WeakPolarHBondContact O-CB 3.43Å; Q506-A509 PolarHBondContact O-N 3.44Å; A509-T512 WeakPolarHBondContact O-CB 3.41Å; A509-T512 PolarHBondContact O-N 2.98Å; A509-A513 WeakPolarHBondContact O-CB 3.23Å; A509-A513 PolarHBondContact O-N 3.5Å
510	D	76	Confident	71.1	Confident	70 Å²	70	104.7 Å²	104.7	37%	0.374	53%	0.534	S	S	.	.	H	α-helix	trans	-67.7	-39.9	179	-62.3	-20.2	0	0	0	111.7	Q506 Q507 A513 Q514	Q506-D510 PolarHBondContact NE2-OD1 3.08Å; Q506-D510 WeakPolarHBondContact O-CB 3.47Å; Q506-D510 PolarHBondContact O-N 2.83Å; Q507-D510 PolarHBondContact O-N 3.05Å; D510-A513 PolarHBondContact O-N 2.92Å; D510-Q514 WeakPolarHBondContact O-CB 3.24Å; D510-Q514 VanDerWaalsContact O-CG 3.28Å; D510-Q514 WeakPolarHBondContact O-CG 3.49Å; D510-Q514 PolarHBondContact O-N 3.04Å
511	L	73.3	Confident	69.5	Low	102 Å²	102	109.7 Å²	109.7	53%	0.534	55%	0.549	S	S	.	.	H	α-helix	trans	-65.7	-38.6	172.5	-77.7	166.7	0	0	0	111.9	Q507 Q514 L515	Q507-L511 VanDerWaalsContact O-CB 3.29Å; Q507-L511 WeakPolarHBondContact O-CB 3.37Å; Q507-L511 VanDerWaalsContact O-CG 3.26Å; Q507-L511 WeakPolarHBondContact O-CG 3.3Å; Q507-L511 PolarHBondContact O-N 3.05Å; L511-Q514 PolarHBondContact O-N 2.82Å; L511-L515 PolarHBondContact O-N 3.45Å
512	T	72.1	Confident	67.6	Low	70 Å²	70	107.8 Å²	107.8	43%	0.429	56%	0.555	S	S	.	*	H	α-helix	trans	-65.8	-41.3	174.7	-59.4	0	0	0	0	110.7	V508 A509 L515 H516	V508-T512 VanDerWaalsContact O-CB 3.26Å; V508-T512 WeakPolarHBondContact O-CB 3.21Å; V508-T512 PolarHBondContact O-N 2.92Å; V508-T512 PolarHBondContact O-OG1 2.76Å; A509-T512 WeakPolarHBondContact O-CB 3.41Å; A509-T512 PolarHBondContact O-N 2.98Å; T512-L515 WeakPolarHBondContact O-CB 3.19Å; T512-L515 PolarHBondContact O-N 3.32Å; T512-H516 PolarHBondContact O-CD2 2.83Å; T512-H516 PolarHBondContact O-N 2.89Å
513	A	71.9	Confident	65.8	Low	58 Å²	58	108.1 Å²	108.1	48%	0.479	56%	0.562	S	S	.	*	H	α-helix	trans	-64.4	-39	173.7	0	0	0	0	0	112	A509 D510 H516 E517	A509-A513 WeakPolarHBondContact O-CB 3.23Å; A509-A513 PolarHBondContact O-N 3.5Å; D510-A513 PolarHBondContact O-N 2.92Å; A513-H516 PolarHBondContact O-N 3.23Å; A513-E517 VanDerWaalsContact O-CB 3.29Å; A513-E517 WeakPolarHBondContact O-CB 3.49Å; A513-E517 PolarHBondContact O-N 3.05Å
514	Q	69.6	Low	63.6	Low	117 Å²	117	108 Å²	108	55%	0.547	57%	0.574	S	S	.	*	H	α-helix	trans	-65.6	-39.7	173.8	-73.8	171.6	41.1	0	0	112.2	D510 L511 E517 L518	D510-Q514 WeakPolarHBondContact O-CB 3.24Å; D510-Q514 VanDerWaalsContact O-CG 3.28Å; D510-Q514 WeakPolarHBondContact O-CG 3.49Å; D510-Q514 PolarHBondContact O-N 3.04Å; L511-Q514 PolarHBondContact O-N 2.82Å; Q514-E517 PolarHBondContact O-N 2.9Å; Q514-L518 WeakPolarHBondContact O-CB 3.43Å; Q514-L518 VanDerWaalsContact O-CG 3.31Å; Q514-L518 WeakPolarHBondContact O-CG 3.4Å; Q514-L518 PolarHBondContact O-N 2.87Å
515	L	63.5	Low	61.1	Low	123 Å²	123	108.2 Å²	108.2	64%	0.644	58%	0.584	S	S	*	*	H	α-helix	trans	-60.7	-46.4	172.2	-101.5	163.4	0	0	0	112	L511 T512 S519	L511-L515 PolarHBondContact O-N 3.45Å; T512-L515 WeakPolarHBondContact O-CB 3.19Å; T512-L515 PolarHBondContact O-N 3.32Å; L515-S519 WeakPolarHBondContact O-CB 3.45Å; L515-S519 PolarHBondContact O-N 2.87Å
516	H	63.2	Low	58.9	Low	135 Å²	135	106.6 Å²	106.6	63%	0.625	59%	0.591	S	S	*	*	H	α-helix	trans	-64.9	-38.4	175.3	-89.1	-89.1	0	0	0	112.7	T512 A513 S519 R520	T512-H516 PolarHBondContact O-CD2 2.83Å; T512-H516 PolarHBondContact O-N 2.89Å; A513-H516 PolarHBondContact O-N 3.23Å; H516-S519 WeakPolarHBondContact O-CB 3.48Å; H516-S519 PolarHBondContact O-N 2.94Å; H516-R520 VanDerWaalsContact O-CB 3.3Å; H516-R520 WeakPolarHBondContact O-CB 3.49Å; H516-R520 PolarHBondContact O-N 2.79Å
517	E	61.4	Low	56.7	Low	50 Å²	50	107.9 Å²	107.9	23%	0.234	61%	0.606	C	S	.	*	H	α-helix	trans	-74.5	-34.4	-179.5	-169.4	69.1	169.2	0	0	112.4	A513 Q514 S519 R520 R521	A513-E517 VanDerWaalsContact O-CB 3.29Å; A513-E517 WeakPolarHBondContact O-CB 3.49Å; A513-E517 PolarHBondContact O-N 3.05Å; Q514-E517 PolarHBondContact O-N 2.9Å; E517-S519 VanDerWaalsContact C-N 3.35Å; E517-R520 VanDerWaalsContact CD-NH2 3.25Å; E517-R520 PolarHBondContact O-N 2.93Å; E517-R520 VanDerWaalsContact O-N 3.17Å; E517-R520 IonicContact OE1-CZ 3.4Å; E517-R520 IonicContact OE1-NH2 3.12Å; E517-R520 PolarHBondContact OE1-NH2 3.44Å; E517-R520 IonicContact OE2-CZ 3.48Å; E517-R520 IonicContact OE2-NE 2.63Å; E517-R520 PolarHBondContact OE2-NE 2.86Å; E517-R520 IonicContact OE2-NH2 2.86Å; E517-R520 PolarHBondContact OE2-NH2 3.03Å; E517-R521 HydrophobicContact CG-CG 4.23Å; E517-R521 WeakPolarHBondContact O-CB 3.5Å; E517-R521 WeakPolarHBondContact O-CG 3.28Å; E517-R521 PolarHBondContact O-N 3.39Å; E517-R521 IonicContact OE1-CZ 2.9Å; E517-R521 IonicContact OE1-NE 2.68Å; E517-R521 PolarHBondContact OE1-NE 3.23Å; E517-R521 IonicContact OE1-NH2 2.84Å; E517-R521 PolarHBondContact OE1-NH2 3.05Å
518	L	57.3	Low	55.1	Low	139 Å²	139	108.5 Å²	108.5	73%	0.728	62%	0.62	S	S	*	*	H	α-helix	trans	-63.9	-39.9	169	-76.6	168.1	0	0	0	111.5	Q514 R520	Q514-L518 WeakPolarHBondContact O-CB 3.43Å; Q514-L518 VanDerWaalsContact O-CG 3.31Å; Q514-L518 WeakPolarHBondContact O-CG 3.4Å; Q514-L518 PolarHBondContact O-N 2.87Å; L518-R520 PolarHBondContact O-N 3.28Å
519	S	49.4	Very low	53	Low	100 Å²	100	108.6 Å²	108.6	70%	0.699	64%	0.637	S	S	*	*	H	α-helix	trans	-64.8	-27.4	172.5	-175.8	0	0	0	0	112.8	L515 H516 E517	L515-S519 WeakPolarHBondContact O-CB 3.45Å; L515-S519 PolarHBondContact O-N 2.87Å; H516-S519 WeakPolarHBondContact O-CB 3.48Å; H516-S519 PolarHBondContact O-N 2.94Å; E517-S519 VanDerWaalsContact C-N 3.35Å
520	R	54.8	Low	50.9	Low	175 Å²	175	109.8 Å²	109.8	66%	0.66	66%	0.655	S	S	*	*	H	α-helix	trans	-94.1	-22.6	-174.9	-160.8	175.4	70.9	95.4	3.3	114.8	H516 E517 L518 A522	H516-R520 VanDerWaalsContact O-CB 3.3Å; H516-R520 WeakPolarHBondContact O-CB 3.49Å; H516-R520 PolarHBondContact O-N 2.79Å; E517-R520 VanDerWaalsContact CD-NH2 3.25Å; E517-R520 PolarHBondContact O-N 2.93Å; E517-R520 VanDerWaalsContact O-N 3.17Å; E517-R520 IonicContact OE1-CZ 3.4Å; E517-R520 IonicContact OE1-NH2 3.12Å; E517-R520 PolarHBondContact OE1-NH2 3.44Å; E517-R520 IonicContact OE2-CZ 3.48Å; E517-R520 IonicContact OE2-NE 2.63Å; E517-R520 PolarHBondContact OE2-NE 2.86Å; E517-R520 IonicContact OE2-NH2 2.86Å; E517-R520 PolarHBondContact OE2-NH2 3.03Å; L518-R520 PolarHBondContact O-N 3.28Å; R520-A522 PolarHBondContact O-N 3.4Å
521	R	45.5	Very low	49.4	Very low	189 Å²	189	112.4 Å²	112.4	71%	0.713	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.9	15.5	-175.9	-74.1	-172	-176.2	-170.5	6.7	115.8	E517 I523	E517-R521 HydrophobicContact CG-CG 4.23Å; E517-R521 WeakPolarHBondContact O-CB 3.5Å; E517-R521 WeakPolarHBondContact O-CG 3.28Å; E517-R521 PolarHBondContact O-N 3.39Å; E517-R521 IonicContact OE1-CZ 2.9Å; E517-R521 IonicContact OE1-NE 2.68Å; E517-R521 PolarHBondContact OE1-NE 3.23Å; E517-R521 IonicContact OE1-NH2 2.84Å; E517-R521 PolarHBondContact OE1-NH2 3.05Å; R521-I523 PolarHBondContact O-N 2.89Å
522	A	38.8	Very low	47.3	Very low	89 Å²	89	112.8 Å²	112.8	74%	0.736	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75	-3.2	175	0	0	0	0	0	114.6	R520	R520-A522 PolarHBondContact O-N 3.4Å
523	I	41.8	Very low	46.3	Very low	148 Å²	148	115.7 Å²	115.7	76%	0.759	71%	0.707	S	S	*	*	S	Bend	trans	-130.2	97.3	-179	-54.5	180	0	0	0	110.8	R521	R521-I523 PolarHBondContact O-N 2.89Å
524	C	32	Very low	44.3	Very low	124 Å²	124	116.8 Å²	116.8	84%	0.838	72%	0.724	S	S	*	*			trans	39	151.6	148.9	-53.1	0	0	0	0	123
525	A	30	Very low	42.5	Very low	82 Å²	82	115.9 Å²	115.9	68%	0.678	74%	0.737	S	S	*	*			cis	-177.2	162.4	-27.4	0	0	0	0	0	109.4
526	S	29.6	Very low	41.9	Very low	112 Å²	112	116.2 Å²	116.2	78%	0.783	75%	0.746	S	S	*	*			trans	65.9	131.6	168.9	35.4	0	0	0	0	118.5
527	V	33.1	Very low	40.4	Very low	138 Å²	138	113.7 Å²	113.7	84%	0.836	76%	0.756	S	S	*	*			cis	88.7	141.4	41.7	168	0	0	0	0	111.9
528	P	41.9	Very low	38.9	Very low	126 Å²	126	115 Å²	115	82%	0.818	78%	0.783	S	S	*	*			cis	-130.3	177	12.2	37.2	-18.7	0	0	0	117.6
529	G	32.8	Very low	38.3	Very low	84 Å²	84	114.6 Å²	114.6	87%	0.866	79%	0.789	S	S	*	*			trans	143	136.2	156.5	0	0	0	0	0	117
530	G	30.1	Very low	37.4	Very low	75 Å²	75	119.4 Å²	119.4	77%	0.773	80%	0.798	S	S	*	*			trans	-140.6	-162.5	171.2	0	0	0	0	0	111
531	P	45.2	Very low	37	Very low	125 Å²	125	116.6 Å²	116.6	81%	0.812	80%	0.802	S	S	*	*			cis	-137.3	175.5	5.7	43.5	-26.3	0	0	0	117
532	S	28.8	Very low	36.3	Very low	110 Å²	110	112.4 Å²	112.4	77%	0.769	80%	0.802	S	S	*	*			trans	8.3	171.2	142.8	-71.4	0	0	0	0	124.4
533	P	51.8	Low	36	Very low	130 Å²	130	112.9 Å²	112.9	84%	0.844	80%	0.8	S	S	*	*			cis	-138.6	-179.1	-17.6	33	-12.1	0	0	0	115.7
534	G	30.3	Very low	35.7	Very low	81 Å²	81	112.6 Å²	112.6	84%	0.835	81%	0.805	S	S	*	*			trans	168.5	128	158.7	0	0	0	0	0	116.7
535	A	31.8	Very low	36.4	Very low	99 Å²	99	112.5 Å²	112.5	82%	0.818	80%	0.803	S	S	*	*			trans	-157.4	-163.8	176.5	0	0	0	0	0	108.6
536	P	51.1	Low	36.6	Very low	130 Å²	130	112.4 Å²	112.4	84%	0.844	81%	0.81	S	S	*	*			cis	-137.7	-173.9	-13.5	42	-23.9	0	0	0	115.5
537	G	30.3	Very low	36.8	Very low	81 Å²	81	112 Å²	112	84%	0.835	81%	0.807	S	S	*	*			trans	102.4	141.9	158.9	0	0	0	0	0	116.6
538	G	31.1	Very low	36.7	Very low	78 Å²	78	112.6 Å²	112.6	80%	0.804	80%	0.804	S	S	*	*			cis	108.4	146.5	-1.5	0	0	0	0	0	114.1
539	P	44.7	Very low	36.5	Very low	130 Å²	130	113.9 Å²	113.9	84%	0.844	80%	0.803	S	S	*	*			cis	-134.1	-167	7.9	43.6	-25.2	0	0	0	116.7
540	F	30.4	Very low	37.1	Very low	201 Å²	201	115.2 Å²	115.2	88%	0.882	80%	0.797	S	S	*	*			trans	-78	-174.5	-177.8	-71.4	-81.6	0	0	0	115.4
541	P	45.9	Very low	37.6	Very low	116 Å²	116	116 Å²	116	75%	0.753	79%	0.789	S	S	*	*			cis	-130.4	-153.5	7.5	40.2	-17.4	0	0	0	113.4
542	S	31.5	Very low	37.5	Very low	102 Å²	102	113.9 Å²	113.9	71%	0.713	77%	0.774	S	S	*	*			cis	-170.2	170.6	1	21.1	0	0	0	0	108.7
543	S	32.5	Very low	38.4	Very low	98 Å²	98	114 Å²	114	69%	0.685	77%	0.773	S	S	*	*			cis	-177.2	107	-42.8	55.7	0	0	0	0	111.8
544	V	35.8	Very low	38.1	Very low	143 Å²	143	112.4 Å²	112.4	87%	0.867	76%	0.763	S	S	*	*			trans	56.4	165.4	155.4	-76.3	0	0	0	0	122.3
545	P	45.7	Very low	39.3	Very low	122 Å²	122	114.1 Å²	114.1	79%	0.792	76%	0.759	S	S	*	*			cis	-138.8	166.7	-26.1	32.4	-12.7	0	0	0	117.5
546	G	35.2	Very low	40.8	Very low	80 Å²	80	114.3 Å²	114.3	83%	0.825	75%	0.752	S	S	*	*			trans	90.2	157.1	147	0	0	0	0	0	119.1
547	S	32.4	Very low	40	Very low	104 Å²	104	115.8 Å²	115.8	73%	0.727	75%	0.752	S	S	*	*			cis	-163.8	141.6	-1.4	65.7	0	0	0	0	115.2
548	L	32.2	Very low	40.3	Very low	150 Å²	150	118.7 Å²	118.7	79%	0.785	75%	0.747	S	S	*	*			trans	65.9	120.1	149.7	-56.7	166.1	0	0	0	119.2
549	L	36.6	Very low	40.5	Very low	152 Å²	152	121 Å²	121	80%	0.796	75%	0.751	S	S	*	*				78.6	155.4	63.8	-69.8	-171.7	0	0	0	115.1
550	P	46.1	Very low	40	Very low	112 Å²	112	118.1 Å²	118.1	73%	0.727	75%	0.745	S	S	*	*			cis	-139.9	172.3	-42.1	40.4	-24.2	0	0	0	115.4
551	P	39.6	Very low	40.2	Very low	93 Å²	93	116.8 Å²	116.8	60%	0.604	75%	0.746	S	S	*	*			trans	-124.1	-169.4	171.8	45.4	-34.9	0	0	0	114	K493	K493-P551 PolarHBondContact NZ-O 2.92Å
552	P	44.9	Very low	40.1	Very low	79 Å²	79	119.3 Å²	119.3	51%	0.513	75%	0.752	S	S	.	*				-101.7	177.3	-102.4	40.5	-24.6	0	0	0	115.9	M490	M490-P552 HydrophobicContact CE-CG 4.22Å
553	P	46.9	Very low	40.8	Very low	114 Å²	114	119.6 Å²	119.6	74%	0.74	75%	0.751	S	S	*	*			trans	-96.9	165	178.6	37.9	-35.8	0	0	0	115.9	M490	M490-P553 WeakPolarHBondContact CE-O 3.3Å
554	P	44.4	Very low	41.8	Very low	96 Å²	96	120.5 Å²	120.5	62%	0.623	76%	0.755	S	S	*	*			trans	-115.4	170.2	-178.2	14.2	10.2	0	0	0	116.4	M490	M490-P554 HydrophobicContact CE-CB 4.07Å; M490-P554 HydrophobicContact CE-CG 4.34Å; M490-P554 HydrophobicContact SD-CB 3.82Å; M490-P554 HydrophobicContact SD-CG 4.19Å
555	P	56.3	Low	42.8	Very low	116 Å²	116	119.4 Å²	119.4	75%	0.753	75%	0.751	S	S	*	*			trans	-96.5	-147.9	164.3	44.5	-37.5	0	0	0	109.3
556	P	64.1	Low	43.5	Very low	103 Å²	103	119.1 Å²	119.1	67%	0.669	75%	0.749	S	S	*	*			cis	-131.6	-160.9	-19.8	42.2	-24.9	0	0	0	112.2
557	L	33.2	Very low	44.8	Very low	162 Å²	162	120.7 Å²	120.7	85%	0.848	75%	0.745	S	S	*	*				-165.4	165.3	123.9	-107.9	170.7	0	0	0	113.4
558	L	37.3	Very low	45.8	Very low	141 Å²	141	121.9 Å²	121.9	74%	0.738	75%	0.75	S	S	*	*			trans	-109.9	158.5	-172.9	-58.6	89.4	0	0	0	112.8
559	S	34.6	Very low	46.8	Very low	126 Å²	126	122.6 Å²	122.6	88%	0.881	75%	0.754	S	S	*	*				160.5	143.4	119	-72	0	0	0	0	112.7
560	G	33.8	Very low	47.8	Very low	71 Å²	71	120.5 Å²	120.5	73%	0.732	75%	0.749	S	S	*	*			trans	144.1	98.4	159.9	0	0	0	0	0	118.2
561	I	35.4	Very low	48.1	Very low	173 Å²	173	121.5 Å²	121.5	89%	0.887	76%	0.756	S	S	*	*			trans	21.4	125.1	138.7	-56.5	165.6	0	0	0	118.6
562	L	43.8	Very low	48.2	Very low	168 Å²	168	120.8 Å²	120.8	88%	0.88	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-82.5	136	167.6	-69.8	170.1	0	0	0	112.7
563	P	45.7	Very low	48.6	Very low	109 Å²	109	120.4 Å²	120.4	71%	0.708	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-89.9	165.8	172	35.9	-34.6	0	0	0	113.6
564	P	53.4	Low	48.6	Very low	116 Å²	116	120.9 Å²	120.9	75%	0.753	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-76.8	165.4	179	32.4	-37.2	0	0	0	114.1
565	P	57.5	Low	48.5	Very low	120 Å²	120	121.9 Å²	121.9	78%	0.779	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-69.9	148.9	177.7	29.4	-36.1	0	0	0	113.3
566	P	59.2	Low	47.8	Very low	117 Å²	117	121.8 Å²	121.8	76%	0.76	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-80.3	156.9	-179	33	-36.1	0	0	0	113.7
567	P	63.4	Low	46.9	Very low	113 Å²	113	122.5 Å²	122.5	73%	0.734	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-76	161.3	175.2	32.9	-36.3	0	0	0	113
568	P	54.3	Low	47.2	Very low	129 Å²	129	121 Å²	121	84%	0.838	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-69.7	144.7	177	29.4	-35.3	0	0	0	112.8
569	L	53.2	Low	47.5	Very low	165 Å²	165	117.4 Å²	117.4	86%	0.864	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-82	151.2	175.2	-75	163	0	0	0	111.8
570	P	57.5	Low	48	Very low	108 Å²	108	117.3 Å²	117.3	70%	0.701	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-72.9	158.8	179.4	31	-35.9	0	0	0	112.7	G572	P570-G572 PolarHBondContact O-N 3.26Å
571	P	51.7	Low	48.3	Very low	133 Å²	133	119.4 Å²	119.4	86%	0.864	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-64.1	131.6	179.8	-20.5	33.1	0	0	0	112.8
572	G	42.3	Very low	48.4	Very low	77 Å²	77	117.5 Å²	117.5	79%	0.794	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-73.3	143.5	172.1	0	0	0	0	0	112.4	P570	P570-G572 PolarHBondContact O-N 3.26Å
573	G	53.3	Low	48.1	Very low	71 Å²	71	118 Å²	118	73%	0.732	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-73.5	173.6	174.1	0	0	0	0	0	113.9
574	P	47	Very low	47.5	Very low	124 Å²	124	116.1 Å²	116.1	81%	0.805	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-68.2	154.5	-177.9	29.2	-35.8	0	0	0	113
575	P	40.8	Very low	46.8	Very low	117 Å²	117	115.6 Å²	115.6	76%	0.76	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-71.1	153.4	178	30.6	-35.8	0	0	0	112.6
576	P	42.6	Very low	45.7	Very low	115 Å²	115	116.7 Å²	116.7	75%	0.747	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-71.6	155.4	175.7	30.9	-35.5	0	0	0	112.5
577	P	45.1	Very low	44.7	Very low	117 Å²	117	119.2 Å²	119.2	76%	0.76	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-74.5	159.2	-177.2	30.9	-36.2	0	0	0	113.5
578	P	40	Very low	43.4	Very low	131 Å²	131	119.3 Å²	119.3	85%	0.851	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-69.7	142.1	177.2	-15.5	30.6	0	0	0	112.9
579	G	42.9	Very low	42.5	Very low	66 Å²	66	118.7 Å²	118.7	68%	0.68	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-79.3	161.2	170.6	0	0	0	0	0	113.5
580	P	44.9	Very low	41.9	Very low	124 Å²	124	117.4 Å²	117.4	81%	0.805	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-70.8	160.2	177.8	30.6	-35.8	0	0	0	113
581	P	39.3	Very low	41.4	Very low	115 Å²	115	116.2 Å²	116.2	75%	0.747	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-71	152.5	-176.8	29.8	-36.2	0	0	0	113.2
582	P	38.5	Very low	40.5	Very low	133 Å²	133	114.1 Å²	114.1	86%	0.864	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-74.5	140.6	-177.5	30.6	-35.2	0	0	0	112.7
583	L	36.8	Very low	40.3	Very low	177 Å²	177	116.7 Å²	116.7	93%	0.927	80%	0.801	S	S	*	*			trans	-128.6	137.3	178	-122.9	172.3	0	0	0	109.4
584	G	33.2	Very low	39.5	Very low	70 Å²	70	122.3 Å²	122.3	72%	0.722	81%	0.81	S	S	*	*			trans	87.8	125.8	170.7	0	0	0	0	0	115.3
585	A	40.3	Very low	38.9	Very low	106 Å²	106	119.8 Å²	119.8	88%	0.876	81%	0.806	S	S	*	*			trans	-88.7	135.3	169.7	0	0	0	0	0	110.6
586	V	33.1	Very low	39	Very low	142 Å²	142	122.4 Å²	122.4	86%	0.861	81%	0.813	S	S	*	*			trans	-137.8	136.1	167.5	-174.3	0	0	0	0	108.5
587	M	38.6	Very low	39	Very low	170 Å²	170	121.4 Å²	121.4	84%	0.837	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-77.2	142.8	179	-66.3	163.7	56.5	0	0	111.5
588	P	35.6	Very low	39.5	Very low	116 Å²	116	122 Å²	122	75%	0.753	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-76.1	143	173	31.2	-33.9	0	0	0	112
589	P	36	Very low	40.2	Very low	115 Å²	115	125.3 Å²	125.3	75%	0.747	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-68.4	158.2	168.5	-18.2	32.2	0	0	0	112.8	G591	P589-G591 PolarHBondContact O-N 3.5Å
590	P	39.3	Very low	40.4	Very low	139 Å²	139	132 Å²	132	90%	0.903	82%	0.822	S	S	*	*	S	Bend	trans	-77.3	117.7	-179.9	30.7	-33.6	0	0	0	111.9
591	G	48.7	Very low	41.4	Very low	83 Å²	83	131.2 Å²	131.2	86%	0.856	81%	0.806	S	S	*	*			trans	154.9	43.4	172.8	0	0	0	0	0	117.8	P589	P589-G591 PolarHBondContact O-N 3.5Å
592	A	32.8	Very low	42.3	Very low	88 Å²	88	131.6 Å²	131.6	73%	0.727	81%	0.811	S	S	*	*	S	Bend	trans	-139.3	149.5	170.3	0	0	0	0	0	111
593	P	38.4	Very low	44.2	Very low	132 Å²	132	128.3 Å²	128.3	86%	0.857	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-66.4	134.1	-179	-18.8	32.2	0	0	0	111.8	G595	P593-G595 PolarHBondContact O-N 2.93Å
594	M	35.5	Very low	46.1	Very low	189 Å²	189	123.1 Å²	123.1	93%	0.931	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-69.3	120.1	169.7	-72.6	-168.8	-71.9	0	0	109.9
595	G	34.9	Very low	48.2	Very low	70 Å²	70	126.9 Å²	126.9	72%	0.722	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-59.2	146	167.1	0	0	0	0	0	111.1	P593 A597	P593-G595 PolarHBondContact O-N 2.93Å; G595-A597 PolarHBondContact O-N 3.03Å
596	L	41.8	Very low	50	Low	172 Å²	172	125 Å²	125	90%	0.901	74%	0.74	S	S	*	*			trans	-68.5	99.5	-173.2	-72.7	164.2	0	0	0	111.8	L598	L596-L598 PolarHBondContact O-N 3.44Å
597	A	42.7	Very low	52.2	Low	94 Å²	94	124 Å²	124	78%	0.777	74%	0.735	S	S	*	*	P	Polyproline II helix	trans	-63.4	119.1	162.6	0	0	0	0	0	109.3	G595 K599	G595-A597 PolarHBondContact O-N 3.03Å; A597-K599 PolarHBondContact O-N 3.17Å
598	L	56.9	Low	53.9	Low	131 Å²	131	120.1 Å²	120.1	69%	0.686	72%	0.717	S	S	*	*	P	Polyproline II helix	trans	-61.5	126.4	178.7	-72.4	168.6	0	0	0	109.9	L596 K600	L596-L598 PolarHBondContact O-N 3.44Å; L598-K600 PolarHBondContact O-N 3.31Å
599	K	53.9	Low	55.7	Low	199 Å²	199	116 Å²	116	87%	0.865	69%	0.692	S	S	*	*	P	Polyproline II helix	trans	-66.8	129.7	178.6	-70.9	-173.8	178	-178.9	0	110	A597 K601	A597-K599 PolarHBondContact O-N 3.17Å; K599-K601 PolarHBondContact O-N 3.45Å; K599-K601 VanDerWaalsContact O-N 3.1Å
600	K	47.8	Very low	57.9	Low	208 Å²	208	112.5 Å²	112.5	90%	0.904	67%	0.667	S	S	*	*			trans	-50.9	115.7	173.7	-174.1	177.1	-178	179.4	0	110	L598	L598-K600 PolarHBondContact O-N 3.31Å
601	K	65.5	Low	59.6	Low	107 Å²	107	108.4 Å²	108.4	47%	0.465	64%	0.635	S	S	.	*			trans	-63.8	145.2	-179.9	-65.2	-173.5	-178.7	-172.3	0	110.8	K599 I603 D633 T634	K599-K601 PolarHBondContact O-N 3.45Å; K599-K601 VanDerWaalsContact O-N 3.1Å; K601-I603 HydrophobicContact CB-CD1 4.14Å; K601-I603 HydrophobicContact CB-CG1 3.94Å; K601-D633 IonicContact NZ-OD1 3.85Å; K601-D633 PolarHBondContact NZ-OD1 3.41Å; K601-T634 HydrophobicContact CD-CG2 4.29Å
602	S	58.4	Low	60.9	Low	122 Å²	122	106.3 Å²	106.3	85%	0.853	61%	0.608	S	S	*	*			trans	-90.4	100.9	170.1	-169.6	0	0	0	0	108.7
603	I	77.6	Confident	63	Low	64 Å²	64	109.6 Å²	109.6	33%	0.328	61%	0.606	S	S	.	*			trans	-112.7	128.2	-176.7	-59.4	175.4	0	0	0	107.9	K601 Q605 F637	K601-I603 HydrophobicContact CB-CD1 4.14Å; K601-I603 HydrophobicContact CB-CG1 3.94Å; I603-Q605 PolarHBondContact O-N 3.07Å; I603-Q605 PolarHBondContact O-NE2 3.4Å; I603-F637 HydrophobicContact CG2-CD2 4.43Å; I603-F637 HydrophobicContact CG2-CE1 4.38Å; I603-F637 HydrophobicContact CG2-CE2 3.76Å; I603-F637 HydrophobicContact CG2-CZ 3.74Å
604	P	76.4	Confident	64.7	Low	68 Å²	68	107.4 Å²	107.4	44%	0.442	59%	0.587	S	S	.	*	P	Polyproline II helix	trans	-60.4	138.1	176	27.2	-34.4	0	0	0	110.3	F637 L642	P604-F637 HydrophobicContact CG-CB 4.17Å; P604-F637 HydrophobicContact CG-CD1 4.01Å; P604-F637 HydrophobicContact CG-CG 4.11Å; P604-L642 HydrophobicContact CB-CD1 4.47Å; P604-L642 HydrophobicContact CG-CD1 4.13Å
605	Q	76.9	Confident	66.8	Low	150 Å²	150	106.2 Å²	106.2	70%	0.701	57%	0.572	S	S	*	*	P	Polyproline II helix	trans	-100.3	144.8	176	-58.5	-54.5	-67.3	0	0	109.3	I603	I603-Q605 PolarHBondContact O-N 3.07Å; I603-Q605 PolarHBondContact O-NE2 3.4Å
606	P	78.9	Confident	68.8	Low	65 Å²	65	108.9 Å²	108.9	42%	0.422	58%	0.58	S	S	.	*	P	Polyproline II helix	trans	-69	153.6	178.6	31.3	-36.1	0	0	0	111.3	L610 E646	P606-L610 HydrophobicContact CB-CD1 3.99Å; P606-L610 HydrophobicContact CB-CG 4.18Å; P606-L610 HydrophobicContact CG-CD1 4.25Å; P606-L610 HydrophobicContact CG-CG 4.29Å; P606-E646 WeakPolarHBondContact CA-OE1 3.22Å; P606-E646 HydrophobicContact CB-CG 3.79Å
607	T	78.7	Confident	70.7	Confident	122 Å²	122	108.8 Å²	108.8	75%	0.748	57%	0.572	S	S	*	*	S	Bend	trans	-75.9	-30.9	179.4	-40.8	0	0	0	0	111.5	E646	T607-E646 WeakPolarHBondContact CB-OE2 3.42Å; T607-E646 PolarHBondContact N-OE1 2.95Å; T607-E646 PolarHBondContact N-OE2 3.34Å; T607-E646 VanDerWaalsContact N-OE2 3.1Å; T607-E646 PolarHBondContact OG1-OE1 3.02Å; T607-E646 VanDerWaalsContact OG1-OE1 3.1Å
608	N	75.3	Confident	72.4	Confident	89 Å²	89	108.3 Å²	108.3	48%	0.476	56%	0.556	S	S	.	*	S	Bend	trans	-124.5	152.9	177.2	-56.2	-96.5	0	0	0	110.6	L610 E646	N608-L610 WeakPolarHBondContact O-CD2 3.38Å; N608-E646 PolarHBondContact N-OE2 2.62Å; N608-E646 PolarHBondContact ND2-OE2 3.38Å; N608-E646 VanDerWaalsContact ND2-OE2 3.13Å
609	A	74.1	Confident	73.6	Confident	28 Å²	28	105.3 Å²	105.3	23%	0.231	55%	0.545	C	S	.	.			trans	-64.8	140.6	176.2	0	0	0	0	0	112.6	A651 Y652 H747	A609-A651 HydrophobicContact CB-CB 4.13Å; A609-A651 WeakPolarHBondContact O-CB 3.34Å; A609-A651 PolarHBondContact O-N 3.18Å; A609-Y652 HydrophobicContact CB-CE2 4.47Å; A609-H747 WeakPolarHBondContact CB-CE1 3.33Å
610	L	80.6	Confident	74.9	Confident	42 Å²	42	103.1 Å²	103.1	22%	0.22	54%	0.537	C	S	.	.	B	Isolated β-bridge	trans	-119.9	159.1	-174.7	-52.7	-173.2	0	0	0	111.9	P606 N608 E646 F649 V687	P606-L610 HydrophobicContact CB-CD1 3.99Å; P606-L610 HydrophobicContact CB-CG 4.18Å; P606-L610 HydrophobicContact CG-CD1 4.25Å; P606-L610 HydrophobicContact CG-CG 4.29Å; N608-L610 WeakPolarHBondContact O-CD2 3.38Å; L610-E646 HydrophobicContact CD1-CG 4.25Å; L610-E646 HydrophobicContact CD2-CB 4.07Å; L610-E646 HydrophobicContact CD2-CG 4.06Å; L610-E646 WeakPolarHBondContact CD2-O 3.29Å; L610-F649 CarbonylContact C-O 3.58Å; L610-F649 WeakPolarHBondContact CA-O 2.82Å; L610-V687 WeakPolarHBondContact O-CG1 3.39Å
611	K	75.3	Confident	76.5	Confident	53 Å²	53	100 Å²	100	23%	0.23	53%	0.53	C	S	.	.			trans	-56.9	133.2	168.5	-67.1	-90.1	173.7	178.2	0	109.7	F649 S686	K611-F649 WeakPolarHBondContact CG-O 3.33Å; K611-F649 PolarHBondContact N-O 3.28Å; K611-S686 VanDerWaalsContact CD-O 3.22Å; K611-S686 WeakPolarHBondContact CD-O 3.37Å; K611-S686 WeakPolarHBondContact CE-O 3.45Å; K611-S686 VanDerWaalsContact NZ-CB 3.26Å; K611-S686 PolarHBondContact NZ-O 2.86Å; K611-S686 PolarHBondContact NZ-OG 3.02Å
612	S	76.4	Confident	77.3	Confident	40 Å²	40	101.2 Å²	101.2	28%	0.28	54%	0.536	S	S	.	.			trans	-71.6	148.8	179.3	64.8	0	0	0	0	112.7	V687	S612-V687 WeakPolarHBondContact CB-O 3.21Å; S612-V687 PolarHBondContact N-O 3.4Å; S612-V687 PolarHBondContact OG-O 3.4Å
613	F	77.4	Confident	78.5	Confident	156 Å²	156	97.8 Å²	97.8	68%	0.684	51%	0.508	S	S	*	.			trans	-96.8	112.2	165.8	179.6	-139.5	0	0	0	109	W615	F613-W615 VanDerWaalsContact C-N 3.29Å; F613-W615 HydrophobicContact CD1-CB 3.8Å; F613-W615 AromaticContact CD1-CD2 3.76Å; F613-W615 HydrophobicContact CD1-CD2 3.76Å; F613-W615 AromaticContact CD1-CE3 3.96Å; F613-W615 HydrophobicContact CD1-CE3 3.96Å; F613-W615 AromaticContact CD1-CG 3.72Å; F613-W615 HydrophobicContact CD1-CG 3.72Å; F613-W615 HydrophobicContact CE1-CB 3.68Å; F613-W615 AromaticContact CE1-CD2 3.95Å; F613-W615 HydrophobicContact CE1-CD2 3.95Å; F613-W615 AromaticContact CE1-CE3 3.77Å; F613-W615 HydrophobicContact CE1-CE3 3.77Å; F613-W615 AromaticContact CE1-CG 3.97Å; F613-W615 HydrophobicContact CE1-CG 3.97Å; F613-W615 HydrophobicContact CG-CB 4.37Å; F613-W615 HydrophobicContact CG-CG 4.44Å; F613-W615 HydrophobicContact CZ-CB 4.14Å; F613-W615 PolarHBondContact O-N 3.18Å
614	N	73.7	Confident	78.7	Confident	86 Å²	86	103.7 Å²	103.7	46%	0.46	53%	0.534	S	S	.	.			trans	-78.5	75.9	-176	-166.4	-6.3	0	0	0	111.4	D689	N614-D689 HydrophobicContact CB-CB 4.26Å; N614-D689 PolarHBondContact ND2-OD1 2.87Å
615	W	79.9	Confident	78.9	Confident	164 Å²	164	104.3 Å²	104.3	62%	0.621	55%	0.553	S	S	*	*			trans	-112.7	142.3	-177	68.1	-22.2	0	0	0	113.9	F613 K617	F613-W615 VanDerWaalsContact C-N 3.29Å; F613-W615 HydrophobicContact CD1-CB 3.8Å; F613-W615 AromaticContact CD1-CD2 3.76Å; F613-W615 HydrophobicContact CD1-CD2 3.76Å; F613-W615 AromaticContact CD1-CE3 3.96Å; F613-W615 HydrophobicContact CD1-CE3 3.96Å; F613-W615 AromaticContact CD1-CG 3.72Å; F613-W615 HydrophobicContact CD1-CG 3.72Å; F613-W615 HydrophobicContact CE1-CB 3.68Å; F613-W615 AromaticContact CE1-CD2 3.95Å; F613-W615 HydrophobicContact CE1-CD2 3.95Å; F613-W615 AromaticContact CE1-CE3 3.77Å; F613-W615 HydrophobicContact CE1-CE3 3.77Å; F613-W615 AromaticContact CE1-CG 3.97Å; F613-W615 HydrophobicContact CE1-CG 3.97Å; F613-W615 HydrophobicContact CG-CB 4.37Å; F613-W615 HydrophobicContact CG-CG 4.44Å; F613-W615 HydrophobicContact CZ-CB 4.14Å; F613-W615 PolarHBondContact O-N 3.18Å; W615-K617 PolarHBondContact O-N 3.41Å
616	S	76	Confident	79.5	Confident	126 Å²	126	99.2 Å²	99.2	88%	0.881	53%	0.532	S	S	*	.			trans	-86.2	99.7	175	-50.4	0	0	0	0	110.9	L618	S616-L618 PolarHBondContact O-N 3.23Å
617	K	81.8	Confident	79.8	Confident	171 Å²	171	100 Å²	100	74%	0.743	54%	0.535	S	S	*	.	P	Polyproline II helix	trans	-60.9	129.4	177.4	-67.2	-178.4	-68.8	-170.9	0	111.4	W615	W615-K617 PolarHBondContact O-N 3.41Å
618	L	79.2	Confident	80.1	Confident	84 Å²	84	100.4 Å²	100.4	44%	0.44	52%	0.523	S	S	.	.	P	Polyproline II helix	trans	-70.7	128.3	171.2	-98.4	158.1	0	0	0	110.3	S616 K622 L623 W628	S616-L618 PolarHBondContact O-N 3.23Å; L618-K622 HydrophobicContact CD2-CB 3.99Å; L618-L623 HydrophobicContact CB-CD1 3.93Å; L618-W628 VanDerWaalsContact CD1-NE1 3.29Å
619	P	82.7	Confident	80.5	Confident	68 Å²	68	100.8 Å²	100.8	44%	0.442	53%	0.529	S	S	.	.	P	Polyproline II helix	trans	-61	143.1	172.8	-25.8	36.3	0	0	0	112.2	N621 K622 L623	P619-N621 WeakPolarHBondContact CB-OD1 3.33Å; P619-N621 PolarHBondContact O-N 3.25Å; P619-K622 WeakPolarHBondContact O-CA 3.36Å; P619-K622 WeakPolarHBondContact O-CB 3.36Å; P619-K622 PolarHBondContact O-N 2.82Å; P619-L623 WeakPolarHBondContact O-CD1 3.35Å
620	E	80.4	Confident	80.9	Confident	152 Å²	152	107.1 Å²	107.1	71%	0.71	55%	0.554	S	S	*	*	G	3₁₀ helix	trans	-57.4	-35.8	-173.9	-65.8	177.4	-165.5	0	0	113.2	K622 L623	E620-K622 PolarHBondContact O-N 2.78Å; E620-K622 VanDerWaalsContact O-N 3.07Å; E620-L623 PolarHBondContact O-N 2.84Å
621	N	81.6	Confident	81	Confident	142 Å²	142	109.2 Å²	109.2	76%	0.759	56%	0.564	S	S	*	*	G	3₁₀ helix	trans	-71.8	6.7	174.5	69.8	-15.5	0	0	0	114.9	P619	P619-N621 WeakPolarHBondContact CB-OD1 3.33Å; P619-N621 PolarHBondContact O-N 3.25Å
622	K	82.2	Confident	81.4	Confident	133 Å²	133	109 Å²	109	58%	0.578	57%	0.566	S	S	*	*	G	3₁₀ helix	trans	-124.2	8.3	173.2	-62.2	-171.1	178.6	-175	0	113.3	L618 P619 E620 T626	L618-K622 HydrophobicContact CD2-CB 3.99Å; P619-K622 WeakPolarHBondContact O-CA 3.36Å; P619-K622 WeakPolarHBondContact O-CB 3.36Å; P619-K622 PolarHBondContact O-N 2.82Å; E620-K622 PolarHBondContact O-N 2.78Å; E620-K622 VanDerWaalsContact O-N 3.07Å; K622-T626 VanDerWaalsContact O-CG2 3.29Å; K622-T626 WeakPolarHBondContact O-CG2 3.49Å
623	L	83.3	Confident	81.5	Confident	50 Å²	50	109.4 Å²	109.4	26%	0.262	56%	0.564	S	S	.	*			trans	-82.7	-31.4	175.9	-96.7	84.6	0	0	0	113.3	L618 P619 E620 G625 T626 W628 T629	L618-L623 HydrophobicContact CB-CD1 3.93Å; P619-L623 WeakPolarHBondContact O-CD1 3.35Å; E620-L623 PolarHBondContact O-N 2.84Å; L623-G625 PolarHBondContact O-N 2.9Å; L623-T626 WeakPolarHBondContact O-CB 3.44Å; L623-T626 PolarHBondContact O-N 3.22Å; L623-T626 PolarHBondContact O-OG1 3.41Å; L623-W628 HydrophobicContact CD2-CB 3.79Å; L623-W628 HydrophobicContact CG-CB 4Å; L623-T629 PolarHBondContact O-OG1 3.4Å
624	E	81.5	Confident	81.7	Confident	188 Å²	188	104 Å²	104	88%	0.879	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	132.5	-177.1	-172.1	170.4	-157.6	0	0	111.7	T626	E624-T626 PolarHBondContact O-N 3.45Å
625	G	81.1	Confident	82.1	Confident	81 Å²	81	105.8 Å²	105.8	84%	0.835	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.3	5.9	-175.3	0	0	0	0	0	115.1	L623	L623-G625 PolarHBondContact O-N 2.9Å
626	T	89.7	Confident	82.2	Confident	43 Å²	43	101.6 Å²	101.6	26%	0.264	54%	0.54	S	S	.	.	S	Bend	trans	-104.1	161.5	174.4	76.9	0	0	0	0	112	K622 L623 E624 W628 T629	K622-T626 VanDerWaalsContact O-CG2 3.29Å; K622-T626 WeakPolarHBondContact O-CG2 3.49Å; L623-T626 WeakPolarHBondContact O-CB 3.44Å; L623-T626 PolarHBondContact O-N 3.22Å; L623-T626 PolarHBondContact O-OG1 3.41Å; E624-T626 PolarHBondContact O-N 3.45Å; T626-W628 PolarHBondContact O-N 2.97Å; T626-W628 PolarHBondContact OG1-N 2.56Å; T626-T629 VanDerWaalsContact O-CB 3.29Å; T626-T629 WeakPolarHBondContact O-CB 3.19Å; T626-T629 PolarHBondContact O-N 3.4Å; T626-T629 PolarHBondContact O-OG1 2.98Å
627	V	84	Confident	82.4	Confident	82 Å²	82	99 Å²	99	50%	0.497	51%	0.513	S	S	.	.	G	3₁₀ helix	trans	-54.1	-23.2	176.9	71	0	0	0	0	113.9	T629 E630 I631	V627-T629 PolarHBondContact O-N 2.92Å; V627-E630 PolarHBondContact O-N 2.83Å; V627-I631 HydrophobicContact CG1-CD1 4.32Å; V627-I631 HydrophobicContact CG2-CD1 3.96Å; V627-I631 HydrophobicContact CG2-CG1 4.41Å; V627-I631 PolarHBondContact O-N 3.11Å
628	W	86.4	Confident	82.4	Confident	131 Å²	131	99.3 Å²	99.3	50%	0.496	52%	0.515	S	S	.	.	G	3₁₀ helix	trans	-68.2	-10.1	175.4	-54.2	107.6	0	0	0	113.7	L618 L623 T626 E630 I631	L618-W628 VanDerWaalsContact CD1-NE1 3.29Å; L623-W628 HydrophobicContact CD2-CB 3.79Å; L623-W628 HydrophobicContact CG-CB 4Å; T626-W628 PolarHBondContact O-N 2.97Å; T626-W628 PolarHBondContact OG1-N 2.56Å; W628-E630 VanDerWaalsContact C-N 3.32Å; W628-I631 HydrophobicContact CE3-CB 4.44Å; W628-I631 HydrophobicContact CE3-CD1 4.03Å; W628-I631 HydrophobicContact CE3-CG2 4.45Å; W628-I631 HydrophobicContact CZ3-CD1 4.13Å
629	T	82.6	Confident	82.5	Confident	97 Å²	97	102.2 Å²	102.2	60%	0.595	53%	0.529	S	S	*	.	G	3₁₀ helix	trans	-73	-26.1	168.8	-40.4	0	0	0	0	111.9	L623 T626 V627	L623-T629 PolarHBondContact O-OG1 3.4Å; T626-T629 VanDerWaalsContact O-CB 3.29Å; T626-T629 WeakPolarHBondContact O-CB 3.19Å; T626-T629 PolarHBondContact O-N 3.4Å; T626-T629 PolarHBondContact O-OG1 2.98Å; V627-T629 PolarHBondContact O-N 2.92Å
630	E	82.8	Confident	82.5	Confident	160 Å²	160	103.2 Å²	103.2	75%	0.748	53%	0.531	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.1	-21.2	-175.5	-63.1	170.7	-127.5	0	0	112.6	V627 W628	V627-E630 PolarHBondContact O-N 2.83Å; W628-E630 VanDerWaalsContact C-N 3.32Å
631	I	83.8	Confident	82.7	Confident	87 Å²	87	101 Å²	101	45%	0.446	52%	0.523	S	S	.	.			trans	-88.1	131.8	-178.6	-64.3	171.2	0	0	0	111.1	V627 W628	V627-I631 HydrophobicContact CG1-CD1 4.32Å; V627-I631 HydrophobicContact CG2-CD1 3.96Å; V627-I631 HydrophobicContact CG2-CG1 4.41Å; V627-I631 PolarHBondContact O-N 3.11Å; W628-I631 HydrophobicContact CE3-CB 4.44Å; W628-I631 HydrophobicContact CE3-CD1 4.03Å; W628-I631 HydrophobicContact CE3-CG2 4.45Å; W628-I631 HydrophobicContact CZ3-CD1 4.13Å
632	D	82.4	Confident	82.8	Confident	48 Å²	48	97 Å²	97	26%	0.257	50%	0.502	S	S	.	.			trans	-132.1	106.7	177.8	170.9	22.3	0	0	0	110.9	T634 K635	D632-T634 VanDerWaalsContact C-N 3.26Å; D632-T634 VanDerWaalsContact CG-OG1 3.31Å; D632-T634 PolarHBondContact O-N 2.95Å; D632-T634 WeakPolarHBondContact OD1-CB 3.24Å; D632-T634 PolarHBondContact OD1-N 3.28Å; D632-T634 PolarHBondContact OD1-OG1 3.42Å; D632-T634 PolarHBondContact OD2-OG1 3.46Å; D632-K635 HydrophobicContact CB-CD 4.02Å; D632-K635 PolarHBondContact O-N 3.27Å; D632-K635 WeakPolarHBondContact OD2-CE 3.46Å; D632-K635 IonicContact OD2-NZ 3.6Å; D632-K635 PolarHBondContact OD2-NZ 2.96Å
633	D	79.9	Confident	82.8	Confident	48 Å²	48	98.4 Å²	98.4	26%	0.257	51%	0.51	S	S	.	.	G	3₁₀ helix	trans	-61.5	-27.6	178.2	55.1	-60.2	0	0	0	113.5	K601 K635 V636 F637	K601-D633 IonicContact NZ-OD1 3.85Å; K601-D633 PolarHBondContact NZ-OD1 3.41Å; D633-K635 PolarHBondContact O-N 3.1Å; D633-K635 VanDerWaalsContact O-N 3.1Å; D633-V636 WeakPolarHBondContact O-CB 3.4Å; D633-V636 PolarHBondContact O-N 2.95Å; D633-F637 HydrophobicContact CB-CE2 4.08Å; D633-F637 WeakPolarHBondContact O-CD2 3.46Å; D633-F637 PolarHBondContact O-N 2.91Å
634	T	80.8	Confident	82.8	Confident	44 Å²	44	98.9 Å²	98.9	27%	0.27	51%	0.513	S	S	.	.	G	3₁₀ helix	trans	-68.2	-13.4	-177.7	73.1	0	0	0	0	113.7	K601 D632 K638	K601-T634 HydrophobicContact CD-CG2 4.29Å; D632-T634 VanDerWaalsContact C-N 3.26Å; D632-T634 VanDerWaalsContact CG-OG1 3.31Å; D632-T634 PolarHBondContact O-N 2.95Å; D632-T634 WeakPolarHBondContact OD1-CB 3.24Å; D632-T634 PolarHBondContact OD1-N 3.28Å; D632-T634 PolarHBondContact OD1-OG1 3.42Å; D632-T634 PolarHBondContact OD2-OG1 3.46Å; T634-K638 WeakPolarHBondContact O-CE 3.33Å
635	K	81.9	Confident	82.6	Confident	123 Å²	123	93.3 Å²	93.3	54%	0.535	49%	0.489	S	S	.	.	G	3₁₀ helix	trans	-78.1	-34.5	169.9	-64.9	162	-176.8	155.2	0	111.9	D632 D633	D632-K635 HydrophobicContact CB-CD 4.02Å; D632-K635 PolarHBondContact O-N 3.27Å; D632-K635 WeakPolarHBondContact OD2-CE 3.46Å; D632-K635 IonicContact OD2-NZ 3.6Å; D632-K635 PolarHBondContact OD2-NZ 2.96Å; D633-K635 PolarHBondContact O-N 3.1Å; D633-K635 VanDerWaalsContact O-N 3.1Å
636	V	81.9	Confident	82.7	Confident	75 Å²	75	90.9 Å²	90.9	46%	0.455	46%	0.456	S	S	.	.	G	3₁₀ helix	trans	-76.5	-39.7	-173.7	-173.4	0	0	0	0	111.3	D633 K638 I639 L640	D633-V636 WeakPolarHBondContact O-CB 3.4Å; D633-V636 PolarHBondContact O-N 2.95Å; V636-K638 PolarHBondContact O-N 3.37Å; V636-I639 PolarHBondContact O-N 2.67Å; V636-L640 HydrophobicContact CG1-CD1 3.78Å; V636-L640 HydrophobicContact CG1-CG 3.95Å; V636-L640 PolarHBondContact O-N 2.97Å; V636-L640 VanDerWaalsContact O-N 3.1Å
637	F	80.8	Confident	82.3	Confident	71 Å²	71	97.9 Å²	97.9	31%	0.311	48%	0.478	S	S	.	.	G	3₁₀ helix	trans	-61.5	-7.5	175	-67.8	-69.8	0	0	0	114.9	I603 P604 D633 L642	I603-F637 HydrophobicContact CG2-CD2 4.43Å; I603-F637 HydrophobicContact CG2-CE1 4.38Å; I603-F637 HydrophobicContact CG2-CE2 3.76Å; I603-F637 HydrophobicContact CG2-CZ 3.74Å; P604-F637 HydrophobicContact CG-CB 4.17Å; P604-F637 HydrophobicContact CG-CD1 4.01Å; P604-F637 HydrophobicContact CG-CG 4.11Å; D633-F637 HydrophobicContact CB-CE2 4.08Å; D633-F637 WeakPolarHBondContact O-CD2 3.46Å; D633-F637 PolarHBondContact O-N 2.91Å; F637-L642 HydrophobicContact CD1-CD2 4.14Å
638	K	80.7	Confident	82.2	Confident	178 Å²	178	97.6 Å²	97.6	77%	0.774	48%	0.476	S	S	*	.	G	3₁₀ helix	trans	-97.1	-3.8	175	-59.9	178.5	-174.5	175.7	0	113.6	T634 V636	T634-K638 WeakPolarHBondContact O-CE 3.33Å; V636-K638 PolarHBondContact O-N 3.37Å
639	I	82.4	Confident	81.9	Confident	146 Å²	146	96.6 Å²	96.6	75%	0.749	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	-122.1	-32.6	-173.6	-54.4	174	0	0	0	110.7	V636	V636-I639 PolarHBondContact O-N 2.67Å
640	L	82.1	Confident	81.9	Confident	89 Å²	89	93.1 Å²	93.1	47%	0.466	46%	0.455	S	S	.	.	S	Bend	trans	-69.1	137.5	174.5	-71.3	175.9	0	0	0	112.2	V636 L642	V636-L640 HydrophobicContact CG1-CD1 3.78Å; V636-L640 HydrophobicContact CG1-CG 3.95Å; V636-L640 PolarHBondContact O-N 2.97Å; V636-L640 VanDerWaalsContact O-N 3.1Å; L640-L642 HydrophobicContact CB-CD2 3.92Å; L640-L642 PolarHBondContact O-N 3.05Å
641	D	84.9	Confident	81.4	Confident	105 Å²	105	85.5 Å²	85.5	56%	0.561	42%	0.419	S	S	*	.			trans	-70.9	106.2	159.1	-172.5	-26.9	0	0	0	108.4	E643 D644 L645	D641-E643 PolarHBondContact OD1-N 3.31Å; D641-D644 HydrophobicContact CB-CB 4.35Å; D641-D644 PolarHBondContact OD1-N 3.27Å; D641-L645 WeakPolarHBondContact O-CB 3.22Å; D641-L645 PolarHBondContact O-N 3.26Å
642	L	84.1	Confident	81	Confident	57 Å²	57	84.6 Å²	84.6	30%	0.298	41%	0.411	S	S	.	.	H	α-helix	trans	-79.1	-24	-179.8	-55.7	-177.1	0	0	0	112	P604 F637 L640 E646	P604-L642 HydrophobicContact CB-CD1 4.47Å; P604-L642 HydrophobicContact CG-CD1 4.13Å; F637-L642 HydrophobicContact CD1-CD2 4.14Å; L640-L642 HydrophobicContact CB-CD2 3.92Å; L640-L642 PolarHBondContact O-N 3.05Å; L642-E646 WeakPolarHBondContact O-CB 3.44Å; L642-E646 WeakPolarHBondContact O-CG 3.5Å; L642-E646 PolarHBondContact O-N 2.92Å
643	E	81.4	Confident	80.3	Confident	163 Å²	163	85.3 Å²	85.3	76%	0.762	41%	0.413	S	S	*	.	H	α-helix	trans	-76.7	-40.4	-179.4	-169.7	174.7	174.7	0	0	110.7	D641 L645 E646 R647	D641-E643 PolarHBondContact OD1-N 3.31Å; E643-L645 VanDerWaalsContact C-N 3.34Å; E643-E646 PolarHBondContact O-N 3.49Å; E643-R647 WeakPolarHBondContact O-CB 3.06Å; E643-R647 PolarHBondContact O-N 2.97Å
644	D	83.1	Confident	79.4	Confident	61 Å²	61	94 Å²	94	33%	0.326	44%	0.442	S	S	.	.	H	α-helix	trans	-68.5	-33.9	171.7	-168.9	47.2	0	0	0	112.7	D641 R647 T648	D641-D644 HydrophobicContact CB-CB 4.35Å; D641-D644 PolarHBondContact OD1-N 3.27Å; D644-R647 PolarHBondContact O-N 3.34Å; D644-R647 IonicContact OD1-CZ 2.77Å; D644-R647 VanDerWaalsContact OD1-CZ 3.22Å; D644-R647 IonicContact OD1-NE 2.82Å; D644-R647 PolarHBondContact OD1-NE 2.67Å; D644-R647 IonicContact OD1-NH2 2.66Å; D644-R647 PolarHBondContact OD1-NH2 2.96Å; D644-T648 WeakPolarHBondContact O-CB 3.41Å; D644-T648 PolarHBondContact O-N 2.67Å; D644-T648 PolarHBondContact O-OG1 3.26Å; D644-T648 PolarHBondContact OD1-OG1 2.89Å
645	L	78.8	Confident	78	Confident	71 Å²	71	96.6 Å²	96.6	37%	0.372	45%	0.451	S	S	.	.	H	α-helix	trans	-64.5	-47.2	172.7	-170.1	73.9	0	0	0	111.3	D641 E643 R647 T648 F649	D641-L645 WeakPolarHBondContact O-CB 3.22Å; D641-L645 PolarHBondContact O-N 3.26Å; E643-L645 VanDerWaalsContact C-N 3.34Å; L645-R647 VanDerWaalsContact C-N 3.33Å; L645-R647 PolarHBondContact O-N 2.69Å; L645-T648 PolarHBondContact O-N 3.18Å; L645-F649 HydrophobicContact CD1-CD2 3.77Å; L645-F649 HydrophobicContact CD1-CE2 4Å; L645-F649 HydrophobicContact CG-CD2 4.48Å; L645-F649 PolarHBondContact O-N 2.99Å
646	E	82.8	Confident	76.7	Confident	29 Å²	29	96.6 Å²	96.6	14%	0.136	45%	0.453	C	S	.	.	H	α-helix	trans	-58.9	-44.9	174.6	-82.5	-161.7	-132.4	0	0	111.6	P606 T607 N608 L610 L642 E643 S650	P606-E646 WeakPolarHBondContact CA-OE1 3.22Å; P606-E646 HydrophobicContact CB-CG 3.79Å; T607-E646 WeakPolarHBondContact CB-OE2 3.42Å; T607-E646 PolarHBondContact N-OE1 2.95Å; T607-E646 PolarHBondContact N-OE2 3.34Å; T607-E646 VanDerWaalsContact N-OE2 3.1Å; T607-E646 PolarHBondContact OG1-OE1 3.02Å; T607-E646 VanDerWaalsContact OG1-OE1 3.1Å; N608-E646 PolarHBondContact N-OE2 2.62Å; N608-E646 PolarHBondContact ND2-OE2 3.38Å; N608-E646 VanDerWaalsContact ND2-OE2 3.13Å; L610-E646 HydrophobicContact CD1-CG 4.25Å; L610-E646 HydrophobicContact CD2-CB 4.07Å; L610-E646 HydrophobicContact CD2-CG 4.06Å; L610-E646 WeakPolarHBondContact CD2-O 3.29Å; L642-E646 WeakPolarHBondContact O-CB 3.44Å; L642-E646 WeakPolarHBondContact O-CG 3.5Å; L642-E646 PolarHBondContact O-N 2.92Å; E643-E646 PolarHBondContact O-N 3.49Å; E646-S650 WeakPolarHBondContact O-CA 3.3Å; E646-S650 WeakPolarHBondContact O-CB 3.48Å; E646-S650 PolarHBondContact O-N 3.48Å; E646-S650 VanDerWaalsContact O-N 3.1Å
647	R	80.6	Confident	74.8	Confident	191 Å²	191	99.5 Å²	99.5	72%	0.721	47%	0.466	S	S	*	.	H	α-helix	trans	-64.5	-43.9	-179.8	-177.7	178.2	72.4	160.5	2.3	112.6	E643 D644 L645	E643-R647 WeakPolarHBondContact O-CB 3.06Å; E643-R647 PolarHBondContact O-N 2.97Å; D644-R647 PolarHBondContact O-N 3.34Å; D644-R647 IonicContact OD1-CZ 2.77Å; D644-R647 VanDerWaalsContact OD1-CZ 3.22Å; D644-R647 IonicContact OD1-NE 2.82Å; D644-R647 PolarHBondContact OD1-NE 2.67Å; D644-R647 IonicContact OD1-NH2 2.66Å; D644-R647 PolarHBondContact OD1-NH2 2.96Å; L645-R647 VanDerWaalsContact C-N 3.33Å; L645-R647 PolarHBondContact O-N 2.69Å
648	T	81.4	Confident	73.1	Confident	75 Å²	75	104.7 Å²	104.7	46%	0.46	49%	0.489	S	S	.	.	H	α-helix	trans	-76.8	-35.8	-173.7	-63.1	0	0	0	0	112.2	D644 L645	D644-T648 WeakPolarHBondContact O-CB 3.41Å; D644-T648 PolarHBondContact O-N 2.67Å; D644-T648 PolarHBondContact O-OG1 3.26Å; D644-T648 PolarHBondContact OD1-OG1 2.89Å; L645-T648 PolarHBondContact O-N 3.18Å
649	F	81.1	Confident	71.2	Confident	111 Å²	111	105 Å²	105	49%	0.487	49%	0.49	S	S	.	.	S	Bend	trans	-111.2	23.5	-176.7	-62.5	-81.1	0	0	0	113.9	L610 K611 L645 A651	L610-F649 CarbonylContact C-O 3.58Å; L610-F649 WeakPolarHBondContact CA-O 2.82Å; K611-F649 WeakPolarHBondContact CG-O 3.33Å; K611-F649 PolarHBondContact N-O 3.28Å; L645-F649 HydrophobicContact CD1-CD2 3.77Å; L645-F649 HydrophobicContact CD1-CE2 4Å; L645-F649 HydrophobicContact CG-CD2 4.48Å; L645-F649 PolarHBondContact O-N 2.99Å; F649-A651 PolarHBondContact O-N 3.24Å
650	S	82.4	Confident	68.8	Low	24 Å²	24	104.8 Å²	104.8	17%	0.168	50%	0.496	C	S	.	.	B	Isolated β-bridge	trans	-56.3	139.6	176.4	-169.4	0	0	0	0	112.6	E646 Y652	E646-S650 WeakPolarHBondContact O-CA 3.3Å; E646-S650 WeakPolarHBondContact O-CB 3.48Å; E646-S650 PolarHBondContact O-N 3.48Å; E646-S650 VanDerWaalsContact O-N 3.1Å; S650-Y652 PolarHBondContact O-N 2.92Å; S650-Y652 PolarHBondContact OG-N 2.94Å
651	A	73.1	Confident	66.4	Low	0 Å²	0	107.6 Å²	107.6	0%	0	51%	0.511	C	S	.	.	S	Bend	trans	-65.6	-24.7	173.2	0	0	0	0	0	112.2	A609 F649 L685 S686 V687	A609-A651 HydrophobicContact CB-CB 4.13Å; A609-A651 WeakPolarHBondContact O-CB 3.34Å; A609-A651 PolarHBondContact O-N 3.18Å; F649-A651 PolarHBondContact O-N 3.24Å; A651-L685 HydrophobicContact CB-CD1 3.65Å; A651-L685 WeakPolarHBondContact O-CA 3.27Å; A651-S686 PolarHBondContact O-N 2.95Å; A651-V687 HydrophobicContact CB-CG2 4.33Å
652	Y	75.4	Confident	63.9	Low	67 Å²	67	108.4 Å²	108.4	26%	0.263	53%	0.525	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	106.6	179.9	-61.5	-75.1	0	0	0	112	A609 S650 K683 E684 L685 E750	A609-Y652 HydrophobicContact CB-CE2 4.47Å; S650-Y652 PolarHBondContact O-N 2.92Å; S650-Y652 PolarHBondContact OG-N 2.94Å; Y652-K683 HydrophobicContact CD1-CB 4.48Å; Y652-E684 WeakPolarHBondContact CA-O 3.48Å; Y652-L685 HydrophobicContact CD1-CB 4.38Å; Y652-L685 HydrophobicContact CD1-CD1 3.97Å; Y652-L685 HydrophobicContact CE1-CB 4.41Å; Y652-L685 HydrophobicContact CE1-CD1 3.71Å; Y652-L685 HydrophobicContact CG-CD1 4.49Å; Y652-E750 WeakPolarHBondContact CE1-OE2 3.45Å; Y652-E750 PolarHBondContact OH-OE1 3.46Å; Y652-E750 PolarHBondContact OH-OE2 3.28Å
653	Q	66.1	Low	61.5	Low	63 Å²	63	113.3 Å²	113.3	29%	0.294	55%	0.551	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-112.6	171.3	-179	-58.6	-164.9	-48.8	0	0	111.8	K683 E684	Q653-K683 CarbonylContact O-C 3.58Å; Q653-K683 WeakPolarHBondContact O-CA 3.49Å; Q653-E684 PolarHBondContact N-O 3.33Å; Q653-E684 PolarHBondContact O-N 2.87Å
654	R	62.6	Low	59	Low	230 Å²	230	111.1 Å²	111.1	87%	0.868	55%	0.554	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-73.1	144.6	166.8	-54.4	179.9	-164.1	166.8	5.7	107.8	Q656	R654-Q656 PolarHBondContact O-N 3.45Å
655	Q	51.4	Low	56.8	Low	99 Å²	99	117.8 Å²	117.8	46%	0.463	58%	0.58	S	S	.	*			trans	-47	127.7	179.5	-69	172.5	-94	0	0	111.9	D657 E684	Q655-D657 VanDerWaalsContact C-N 3.31Å; Q655-D657 PolarHBondContact O-N 3.13Å; Q655-D657 VanDerWaalsContact O-N 3.13Å; Q655-E684 WeakPolarHBondContact CA-OE2 3.02Å; Q655-E684 HydrophobicContact CG-CB 4.44Å
656	Q	53.7	Low	54.6	Low	124 Å²	124	123.3 Å²	123.3	58%	0.579	60%	0.604	S	S	*	*			trans	-87.1	70.8	177.5	-63.6	-166.5	15.6	0	0	110.9	R654 F658 E684	R654-Q656 PolarHBondContact O-N 3.45Å; Q656-F658 PolarHBondContact O-N 3.34Å; Q656-E684 PolarHBondContact N-OE2 2.92Å
657	D	41.8	Very low	52.1	Low	136 Å²	136	131.6 Å²	131.6	73%	0.727	64%	0.64	S	S	*	*			trans	-64.5	88.5	179.3	-72.2	-40	0	0	0	112.3	Q655	Q655-D657 VanDerWaalsContact C-N 3.31Å; Q655-D657 PolarHBondContact O-N 3.13Å; Q655-D657 VanDerWaalsContact O-N 3.13Å
658	F	45.3	Very low	50.1	Low	179 Å²	179	132 Å²	132	79%	0.785	65%	0.65	S	S	*	*			trans	-127	95.5	171.7	-92.4	-85.3	0	0	0	111.3	Q656	Q656-F658 PolarHBondContact O-N 3.34Å
659	F	40.4	Very low	47.7	Very low	185 Å²	185	132.4 Å²	132.4	81%	0.811	66%	0.66	S	S	*	*			trans	-179.9	68.7	133.3	-90.8	-58.1	0	0	0	110.5
660	V	32.8	Very low	45.2	Very low	142 Å²	142	134.5 Å²	134.5	86%	0.861	68%	0.677	S	S	*	*			trans	-106.1	122.8	163.9	-179.8	0	0	0	0	108.4
661	N	31	Very low	43.3	Very low	148 Å²	148	137.7 Å²	137.7	79%	0.791	71%	0.705	S	S	*	*			trans	-64.7	134.2	-178.4	-82.2	-25.5	0	0	0	112	N663	N661-N663 VanDerWaalsContact C-N 3.3Å; N661-N663 PolarHBondContact O-N 3.19Å
662	S	32.3	Very low	41.9	Very low	121 Å²	121	146 Å²	146	85%	0.846	75%	0.747	S	S	*	*	S	Bend	trans	-71.7	80.7	165.6	-51.7	0	0	0	0	110.9
663	N	33.1	Very low	40.1	Very low	160 Å²	160	149.1 Å²	149.1	86%	0.856	77%	0.769	S	S	*	*			trans	-163.2	74.1	164.5	-108.5	-22.1	0	0	0	114.2	N661	N661-N663 VanDerWaalsContact C-N 3.3Å; N661-N663 PolarHBondContact O-N 3.19Å
664	S	30.8	Very low	38.4	Very low	117 Å²	117	151.5 Å²	151.5	82%	0.818	78%	0.783	S	S	*	*			trans	-153.9	119	157.7	46.7	0	0	0	0	111.1
665	K	36.8	Very low	37.4	Very low	201 Å²	201	146.3 Å²	146.3	87%	0.874	78%	0.777	S	S	*	*			trans	-96.3	155.2	163.2	-77.5	-176.2	174	-178.9	0	108.8
666	Q	32.4	Very low	36.9	Very low	188 Å²	188	149 Å²	149	88%	0.879	79%	0.794	S	S	*	*			trans	78.2	116.6	-176.7	-50.7	176.8	-19.5	0	0	112.9
667	K	29.6	Very low	36.2	Very low	203 Å²	203	146.9 Å²	146.9	88%	0.883	79%	0.793	S	S	*	*			cis	-145.9	157.7	40.2	-75.1	173.8	170.6	177.9	0	113
668	E	37.7	Very low	35.9	Very low	199 Å²	199	145 Å²	145	93%	0.93	79%	0.79	S	S	*	*			trans	-87.7	133.1	158.2	-63.2	170.1	125.8	0	0	109.4
669	A	31.6	Very low	35.6	Very low	83 Å²	83	145.7 Å²	145.7	69%	0.686	79%	0.793	S	S	*	*			trans	-170	156.6	155	0	0	0	0	0	109.2
670	D	28.8	Very low	35.9	Very low	155 Å²	155	145 Å²	145	83%	0.829	80%	0.797	S	S	*	*			trans	53.6	80.9	154.4	-50.6	-22.1	0	0	0	117.8
671	A	43	Very low	36.6	Very low	91 Å²	91	146.5 Å²	146.5	75%	0.752	79%	0.792	S	S	*	*			trans	-67.2	165.2	138.9	0	0	0	0	0	109.9
672	I	44.3	Very low	37.7	Very low	176 Å²	176	143.7 Å²	143.7	90%	0.903	78%	0.78	S	S	*	*			trans	82.7	68.5	-175.6	-42.3	160.6	0	0	0	114
673	D	36.3	Very low	39	Very low	132 Å²	132	144.5 Å²	144.5	71%	0.706	77%	0.768	S	S	*	*				176.9	108.3	108.7	-176.6	26.9	0	0	0	111.8
674	D	31.9	Very low	41.1	Very low	113 Å²	113	139.1 Å²	139.1	60%	0.604	74%	0.738	S	S	*	*			trans	-155.5	55.9	157.1	-167.3	15.9	0	0	0	111.6	S677	D674-S677 WeakPolarHBondContact OD1-CB 3.42Å; D674-S677 PolarHBondContact OD1-N 3Å; D674-S677 PolarHBondContact OD1-OG 3.46Å
675	T	40.4	Very low	43.5	Very low	121 Å²	121	133.6 Å²	133.6	74%	0.742	70%	0.699	S	S	*	*	S	Bend	trans	-91.3	-0.6	178.8	-45.4	0	0	0	0	112.6
676	L	42.1	Very low	45.9	Very low	154 Å²	154	124.6 Å²	124.6	81%	0.806	66%	0.662	S	S	*	*	S	Bend	trans	-128.8	-12	-168.1	-69.4	173.9	0	0	0	116.4	S678	L676-S678 VanDerWaalsContact C-N 3.34Å; L676-S678 PolarHBondContact O-N 3.03Å
677	S	37.1	Very low	48.3	Very low	81 Å²	81	115.7 Å²	115.7	57%	0.566	62%	0.62	S	S	*	*			trans	-85.3	0.9	-174.6	-42.7	0	0	0	0	115.1	D674 K679	D674-S677 WeakPolarHBondContact OD1-CB 3.42Å; D674-S677 PolarHBondContact OD1-N 3Å; D674-S677 PolarHBondContact OD1-OG 3.46Å; S677-K679 VanDerWaalsContact C-N 3.26Å; S677-K679 PolarHBondContact O-N 3.04Å; S677-K679 VanDerWaalsContact O-N 3.1Å
678	S	36	Very low	51.1	Low	96 Å²	96	106.1 Å²	106.1	67%	0.671	58%	0.578	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.9	3.6	-166	57.6	0	0	0	0	116.5	L676	L676-S678 VanDerWaalsContact C-N 3.34Å; L676-S678 PolarHBondContact O-N 3.03Å
679	K	39.1	Very low	53.4	Low	194 Å²	194	98.6 Å²	98.6	84%	0.843	54%	0.544	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.1	-2.8	-171.6	-75.1	-171.8	175.1	179.9	0	117	S677	S677-K679 VanDerWaalsContact C-N 3.26Å; S677-K679 PolarHBondContact O-N 3.04Å; S677-K679 VanDerWaalsContact O-N 3.1Å
680	L	47.8	Very low	55.9	Low	169 Å²	169	97.4 Å²	97.4	89%	0.885	54%	0.54	S	S	*	.			trans	-131.6	75.9	176.2	-74.6	177.2	0	0	0	111.4
681	K	46	Very low	58.7	Low	175 Å²	175	99.7 Å²	99.7	76%	0.761	54%	0.537	S	S	*	.			trans	-118.4	124.7	165.7	-63.8	-164	176.5	-169.2	0	109.1
682	V	53.9	Low	60.8	Low	88 Å²	88	96.8 Å²	96.8	53%	0.533	51%	0.507	S	S	.	.	P	Polyproline II helix	trans	-71.3	140.2	-173.4	-177.1	0	0	0	0	109.2
683	K	60.8	Low	62.9	Low	138 Å²	138	88.8 Å²	88.8	60%	0.6	47%	0.467	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.4	132.5	172.8	-60.9	-172.2	-174.1	-179.6	0	109.5	Y652 Q653	Y652-K683 HydrophobicContact CD1-CB 4.48Å; Q653-K683 CarbonylContact O-C 3.58Å; Q653-K683 WeakPolarHBondContact O-CA 3.49Å
684	E	76.6	Confident	65.3	Low	48 Å²	48	87.7 Å²	87.7	22%	0.224	46%	0.458	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	131.9	175.4	-176.1	177.8	-167.3	0	0	108.9	Y652 Q653 Q655 Q656 A755	Y652-E684 WeakPolarHBondContact CA-O 3.48Å; Q653-E684 PolarHBondContact N-O 3.33Å; Q653-E684 PolarHBondContact O-N 2.87Å; Q655-E684 WeakPolarHBondContact CA-OE2 3.02Å; Q655-E684 HydrophobicContact CG-CB 4.44Å; Q656-E684 PolarHBondContact N-OE2 2.92Å; E684-A755 HydrophobicContact CG-CB 3.94Å; E684-A755 VanDerWaalsContact OE1-CA 3.27Å; E684-A755 WeakPolarHBondContact OE1-CA 3.35Å; E684-A755 VanDerWaalsContact OE1-CB 3.28Å; E684-A755 WeakPolarHBondContact OE1-CB 3.35Å
685	L	81.2	Confident	68.1	Low	1 Å²	1	85.3 Å²	85.3	1%	0.005	45%	0.445	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	119	178.5	177.6	83	0	0	0	109.7	A651 Y652 V687 H747 E750 R753 M754 A755	A651-L685 HydrophobicContact CB-CD1 3.65Å; A651-L685 WeakPolarHBondContact O-CA 3.27Å; Y652-L685 HydrophobicContact CD1-CB 4.38Å; Y652-L685 HydrophobicContact CD1-CD1 3.97Å; Y652-L685 HydrophobicContact CE1-CB 4.41Å; Y652-L685 HydrophobicContact CE1-CD1 3.71Å; Y652-L685 HydrophobicContact CG-CD1 4.49Å; L685-V687 HydrophobicContact CD1-CG2 4.17Å; L685-V687 HydrophobicContact CD2-CG2 4.18Å; L685-V687 HydrophobicContact CG-CG2 3.97Å; L685-H747 HydrophobicContact CD2-CB 3.64Å; L685-H747 VanDerWaalsContact CD2-ND1 3.35Å; L685-H747 WeakPolarHBondContact CD2-ND1 3.39Å; L685-E750 HydrophobicContact CD2-CG 4.15Å; L685-R753 PolarHBondContact N-O 3.44Å; L685-M754 HydrophobicContact CD2-CG 4.06Å; L685-M754 CarbonylContact O-C 3.59Å; L685-M754 WeakPolarHBondContact O-CA 3.27Å; L685-A755 WeakPolarHBondContact O-CB 3.48Å; L685-A755 PolarHBondContact O-N 3.17Å
686	S	86.6	Confident	70.5	Confident	12 Å²	12	79.5 Å²	79.5	8%	0.084	41%	0.41	C	S	.	.			trans	-136.2	115.4	174.7	167.1	0	0	0	0	109.8	K611 A651	K611-S686 VanDerWaalsContact CD-O 3.22Å; K611-S686 WeakPolarHBondContact CD-O 3.37Å; K611-S686 WeakPolarHBondContact CE-O 3.45Å; K611-S686 VanDerWaalsContact NZ-CB 3.26Å; K611-S686 PolarHBondContact NZ-O 2.86Å; K611-S686 PolarHBondContact NZ-OG 3.02Å; A651-S686 PolarHBondContact O-N 2.95Å
687	V	84.4	Confident	72.8	Confident	1 Å²	1	74.8 Å²	74.8	1%	0.006	39%	0.385	C	S	.	.			trans	-113.2	-31.4	-172.6	-150.7	0	0	0	0	111.2	L610 S612 A651 L685 L743 D758	L610-V687 WeakPolarHBondContact O-CG1 3.39Å; S612-V687 WeakPolarHBondContact CB-O 3.21Å; S612-V687 PolarHBondContact N-O 3.4Å; S612-V687 PolarHBondContact OG-O 3.4Å; A651-V687 HydrophobicContact CB-CG2 4.33Å; L685-V687 HydrophobicContact CD1-CG2 4.17Å; L685-V687 HydrophobicContact CD2-CG2 4.18Å; L685-V687 HydrophobicContact CG-CG2 3.97Å; V687-L743 HydrophobicContact CB-CD2 4.21Å; V687-L743 HydrophobicContact CB-CG 4.43Å; V687-L743 HydrophobicContact CG1-CD1 3.76Å; V687-L743 HydrophobicContact CG1-CD2 3.86Å; V687-L743 HydrophobicContact CG1-CG 3.84Å; V687-D758 PolarHBondContact N-OD1 3.45Å
688	I	88.4	Confident	75.4	Confident	1 Å²	1	74 Å²	74	1%	0.005	37%	0.374	C	S	.	.	S	Bend	trans	-65.4	147.3	174.4	-62.9	-68.6	0	0	0	110.9	R692 A693 D740 L743 L744 D758 L761	I688-R692 HydrophobicContact CG2-CB 3.94Å; I688-R692 HydrophobicContact CG2-CG 4.07Å; I688-A693 HydrophobicContact CG2-CB 4.25Å; I688-D740 HydrophobicContact CD1-CB 3.94Å; I688-L743 HydrophobicContact CD1-CD2 4.42Å; I688-L744 HydrophobicContact CD1-CD1 4.21Å; I688-L744 HydrophobicContact CD1-CG 4.47Å; I688-L744 HydrophobicContact CG1-CD1 4.44Å; I688-L744 HydrophobicContact CG1-CD2 4.37Å; I688-D758 WeakPolarHBondContact CB-OD1 3.32Å; I688-D758 HydrophobicContact CG1-CB 4.37Å; I688-D758 WeakPolarHBondContact CG1-OD1 3.32Å; I688-D758 PolarHBondContact N-OD1 2.88Å; I688-L761 HydrophobicContact CD1-CD1 4.05Å; I688-L761 HydrophobicContact CG1-CD1 4.11Å; I688-L761 HydrophobicContact CG2-CD1 4.29Å
689	D	86.1	Confident	78	Confident	41 Å²	41	69.8 Å²	69.8	22%	0.219	34%	0.344	C	S	.	.			trans	-62.1	144.6	-179.2	87.4	-111.4	0	0	0	112.4	N614 R691 R692 A693	N614-D689 HydrophobicContact CB-CB 4.26Å; N614-D689 PolarHBondContact ND2-OD1 2.87Å; D689-R691 PolarHBondContact O-N 2.82Å; D689-R691 VanDerWaalsContact O-N 3.12Å; D689-R691 WeakPolarHBondContact OD2-CA 3.44Å; D689-R691 WeakPolarHBondContact OD2-CB 3.47Å; D689-R691 PolarHBondContact OD2-N 2.91Å; D689-R692 PolarHBondContact O-N 2.82Å; D689-R692 WeakPolarHBondContact OD1-CB 3.3Å; D689-R692 PolarHBondContact OD2-N 2.87Å; D689-A693 VanDerWaalsContact O-CB 3.31Å; D689-A693 WeakPolarHBondContact O-CB 3.16Å; D689-A693 PolarHBondContact O-N 3.33Å
690	G	83.8	Confident	80.5	Confident	58 Å²	58	60.7 Å²	60.7	60%	0.598	30%	0.304	S	S	*	.	H	α-helix	trans	-62.1	-23.7	-172.5	0	0	0	0	0	114.9	Q694	G690-Q694 WeakPolarHBondContact O-CB 3.18Å; G690-Q694 PolarHBondContact O-N 2.81Å; G690-Q694 VanDerWaalsContact O-N 3.07Å
691	R	86.6	Confident	82.5	Confident	203 Å²	203	55 Å²	55	77%	0.766	28%	0.279	S	S	*	.	H	α-helix	trans	-80.3	-44.7	178.3	-171.3	-176.8	-176.3	-166.5	1	110.5	D689 N695	D689-R691 PolarHBondContact O-N 2.82Å; D689-R691 VanDerWaalsContact O-N 3.12Å; D689-R691 WeakPolarHBondContact OD2-CA 3.44Å; D689-R691 WeakPolarHBondContact OD2-CB 3.47Å; D689-R691 PolarHBondContact OD2-N 2.91Å; R691-N695 WeakPolarHBondContact O-CB 3.44Å; R691-N695 PolarHBondContact O-N 2.97Å; R691-N695 VanDerWaalsContact O-N 3.09Å; R691-N695 PolarHBondContact O-ND2 3.38Å
692	R	87.3	Confident	84.6	Confident	30 Å²	30	54.7 Å²	54.7	11%	0.113	27%	0.273	C	S	.	.	H	α-helix	trans	-63.2	-47.5	173.3	-170	-178.1	-164.3	142.2	14.5	110.6	I688 D689 Q694 N695 C696 V735 E737 D740	I688-R692 HydrophobicContact CG2-CB 3.94Å; I688-R692 HydrophobicContact CG2-CG 4.07Å; D689-R692 PolarHBondContact O-N 2.82Å; D689-R692 WeakPolarHBondContact OD1-CB 3.3Å; D689-R692 PolarHBondContact OD2-N 2.87Å; R692-Q694 PolarHBondContact O-N 2.98Å; R692-N695 PolarHBondContact O-N 2.98Å; R692-C696 PolarHBondContact O-N 3Å; R692-C696 PolarHBondContact O-SG 2.65Å; R692-C696 VanDerWaalsContact O-SG 3.35Å; R692-V735 PolarHBondContact NH2-O 2.74Å; R692-E737 IonicContact CZ-OE2 2.65Å; R692-E737 VanDerWaalsContact CZ-OE2 3.23Å; R692-E737 IonicContact NH1-OE2 3.19Å; R692-E737 PolarHBondContact NH1-OE2 3.33Å; R692-E737 IonicContact NH2-OE2 2.89Å; R692-E737 PolarHBondContact NH2-OE2 2.96Å; R692-D740 IonicContact CZ-OD1 3.62Å; R692-D740 IonicContact CZ-OD2 3.42Å; R692-D740 IonicContact NE-OD1 3.17Å; R692-D740 IonicContact NE-OD2 3.35Å; R692-D740 VanDerWaalsContact NH1-CG 3.31Å; R692-D740 IonicContact NH1-OD1 3.58Å; R692-D740 PolarHBondContact NH1-OD1 2.61Å; R692-D740 IonicContact NH1-OD2 2.77Å; R692-D740 PolarHBondContact NH1-OD2 2.8Å; R692-D740 IonicContact NH2-OD2 3.75Å; R692-D740 PolarHBondContact NH2-OD2 3.07Å
693	A	88.1	Confident	86.3	Confident	8 Å²	8	51.4 Å²	51.4	7%	0.066	25%	0.252	C	S	.	.	H	α-helix	trans	-59	-45.9	177.8	0	0	0	0	0	112.4	I688 D689 N695 C696 N697 A757	I688-A693 HydrophobicContact CG2-CB 4.25Å; D689-A693 VanDerWaalsContact O-CB 3.31Å; D689-A693 WeakPolarHBondContact O-CB 3.16Å; D689-A693 PolarHBondContact O-N 3.33Å; A693-N695 PolarHBondContact O-N 2.96Å; A693-C696 PolarHBondContact O-N 3.06Å; A693-N697 PolarHBondContact O-N 2.59Å; A693-N697 PolarHBondContact O-ND2 3.12Å; A693-A757 HydrophobicContact CB-CB 3.88Å
694	Q	88.1	Confident	87.7	Confident	109 Å²	109	53 Å²	53	51%	0.509	26%	0.259	S	S	.	.	H	α-helix	trans	-63.4	-40.2	177.1	-177.2	61.8	6.5	0	0	112.4	G690 R692 N697 I698	G690-Q694 WeakPolarHBondContact O-CB 3.18Å; G690-Q694 PolarHBondContact O-N 2.81Å; G690-Q694 VanDerWaalsContact O-N 3.07Å; R692-Q694 PolarHBondContact O-N 2.98Å; Q694-N697 PolarHBondContact O-N 2.93Å; Q694-I698 HydrophobicContact CG-CD1 4.15Å; Q694-I698 VanDerWaalsContact O-CG1 3.31Å; Q694-I698 WeakPolarHBondContact O-CG1 3.27Å; Q694-I698 PolarHBondContact O-N 3.34Å
695	N	90.4	Very high	88.5	Confident	63 Å²	63	52.4 Å²	52.4	34%	0.337	26%	0.257	S	S	.	.	H	α-helix	trans	-65	-41.7	176.2	-70.6	-22.2	0	0	0	112.1	R691 R692 A693 I698 L699 F734	R691-N695 WeakPolarHBondContact O-CB 3.44Å; R691-N695 PolarHBondContact O-N 2.97Å; R691-N695 VanDerWaalsContact O-N 3.09Å; R691-N695 PolarHBondContact O-ND2 3.38Å; R692-N695 PolarHBondContact O-N 2.98Å; A693-N695 PolarHBondContact O-N 2.96Å; N695-I698 PolarHBondContact O-N 2.92Å; N695-L699 PolarHBondContact O-N 3.44Å; N695-F734 HydrophobicContact CB-CD1 4.39Å; N695-F734 HydrophobicContact CB-CE1 3.48Å; N695-F734 VanDerWaalsContact CB-CE1 3.48Å; N695-F734 HydrophobicContact CB-CZ 3.63Å
696	C	90.9	Very high	89.1	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-60.5	-43.4	172.3	-68.6	0	0	0	0	111.7	R692 A693 I698 L699 L700 A757	R692-C696 PolarHBondContact O-N 3Å; R692-C696 PolarHBondContact O-SG 2.65Å; R692-C696 VanDerWaalsContact O-SG 3.35Å; A693-C696 PolarHBondContact O-N 3.06Å; C696-I698 VanDerWaalsContact C-N 3.34Å; C696-I698 PolarHBondContact O-N 2.78Å; C696-L699 PolarHBondContact O-N 3.46Å; C696-L700 WeakPolarHBondContact O-CB 3.49Å; C696-L700 VanDerWaalsContact O-CG 3.28Å; C696-L700 WeakPolarHBondContact O-CG 3.37Å; C696-L700 PolarHBondContact O-N 3.45Å; C696-A757 HydrophobicContact CB-CB 3.75Å
697	N	90.6	Very high	89.4	Confident	55 Å²	55	55.6 Å²	55.6	29%	0.294	28%	0.277	S	S	.	.	H	α-helix	trans	-62.5	-39.1	175.9	-74.2	-25.5	0	0	0	112.3	A693 Q694 L700 S701	A693-N697 PolarHBondContact O-N 2.59Å; A693-N697 PolarHBondContact O-ND2 3.12Å; Q694-N697 PolarHBondContact O-N 2.93Å; N697-L700 PolarHBondContact O-N 3.19Å; N697-S701 WeakPolarHBondContact O-CB 3.49Å; N697-S701 PolarHBondContact O-N 3.11Å; N697-S701 PolarHBondContact O-OG 2.87Å; N697-S701 VanDerWaalsContact O-OG 3.09Å
698	I	90.6	Very high	89.8	Confident	65 Å²	65	59.9 Å²	59.9	33%	0.333	30%	0.3	S	S	.	.	H	α-helix	trans	-63	-42.3	173.6	-69.1	164.2	0	0	0	111	Q694 N695 C696 S701 R702	Q694-I698 HydrophobicContact CG-CD1 4.15Å; Q694-I698 VanDerWaalsContact O-CG1 3.31Å; Q694-I698 WeakPolarHBondContact O-CG1 3.27Å; Q694-I698 PolarHBondContact O-N 3.34Å; N695-I698 PolarHBondContact O-N 2.92Å; C696-I698 VanDerWaalsContact C-N 3.34Å; C696-I698 PolarHBondContact O-N 2.78Å; I698-S701 PolarHBondContact O-OG 2.91Å; I698-R702 WeakPolarHBondContact O-CG 3.26Å; I698-R702 PolarHBondContact O-N 2.97Å
699	L	90.9	Very high	90.1	Very high	6 Å²	6	63.1 Å²	63.1	3%	0.031	32%	0.315	C	S	.	.	H	α-helix	trans	-61.7	-53.2	173.5	175.6	53.6	0	0	0	111.5	N695 C696 S701 R702 L703 M727 Q730 L731 F734	N695-L699 PolarHBondContact O-N 3.44Å; C696-L699 PolarHBondContact O-N 3.46Å; L699-S701 VanDerWaalsContact C-N 3.28Å; L699-S701 PolarHBondContact O-N 3.19Å; L699-R702 PolarHBondContact O-N 3.15Å; L699-L703 HydrophobicContact CD1-CB 4.34Å; L699-L703 HydrophobicContact CD1-CD1 3.99Å; L699-L703 HydrophobicContact CG-CD1 4.33Å; L699-L703 VanDerWaalsContact O-CB 3.29Å; L699-L703 WeakPolarHBondContact O-CB 3.32Å; L699-L703 PolarHBondContact O-N 3.13Å; L699-M727 HydrophobicContact CD1-SD 3.99Å; L699-Q730 HydrophobicContact CD1-CB 3.59Å; L699-Q730 HydrophobicContact CD1-CG 4.32Å; L699-Q730 HydrophobicContact CD2-CB 4.09Å; L699-Q730 HydrophobicContact CG-CB 4.44Å; L699-L731 HydrophobicContact CD2-CD2 3.94Å; L699-L731 HydrophobicContact CD2-CG 4.21Å; L699-F734 HydrophobicContact CD2-CD2 3.8Å
700	L	90.9	Very high	90.5	Very high	3 Å²	3	61.2 Å²	61.2	2%	0.016	31%	0.305	C	S	.	.	H	α-helix	trans	-62	-32.5	-176.7	-67	169.5	0	0	0	113.2	C696 N697 R702 K704 I710 K756 F760	C696-L700 WeakPolarHBondContact O-CB 3.49Å; C696-L700 VanDerWaalsContact O-CG 3.28Å; C696-L700 WeakPolarHBondContact O-CG 3.37Å; C696-L700 PolarHBondContact O-N 3.45Å; N697-L700 PolarHBondContact O-N 3.19Å; L700-R702 VanDerWaalsContact C-N 3.34Å; L700-K704 PolarHBondContact O-N 3.28Å; L700-I710 HydrophobicContact CD2-CD1 4.07Å; L700-K756 HydrophobicContact CD1-CG 4.12Å; L700-F760 HydrophobicContact CD1-CB 3.77Å; L700-F760 HydrophobicContact CD1-CD1 4.36Å; L700-F760 HydrophobicContact CD1-CD2 4.43Å; L700-F760 HydrophobicContact CD1-CG 3.94Å; L700-F760 HydrophobicContact CD2-CD2 3.69Å; L700-F760 HydrophobicContact CD2-CE2 4.02Å; L700-F760 HydrophobicContact CD2-CG 4.02Å; L700-F760 HydrophobicContact CG-CG 4.44Å
701	S	90.4	Very high	91	Very high	50 Å²	50	61 Å²	61	35%	0.35	29%	0.288	S	S	.	.	H	α-helix	trans	-70.7	-25.6	174.9	61.6	0	0	0	0	114.2	N697 I698 L699 K704	N697-S701 WeakPolarHBondContact O-CB 3.49Å; N697-S701 PolarHBondContact O-N 3.11Å; N697-S701 PolarHBondContact O-OG 2.87Å; N697-S701 VanDerWaalsContact O-OG 3.09Å; I698-S701 PolarHBondContact O-OG 2.91Å; L699-S701 VanDerWaalsContact C-N 3.28Å; L699-S701 PolarHBondContact O-N 3.19Å; S701-K704 WeakPolarHBondContact O-CG 3.37Å
702	R	89.6	Confident	91.4	Very high	169 Å²	169	58 Å²	58	64%	0.638	28%	0.276	S	S	*	.	H	α-helix	trans	-83.9	-43.7	172.8	-66.9	175.1	-177.9	-168.4	0.5	111.7	I698 L699 L700 M727	I698-R702 WeakPolarHBondContact O-CG 3.26Å; I698-R702 PolarHBondContact O-N 2.97Å; L699-R702 PolarHBondContact O-N 3.15Å; L700-R702 VanDerWaalsContact C-N 3.34Å; R702-M727 HydrophobicContact CB-SD 4.3Å
703	L	89.6	Confident	91.8	Very high	18 Å²	18	56.7 Å²	56.7	9%	0.094	27%	0.272	C	S	.	.	H	α-helix	trans	-72.8	-32.2	-174.1	-165	154.8	0	0	0	112.2	L699 L705 I710 L723 M727 L731	L699-L703 HydrophobicContact CD1-CB 4.34Å; L699-L703 HydrophobicContact CD1-CD1 3.99Å; L699-L703 HydrophobicContact CG-CD1 4.33Å; L699-L703 VanDerWaalsContact O-CB 3.29Å; L699-L703 WeakPolarHBondContact O-CB 3.32Å; L699-L703 PolarHBondContact O-N 3.13Å; L703-L705 HydrophobicContact CD2-CB 3.65Å; L703-L705 HydrophobicContact CD2-CD1 3.8Å; L703-L705 HydrophobicContact CD2-CG 3.74Å; L703-L705 PolarHBondContact O-N 3.19Å; L703-I710 HydrophobicContact CD2-CD1 3.82Å; L703-I710 HydrophobicContact CD2-CG1 3.82Å; L703-L723 HydrophobicContact CD1-CD2 4.49Å; L703-L723 HydrophobicContact CD2-CD2 4.38Å; L703-M727 HydrophobicContact CB-SD 4.1Å; L703-M727 HydrophobicContact CD1-CB 4.28Å; L703-M727 HydrophobicContact CD1-SD 4.49Å; L703-M727 HydrophobicContact CG-SD 4.41Å; L703-L731 HydrophobicContact CD1-CD1 3.91Å; L703-L731 HydrophobicContact CD1-CD2 3.91Å; L703-L731 HydrophobicContact CD1-CG 3.86Å
704	K	91.6	Very high	92.2	Very high	173 Å²	173	56.3 Å²	56.3	75%	0.752	27%	0.269	S	S	*	.			trans	61.4	-6.4	168.9	-66.4	-179.6	179.4	179.2	0	118.3	L700 S701	L700-K704 PolarHBondContact O-N 3.28Å; S701-K704 WeakPolarHBondContact O-CG 3.37Å
705	L	91.9	Very high	92.5	Very high	34 Å²	34	53.4 Å²	53.4	18%	0.178	26%	0.256	C	S	.	.			trans	-74.3	151.3	169.9	-56.4	177.7	0	0	0	111.8	L703 E709 I710 D722 L723	L703-L705 HydrophobicContact CD2-CB 3.65Å; L703-L705 HydrophobicContact CD2-CD1 3.8Å; L703-L705 HydrophobicContact CD2-CG 3.74Å; L703-L705 PolarHBondContact O-N 3.19Å; L705-E709 HydrophobicContact CB-CB 3.91Å; L705-E709 HydrophobicContact CD2-CB 4.25Å; L705-E709 HydrophobicContact CG-CB 4.45Å; L705-I710 HydrophobicContact CB-CD1 4.42Å; L705-I710 HydrophobicContact CB-CG1 3.75Å; L705-I710 HydrophobicContact CD1-CG1 4.18Å; L705-D722 HydrophobicContact CD1-CB 3.89Å; L705-D722 HydrophobicContact CD2-CB 4.44Å; L705-L723 HydrophobicContact CD1-CD2 3.83Å
706	S	94	Very high	92.7	Very high	52 Å²	52	51.6 Å²	51.6	36%	0.364	25%	0.248	S	C	.	.			trans	-73.5	162.2	165	65.3	0	0	0	0	111.9	D708 E709 I710	S706-D708 PolarHBondContact O-N 3.07Å; S706-E709 VanDerWaalsContact CB-OE2 3.25Å; S706-E709 WeakPolarHBondContact CB-OE2 3.34Å; S706-E709 PolarHBondContact N-OE2 3.08Å; S706-E709 PolarHBondContact O-N 3.26Å; S706-E709 VanDerWaalsContact O-N 3.08Å; S706-E709 WeakPolarHBondContact OG-CG 3.28Å; S706-E709 PolarHBondContact OG-N 3.44Å; S706-E709 PolarHBondContact OG-OE2 3.22Å; S706-I710 WeakPolarHBondContact O-CG1 3.42Å; S706-I710 PolarHBondContact O-N 2.84Å
707	N	93.6	Very high	93	Very high	29 Å²	29	51.7 Å²	51.7	16%	0.155	25%	0.248	C	C	.	.	H	α-helix	trans	-57.8	-36.3	178.5	-66.3	-6.9	0	0	0	112.1	K711 R759 E763 M764	N707-K711 WeakPolarHBondContact O-CB 3.35Å; N707-K711 PolarHBondContact O-N 3.27Å; N707-R759 PolarHBondContact ND2-O 3.43Å; N707-E763 HydrophobicContact CB-CB 4.09Å; N707-E763 HydrophobicContact CB-CG 4.07Å; N707-M764 HydrophobicContact CB-CE 4.33Å
708	D	92.8	Very high	93.2	Very high	90 Å²	90	49.2 Å²	49.2	48%	0.481	24%	0.235	S	C	.	.	H	α-helix	trans	-72.1	-30.5	177.6	-67.4	-64.1	0	0	0	113.3	S706 R712	S706-D708 PolarHBondContact O-N 3.07Å; D708-R712 WeakPolarHBondContact O-CB 3.41Å; D708-R712 VanDerWaalsContact O-CG 3.29Å; D708-R712 WeakPolarHBondContact O-CG 3.49Å; D708-R712 PolarHBondContact O-N 3.3Å; D708-R712 PolarHBondContact O-NH1 3.07Å
709	E	94.6	Very high	93.3	Very high	70 Å²	70	51.2 Å²	51.2	33%	0.327	24%	0.243	S	C	.	.	H	α-helix	trans	-70.9	-46.4	172.9	-74.6	158.4	153.2	0	0	110.9	L705 S706 K711 R712 A713	L705-E709 HydrophobicContact CB-CB 3.91Å; L705-E709 HydrophobicContact CD2-CB 4.25Å; L705-E709 HydrophobicContact CG-CB 4.45Å; S706-E709 VanDerWaalsContact CB-OE2 3.25Å; S706-E709 WeakPolarHBondContact CB-OE2 3.34Å; S706-E709 PolarHBondContact N-OE2 3.08Å; S706-E709 PolarHBondContact O-N 3.26Å; S706-E709 VanDerWaalsContact O-N 3.08Å; S706-E709 WeakPolarHBondContact OG-CG 3.28Å; S706-E709 PolarHBondContact OG-N 3.44Å; S706-E709 PolarHBondContact OG-OE2 3.22Å; E709-K711 VanDerWaalsContact C-N 3.29Å; E709-K711 PolarHBondContact O-N 3.12Å; E709-R712 PolarHBondContact O-N 3.47Å; E709-A713 WeakPolarHBondContact O-CB 3.29Å; E709-A713 PolarHBondContact O-N 3.3Å
710	I	94.8	Very high	93.3	Very high	0 Å²	0	57.5 Å²	57.5	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-57.8	-44	173.9	-59.3	167.3	0	0	0	110.5	L700 L703 L705 S706 A713 I714 F760 M764	L700-I710 HydrophobicContact CD2-CD1 4.07Å; L703-I710 HydrophobicContact CD2-CD1 3.82Å; L703-I710 HydrophobicContact CD2-CG1 3.82Å; L705-I710 HydrophobicContact CB-CD1 4.42Å; L705-I710 HydrophobicContact CB-CG1 3.75Å; L705-I710 HydrophobicContact CD1-CG1 4.18Å; S706-I710 WeakPolarHBondContact O-CG1 3.42Å; S706-I710 PolarHBondContact O-N 2.84Å; I710-A713 PolarHBondContact O-N 3.27Å; I710-I714 HydrophobicContact CG2-CD1 3.81Å; I710-I714 WeakPolarHBondContact O-CG1 3.36Å; I710-I714 PolarHBondContact O-N 2.94Å; I710-F760 HydrophobicContact CD1-CD2 4.23Å; I710-F760 HydrophobicContact CD1-CE2 3.94Å; I710-M764 HydrophobicContact CB-CE 4.19Å; I710-M764 HydrophobicContact CB-SD 4.42Å; I710-M764 HydrophobicContact CG2-CE 4.05Å; I710-M764 HydrophobicContact CG2-SD 3.62Å
711	K	94.6	Very high	93.5	Very high	54 Å²	54	63.5 Å²	63.5	24%	0.235	30%	0.3	C	S	.	.	H	α-helix	trans	-63.1	-43.9	177.5	-175.7	171.9	-169.5	175.6	0	112.1	N707 E709 L715 E763 I767	N707-K711 WeakPolarHBondContact O-CB 3.35Å; N707-K711 PolarHBondContact O-N 3.27Å; E709-K711 VanDerWaalsContact C-N 3.29Å; E709-K711 PolarHBondContact O-N 3.12Å; K711-L715 HydrophobicContact CG-CD1 4.36Å; K711-L715 WeakPolarHBondContact O-CB 3.26Å; K711-L715 VanDerWaalsContact O-CG 3.26Å; K711-L715 WeakPolarHBondContact O-CG 3.47Å; K711-L715 PolarHBondContact O-N 3.47Å; K711-L715 VanDerWaalsContact O-N 3.16Å; K711-E763 IonicContact NZ-OE2 3.77Å; K711-E763 PolarHBondContact NZ-OE2 3.02Å; K711-I767 HydrophobicContact CB-CD1 4.02Å; K711-I767 HydrophobicContact CG-CD1 3.86Å; K711-I767 HydrophobicContact CG-CG1 4.02Å
712	R	94.6	Very high	93.5	Very high	140 Å²	140	64.4 Å²	64.4	53%	0.528	30%	0.301	S	S	.	.	H	α-helix	trans	-62.8	-50.8	173.1	-77.1	-170.9	-57	-90	12.3	111.5	D708 E709 I714 L715 T716	D708-R712 WeakPolarHBondContact O-CB 3.41Å; D708-R712 VanDerWaalsContact O-CG 3.29Å; D708-R712 WeakPolarHBondContact O-CG 3.49Å; D708-R712 PolarHBondContact O-N 3.3Å; D708-R712 PolarHBondContact O-NH1 3.07Å; E709-R712 PolarHBondContact O-N 3.47Å; R712-I714 VanDerWaalsContact C-N 3.32Å; R712-I714 PolarHBondContact O-N 3.07Å; R712-L715 PolarHBondContact O-N 2.97Å; R712-L715 VanDerWaalsContact O-N 3.12Å; R712-T716 WeakPolarHBondContact O-CG2 3.31Å; R712-T716 PolarHBondContact O-N 2.83Å; R712-T716 PolarHBondContact O-OG1 3.09Å; R712-T716 VanDerWaalsContact O-OG1 3.1Å
713	A	95.8	Very high	93.8	Very high	3 Å²	3	56.3 Å²	56.3	3%	0.025	27%	0.271	C	S	.	.	H	α-helix	trans	-58.3	-40.8	-178.5	0	0	0	0	0	112.5	E709 I710 T716 M717 D718 D722 L723	E709-A713 WeakPolarHBondContact O-CB 3.29Å; E709-A713 PolarHBondContact O-N 3.3Å; I710-A713 PolarHBondContact O-N 3.27Å; A713-T716 PolarHBondContact O-OG1 3.37Å; A713-M717 PolarHBondContact O-N 3.36Å; A713-D718 WeakPolarHBondContact O-CA 3.14Å; A713-D718 PolarHBondContact O-N 3.49Å; A713-D722 HydrophobicContact CB-CB 4.43Å; A713-L723 HydrophobicContact CB-CD1 3.66Å; A713-L723 HydrophobicContact CB-CG 3.94Å
714	I	95.6	Very high	94	Very high	0 Å²	0	58.3 Å²	58.3	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-71	-34.3	177.6	-67.1	170.5	0	0	0	112.1	I710 R712 L723 I767 Y770 R773 L774	I710-I714 HydrophobicContact CG2-CD1 3.81Å; I710-I714 WeakPolarHBondContact O-CG1 3.36Å; I710-I714 PolarHBondContact O-N 2.94Å; R712-I714 VanDerWaalsContact C-N 3.32Å; R712-I714 PolarHBondContact O-N 3.07Å; I714-L723 HydrophobicContact CG1-CD1 3.83Å; I714-I767 HydrophobicContact CG2-CG2 4.47Å; I714-Y770 HydrophobicContact CD1-CD2 4.22Å; I714-Y770 HydrophobicContact CD1-CE2 3.44Å; I714-Y770 VanDerWaalsContact CD1-CE2 3.44Å; I714-R773 HydrophobicContact CG2-CB 4.01Å; I714-L774 HydrophobicContact CD1-CD1 4.04Å; I714-L774 HydrophobicContact CG1-CD1 4.42Å
715	L	94.8	Very high	94.1	Very high	47 Å²	47	54.1 Å²	54.1	25%	0.246	27%	0.266	C	S	.	.	H	α-helix	trans	-74.7	-33.2	175.1	-69.6	172.9	0	0	0	112.9	K711 R712 M717 I767 K923	K711-L715 HydrophobicContact CG-CD1 4.36Å; K711-L715 WeakPolarHBondContact O-CB 3.26Å; K711-L715 VanDerWaalsContact O-CG 3.26Å; K711-L715 WeakPolarHBondContact O-CG 3.47Å; K711-L715 PolarHBondContact O-N 3.47Å; K711-L715 VanDerWaalsContact O-N 3.16Å; R712-L715 PolarHBondContact O-N 2.97Å; R712-L715 VanDerWaalsContact O-N 3.12Å; L715-M717 VanDerWaalsContact C-N 3.33Å; L715-I767 HydrophobicContact CD2-CG2 4.35Å; L715-K923 PolarHBondContact O-N 2.92Å
716	T	95.3	Very high	94.1	Very high	25 Å²	25	56.7 Å²	56.7	15%	0.153	28%	0.28	C	S	.	.	H	α-helix	trans	-85.9	0.1	177.9	62.2	0	0	0	0	114.2	R712 A713 D718 K923	R712-T716 WeakPolarHBondContact O-CG2 3.31Å; R712-T716 PolarHBondContact O-N 2.83Å; R712-T716 PolarHBondContact O-OG1 3.09Å; R712-T716 VanDerWaalsContact O-OG1 3.1Å; A713-T716 PolarHBondContact O-OG1 3.37Å; T716-D718 VanDerWaalsContact C-N 3.27Å; T716-D718 PolarHBondContact O-N 3.31Å; T716-K923 HydrophobicContact CG2-CD 4.31Å
717	M	95.5	Very high	94.1	Very high	2 Å²	2	55.2 Å²	55.2	1%	0.01	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	58.5	37.8	-172.2	-70.5	-67	-64.1	0	0	113.9	A713 L715 L777 K780 F924 V927 V928	A713-M717 PolarHBondContact O-N 3.36Å; L715-M717 VanDerWaalsContact C-N 3.33Å; M717-L777 HydrophobicContact CE-CB 3.95Å; M717-L777 HydrophobicContact CE-CD1 4.13Å; M717-L777 WeakPolarHBondContact O-CD1 3.48Å; M717-L777 HydrophobicContact SD-CB 4.16Å; M717-K780 HydrophobicContact CE-CD 3.98Å; M717-K780 PolarHBondContact O-NZ 3.16Å; M717-F924 HydrophobicContact CE-CE2 4.45Å; M717-F924 HydrophobicContact CG-CD2 4.04Å; M717-F924 HydrophobicContact SD-CD2 3.43Å; M717-F924 WeakPolarHBondContact SD-CD2 3.44Å; M717-F924 HydrophobicContact SD-CE2 3.71Å; M717-F924 HydrophobicContact SD-CG 4.49Å; M717-V927 HydrophobicContact CB-CB 3.95Å; M717-V927 HydrophobicContact CB-CG1 3.77Å; M717-V927 HydrophobicContact CB-CG2 4.23Å; M717-V927 HydrophobicContact CG-CB 4.17Å; M717-V927 HydrophobicContact CG-CG1 4.31Å; M717-V928 HydrophobicContact CE-CG2 3.62Å; M717-V928 HydrophobicContact CG-CG2 4.29Å; M717-V928 HydrophobicContact SD-CG2 4.11Å
718	D	95.9	Very high	94.1	Very high	3 Å²	3	53.8 Å²	53.8	2%	0.016	26%	0.26	C	S	.	.	S	Bend	trans	58.5	51.2	178.2	-162	32.6	0	0	0	114.9	A713 T716 Q720 E721 D722 L723 L777 K781	A713-D718 WeakPolarHBondContact O-CA 3.14Å; A713-D718 PolarHBondContact O-N 3.49Å; T716-D718 VanDerWaalsContact C-N 3.27Å; T716-D718 PolarHBondContact O-N 3.31Å; D718-Q720 PolarHBondContact O-N 3.17Å; D718-Q720 VanDerWaalsContact O-N 3.14Å; D718-E721 PolarHBondContact O-N 2.74Å; D718-E721 VanDerWaalsContact O-N 3.12Å; D718-E721 WeakPolarHBondContact OD2-CA 3.48Å; D718-D722 PolarHBondContact OD1-N 3.28Å; D718-D722 PolarHBondContact OD2-N 3.17Å; D718-L723 PolarHBondContact OD1-N 3.27Å; D718-L723 WeakPolarHBondContact OD2-CA 3.5Å; D718-L723 PolarHBondContact OD2-N 3.33Å; D718-L777 HydrophobicContact CB-CD1 3.8Å; D718-L777 HydrophobicContact CB-CD2 3.97Å; D718-L777 HydrophobicContact CB-CG 4.48Å; D718-K781 WeakPolarHBondContact OD2-CE 3.42Å; D718-K781 IonicContact OD2-NZ 3.61Å; D718-K781 PolarHBondContact OD2-NZ 3.46Å
719	E	91.6	Very high	94.2	Very high	108 Å²	108	52.5 Å²	52.5	51%	0.505	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60	-18.2	179	-176	174.1	-125.7	0	0	114.5	K923	E719-K923 IonicContact OE1-NZ 2.88Å; E719-K923 PolarHBondContact OE1-NZ 2.59Å; E719-K923 IonicContact OE2-NZ 2.79Å; E719-K923 PolarHBondContact OE2-NZ 2.9Å
720	Q	92.5	Very high	94.1	Very high	137 Å²	137	52 Å²	52	64%	0.64	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-101.9	-1.8	178.6	-57.8	-58.3	-84	0	0	113.4	D718 D722	D718-Q720 PolarHBondContact O-N 3.17Å; D718-Q720 VanDerWaalsContact O-N 3.14Å; Q720-D722 WeakPolarHBondContact CB-OD2 3.4Å; Q720-D722 PolarHBondContact O-N 3.37Å
721	E	93.3	Very high	94	Very high	129 Å²	129	52 Å²	52	60%	0.603	25%	0.249	S	C	*	.			trans	57.4	30.3	-170.5	-70.7	-74.1	130.3	0	0	114	D718 L723 K781	D718-E721 PolarHBondContact O-N 2.74Å; D718-E721 VanDerWaalsContact O-N 3.12Å; D718-E721 WeakPolarHBondContact OD2-CA 3.48Å; E721-L723 VanDerWaalsContact C-N 3.28Å; E721-L723 PolarHBondContact O-N 2.95Å; E721-K781 IonicContact OE1-NZ 2.69Å; E721-K781 PolarHBondContact OE1-NZ 3.26Å; E721-K781 IonicContact OE2-NZ 2.81Å; E721-K781 PolarHBondContact OE2-NZ 2.93Å
722	D	92.2	Very high	94	Very high	69 Å²	69	51.4 Å²	51.4	37%	0.369	25%	0.248	S	C	.	.			trans	-71.4	-18.1	178.8	-75.7	-37.7	0	0	0	113	L705 A713 D718 Q720 P724	L705-D722 HydrophobicContact CD1-CB 3.89Å; L705-D722 HydrophobicContact CD2-CB 4.44Å; A713-D722 HydrophobicContact CB-CB 4.43Å; D718-D722 PolarHBondContact OD1-N 3.28Å; D718-D722 PolarHBondContact OD2-N 3.17Å; Q720-D722 WeakPolarHBondContact CB-OD2 3.4Å; Q720-D722 PolarHBondContact O-N 3.37Å; D722-P724 VanDerWaalsContact O-CD 3.24Å; D722-P724 WeakPolarHBondContact O-CD 3.48Å
723	L	94.5	Very high	94	Very high	0 Å²	0	50 Å²	50	0%	0	25%	0.246	C	C	.	.	S	Bend	trans	-116.5	88.6	-176.1	-63.2	178.2	0	0	0	112.9	L703 L705 A713 I714 D718 E721 L728 L731 L777 K781	L703-L723 HydrophobicContact CD1-CD2 4.49Å; L703-L723 HydrophobicContact CD2-CD2 4.38Å; L705-L723 HydrophobicContact CD1-CD2 3.83Å; A713-L723 HydrophobicContact CB-CD1 3.66Å; A713-L723 HydrophobicContact CB-CG 3.94Å; I714-L723 HydrophobicContact CG1-CD1 3.83Å; D718-L723 PolarHBondContact OD1-N 3.27Å; D718-L723 WeakPolarHBondContact OD2-CA 3.5Å; D718-L723 PolarHBondContact OD2-N 3.33Å; E721-L723 VanDerWaalsContact C-N 3.28Å; E721-L723 PolarHBondContact O-N 2.95Å; L723-L728 HydrophobicContact CB-CD1 4.48Å; L723-L728 HydrophobicContact CB-CD2 3.81Å; L723-L728 HydrophobicContact CB-CG 4.01Å; L723-L728 HydrophobicContact CD1-CD2 4.01Å; L723-L728 HydrophobicContact CG-CD2 4.49Å; L723-L728 WeakPolarHBondContact O-CD1 3.48Å; L723-L731 HydrophobicContact CD2-CD1 4.11Å; L723-L777 HydrophobicContact CD1-CD2 4.09Å; L723-K781 WeakPolarHBondContact O-CE 3.29Å; L723-K781 PolarHBondContact O-NZ 3Å
724	P	94.1	Very high	93.8	Very high	59 Å²	59	51.5 Å²	51.5	38%	0.383	25%	0.252	S	S	.	.			trans	-53.8	153.3	171.8	-30.4	36.7	0	0	0	114.9	D722 D726 M727 L728	D722-P724 VanDerWaalsContact O-CD 3.24Å; D722-P724 WeakPolarHBondContact O-CD 3.48Å; P724-D726 VanDerWaalsContact C-N 3.29Å; P724-D726 VanDerWaalsContact CB-OD1 3.27Å; P724-D726 WeakPolarHBondContact CB-OD1 3.41Å; P724-D726 PolarHBondContact O-N 2.89Å; P724-M727 HydrophobicContact CB-CB 4.34Å; P724-M727 HydrophobicContact CB-CG 4.25Å; P724-M727 HydrophobicContact CG-CG 4.38Å; P724-M727 PolarHBondContact O-N 2.82Å; P724-M727 VanDerWaalsContact O-N 3.12Å; P724-L728 WeakPolarHBondContact O-CG 3.23Å; P724-L728 PolarHBondContact O-N 2.74Å
725	K	93.6	Very high	93.7	Very high	85 Å²	85	52.3 Å²	52.3	37%	0.37	26%	0.257	S	S	.	.	H	α-helix	trans	-56.4	-38.6	-176.5	-64.4	177.2	-176.1	-179.1	0	113.5	E729 Y778 K781 K782 E785	K725-E729 PolarHBondContact O-N 2.78Å; K725-E729 VanDerWaalsContact O-N 3.17Å; K725-Y778 WeakPolarHBondContact O-CE2 3.28Å; K725-K781 WeakPolarHBondContact CE-O 3.37Å; K725-K781 HydrophobicContact CG-CB 4.04Å; K725-K781 HydrophobicContact CG-CD 4.41Å; K725-K781 PolarHBondContact NZ-O 3.12Å; K725-K782 HydrophobicContact CD-CG 4.43Å; K725-E785 WeakPolarHBondContact CD-OE2 3.38Å; K725-E785 IonicContact NZ-OE2 3.68Å; K725-E785 PolarHBondContact NZ-OE2 3.49Å
726	D	92	Very high	93.6	Very high	88 Å²	88	50.6 Å²	50.6	47%	0.471	25%	0.249	S	C	.	.	H	α-helix	trans	-76.4	-36.5	178.7	66.8	-52.8	0	0	0	112.3	P724 E729 Q730	P724-D726 VanDerWaalsContact C-N 3.29Å; P724-D726 VanDerWaalsContact CB-OD1 3.27Å; P724-D726 WeakPolarHBondContact CB-OD1 3.41Å; P724-D726 PolarHBondContact O-N 2.89Å; D726-E729 WeakPolarHBondContact O-CB 3.37Å; D726-E729 PolarHBondContact O-N 3.28Å; D726-Q730 WeakPolarHBondContact O-CG 3.42Å; D726-Q730 PolarHBondContact O-N 3.35Å; D726-Q730 PolarHBondContact O-NE2 3.37Å
727	M	93.6	Very high	93.4	Very high	21 Å²	21	54.2 Å²	54.2	10%	0.103	26%	0.264	C	S	.	.	H	α-helix	trans	-65.5	-41.4	172.8	-70.1	-60.3	103.2	0	0	111.7	L699 R702 L703 P724 E729 Q730 L731	L699-M727 HydrophobicContact CD1-SD 3.99Å; R702-M727 HydrophobicContact CB-SD 4.3Å; L703-M727 HydrophobicContact CB-SD 4.1Å; L703-M727 HydrophobicContact CD1-CB 4.28Å; L703-M727 HydrophobicContact CD1-SD 4.49Å; L703-M727 HydrophobicContact CG-SD 4.41Å; P724-M727 HydrophobicContact CB-CB 4.34Å; P724-M727 HydrophobicContact CB-CG 4.25Å; P724-M727 HydrophobicContact CG-CG 4.38Å; P724-M727 PolarHBondContact O-N 2.82Å; P724-M727 VanDerWaalsContact O-N 3.12Å; M727-E729 VanDerWaalsContact C-N 3.31Å; M727-E729 PolarHBondContact O-N 2.92Å; M727-Q730 HydrophobicContact CE-CG 4.44Å; M727-Q730 PolarHBondContact O-N 3.07Å; M727-L731 WeakPolarHBondContact O-CG 3.49Å; M727-L731 PolarHBondContact O-N 2.88Å
728	L	94.8	Very high	93	Very high	0 Å²	0	61.3 Å²	61.3	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-58.6	-42.3	170.2	-70.5	170.2	0	0	0	111.6	L723 P724 Q730 L731 L732 L774 L777 Y778 K781	L723-L728 HydrophobicContact CB-CD1 4.48Å; L723-L728 HydrophobicContact CB-CD2 3.81Å; L723-L728 HydrophobicContact CB-CG 4.01Å; L723-L728 HydrophobicContact CD1-CD2 4.01Å; L723-L728 HydrophobicContact CG-CD2 4.49Å; L723-L728 WeakPolarHBondContact O-CD1 3.48Å; P724-L728 WeakPolarHBondContact O-CG 3.23Å; P724-L728 PolarHBondContact O-N 2.74Å; L728-Q730 VanDerWaalsContact C-N 3.31Å; L728-Q730 PolarHBondContact O-N 3.06Å; L728-L731 HydrophobicContact CD2-CD1 4.47Å; L728-L731 PolarHBondContact O-N 2.72Å; L728-L732 VanDerWaalsContact O-CG 3.32Å; L728-L732 WeakPolarHBondContact O-CG 3.44Å; L728-L732 PolarHBondContact O-N 3.04Å; L728-L774 HydrophobicContact CD2-CD1 3.55Å; L728-L777 HydrophobicContact CD1-CD2 4.45Å; L728-L777 HydrophobicContact CD1-CG 4.03Å; L728-L777 HydrophobicContact CD2-CD2 3.7Å; L728-L777 HydrophobicContact CD2-CG 4.03Å; L728-Y778 HydrophobicContact CB-CD2 3.82Å; L728-Y778 HydrophobicContact CB-CG 4.43Å; L728-K781 HydrophobicContact CD1-CD 3.91Å; L728-K781 HydrophobicContact CD1-CG 4.38Å
729	E	93.6	Very high	92.6	Very high	63 Å²	63	64.4 Å²	64.4	29%	0.294	32%	0.316	S	S	.	.	H	α-helix	trans	-67.3	-29	176.3	-158.3	-164	107	0	0	113.2	K725 D726 M727 K733 Y778 K782	K725-E729 PolarHBondContact O-N 2.78Å; K725-E729 VanDerWaalsContact O-N 3.17Å; D726-E729 WeakPolarHBondContact O-CB 3.37Å; D726-E729 PolarHBondContact O-N 3.28Å; M727-E729 VanDerWaalsContact C-N 3.31Å; M727-E729 PolarHBondContact O-N 2.92Å; E729-K733 WeakPolarHBondContact O-CD 3.49Å; E729-K733 WeakPolarHBondContact O-CE 3.29Å; E729-K733 WeakPolarHBondContact O-CG 3.35Å; E729-K733 PolarHBondContact O-NZ 3.39Å; E729-K733 IonicContact OE1-NZ 2.76Å; E729-K733 PolarHBondContact OE1-NZ 3.15Å; E729-Y778 HydrophobicContact CB-CE2 3.82Å; E729-Y778 HydrophobicContact CG-CE2 4.19Å; E729-Y778 WeakPolarHBondContact CG-OH 3.2Å; E729-Y778 PolarHBondContact OE2-OH 3.04Å; E729-K782 IonicContact OE2-NZ 3.6Å; E729-K782 PolarHBondContact OE2-NZ 3.16Å
730	Q	93.3	Very high	92.4	Very high	58 Å²	58	59.7 Å²	59.7	27%	0.271	29%	0.294	S	S	.	.	H	α-helix	trans	-76.4	-43.7	170.9	-58.9	-37.1	-68.6	0	0	112	L699 D726 M727 L728 L732 K733 F734	L699-Q730 HydrophobicContact CD1-CB 3.59Å; L699-Q730 HydrophobicContact CD1-CG 4.32Å; L699-Q730 HydrophobicContact CD2-CB 4.09Å; L699-Q730 HydrophobicContact CG-CB 4.44Å; D726-Q730 WeakPolarHBondContact O-CG 3.42Å; D726-Q730 PolarHBondContact O-N 3.35Å; D726-Q730 PolarHBondContact O-NE2 3.37Å; M727-Q730 HydrophobicContact CE-CG 4.44Å; M727-Q730 PolarHBondContact O-N 3.07Å; L728-Q730 VanDerWaalsContact C-N 3.31Å; L728-Q730 PolarHBondContact O-N 3.06Å; Q730-L732 PolarHBondContact O-N 2.94Å; Q730-K733 VanDerWaalsContact NE2-NZ 3.2Å; Q730-K733 WeakPolarHBondContact O-CB 3.38Å; Q730-K733 PolarHBondContact O-N 3.47Å; Q730-F734 VanDerWaalsContact O-CD2 3.24Å; Q730-F734 WeakPolarHBondContact O-CD2 3.41Å
731	L	93.9	Very high	92.3	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-54.7	-39.9	175.8	-76.1	167.8	0	0	0	111.3	L699 L703 L723 M727 L728 K733 F734 V735 F760 L774	L699-L731 HydrophobicContact CD2-CD2 3.94Å; L699-L731 HydrophobicContact CD2-CG 4.21Å; L703-L731 HydrophobicContact CD1-CD1 3.91Å; L703-L731 HydrophobicContact CD1-CD2 3.91Å; L703-L731 HydrophobicContact CD1-CG 3.86Å; L723-L731 HydrophobicContact CD2-CD1 4.11Å; M727-L731 WeakPolarHBondContact O-CG 3.49Å; M727-L731 PolarHBondContact O-N 2.88Å; L728-L731 HydrophobicContact CD2-CD1 4.47Å; L728-L731 PolarHBondContact O-N 2.72Å; L731-K733 PolarHBondContact O-N 2.82Å; L731-K733 VanDerWaalsContact O-N 3.11Å; L731-F734 CarbonylContact O-C 3.55Å; L731-F734 PolarHBondContact O-N 3.14Å; L731-V735 PolarHBondContact O-N 3.15Å; L731-F760 HydrophobicContact CD2-CE2 4.19Å; L731-F760 HydrophobicContact CD2-CZ 3.73Å; L731-L774 HydrophobicContact CB-CD1 4.09Å; L731-L774 HydrophobicContact CB-CD2 3.68Å; L731-L774 HydrophobicContact CB-CG 4.47Å; L731-L774 HydrophobicContact CD1-CD1 4.01Å
732	L	94.5	Very high	92	Very high	42 Å²	42	53.6 Å²	53.6	22%	0.22	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-16.7	176.2	-76.8	169.4	0	0	0	114.6	L728 Q730 L774 Q775 Y778	L728-L732 VanDerWaalsContact O-CG 3.32Å; L728-L732 WeakPolarHBondContact O-CG 3.44Å; L728-L732 PolarHBondContact O-N 3.04Å; Q730-L732 PolarHBondContact O-N 2.94Å; L732-L774 HydrophobicContact CD2-CB 4.23Å; L732-L774 HydrophobicContact CD2-CD2 3.72Å; L732-L774 HydrophobicContact CD2-CG 3.78Å; L732-L774 HydrophobicContact CG-CD2 3.85Å; L732-L774 HydrophobicContact CG-CG 3.95Å; L732-Q775 HydrophobicContact CD2-CB 4.36Å; L732-Q775 HydrophobicContact CD2-CG 3.44Å; L732-Q775 VanDerWaalsContact CD2-CG 3.44Å; L732-Y778 HydrophobicContact CD1-CD1 3.46Å; L732-Y778 VanDerWaalsContact CD1-CD1 3.46Å; L732-Y778 HydrophobicContact CD1-CD2 4.43Å; L732-Y778 HydrophobicContact CD1-CE1 4.06Å; L732-Y778 HydrophobicContact CD1-CG 3.67Å
733	K	93.4	Very high	91.8	Very high	110 Å²	110	52.1 Å²	52.1	48%	0.478	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.3	-10	176	-61.5	161.5	-168.1	158.8	0	112.7	E729 Q730 L731	E729-K733 WeakPolarHBondContact O-CD 3.49Å; E729-K733 WeakPolarHBondContact O-CE 3.29Å; E729-K733 WeakPolarHBondContact O-CG 3.35Å; E729-K733 PolarHBondContact O-NZ 3.39Å; E729-K733 IonicContact OE1-NZ 2.76Å; E729-K733 PolarHBondContact OE1-NZ 3.15Å; Q730-K733 VanDerWaalsContact NE2-NZ 3.2Å; Q730-K733 WeakPolarHBondContact O-CB 3.38Å; Q730-K733 PolarHBondContact O-N 3.47Å; L731-K733 PolarHBondContact O-N 2.82Å; L731-K733 VanDerWaalsContact O-N 3.11Å
734	F	92.4	Very high	91.5	Very high	35 Å²	35	52.2 Å²	52.2	15%	0.154	26%	0.263	C	S	.	.	S	Bend	trans	-128.5	37.1	-178.4	-57.3	-70	0	0	0	112.1	N695 L699 Q730 L731 L761	N695-F734 HydrophobicContact CB-CD1 4.39Å; N695-F734 HydrophobicContact CB-CE1 3.48Å; N695-F734 VanDerWaalsContact CB-CE1 3.48Å; N695-F734 HydrophobicContact CB-CZ 3.63Å; L699-F734 HydrophobicContact CD2-CD2 3.8Å; Q730-F734 VanDerWaalsContact O-CD2 3.24Å; Q730-F734 WeakPolarHBondContact O-CD2 3.41Å; L731-F734 CarbonylContact O-C 3.55Å; L731-F734 PolarHBondContact O-N 3.14Å; F734-L761 VanDerWaalsContact O-CD2 3.3Å; F734-L761 WeakPolarHBondContact O-CD2 3.24Å
735	V	93.9	Very high	91.3	Very high	17 Å²	17	51.8 Å²	51.8	10%	0.103	26%	0.255	C	S	.	.	P	Polyproline II helix	trans	-62.3	140.5	167.2	171.8	0	0	0	0	109.5	R692 L731 E737 Y770 Q771 L774	R692-V735 PolarHBondContact NH2-O 2.74Å; L731-V735 PolarHBondContact O-N 3.15Å; V735-E737 PolarHBondContact O-N 2.67Å; V735-Y770 HydrophobicContact CG1-CD1 4.29Å; V735-Y770 HydrophobicContact CG2-CD1 4.43Å; V735-Y770 HydrophobicContact CG2-CE1 4.14Å; V735-Q771 HydrophobicContact CG1-CB 3.92Å; V735-Q771 HydrophobicContact CG1-CG 4.17Å; V735-Q771 HydrophobicContact CG2-CB 4.41Å; V735-Q771 HydrophobicContact CG2-CG 4.19Å; V735-L774 HydrophobicContact CG2-CD2 4.48Å
736	P	92.7	Very high	90.9	Very high	12 Å²	12	54.3 Å²	54.3	8%	0.078	27%	0.268	C	S	.	.	P	Polyproline II helix	trans	-65.4	118.3	169.4	-18.1	31.3	0	0	0	110.5	I741 L761 M764	P736-I741 HydrophobicContact CB-CD1 4.28Å; P736-I741 HydrophobicContact CB-CG1 3.96Å; P736-L761 HydrophobicContact CB-CD2 4.42Å; P736-L761 HydrophobicContact CG-CB 4.33Å; P736-L761 HydrophobicContact CG-CD2 3.97Å; P736-L761 WeakPolarHBondContact CG-O 3.2Å; P736-M764 HydrophobicContact CG-CB 3.88Å
737	E	90.1	Very high	90.7	Very high	100 Å²	100	50.6 Å²	50.6	47%	0.467	25%	0.248	S	C	.	.	P	Polyproline II helix	trans	-81.9	160	173.1	-69.4	170	136.1	0	0	110.1	R692 V735 S739 D740 I741	R692-E737 IonicContact CZ-OE2 2.65Å; R692-E737 VanDerWaalsContact CZ-OE2 3.23Å; R692-E737 IonicContact NH1-OE2 3.19Å; R692-E737 PolarHBondContact NH1-OE2 3.33Å; R692-E737 IonicContact NH2-OE2 2.89Å; R692-E737 PolarHBondContact NH2-OE2 2.96Å; V735-E737 PolarHBondContact O-N 2.67Å; E737-S739 PolarHBondContact O-N 3.43Å; E737-S739 VanDerWaalsContact O-N 3.1Å; E737-D740 PolarHBondContact N-OD2 2.91Å; E737-D740 WeakPolarHBondContact O-CA 3.3Å; E737-D740 WeakPolarHBondContact O-CB 3.41Å; E737-D740 PolarHBondContact O-N 3.46Å; E737-I741 WeakPolarHBondContact O-CG1 3.38Å; E737-I741 PolarHBondContact O-N 3.45Å
738	K	87.8	Confident	90.3	Very high	152 Å²	152	55.2 Å²	55.2	66%	0.661	27%	0.268	S	S	*	.	H	α-helix	trans	-54.3	-36.8	-178.1	179	159.8	-177.3	161.2	0	113.1	D740 I741 D742	K738-D740 PolarHBondContact O-N 2.99Å; K738-I741 PolarHBondContact O-N 2.6Å; K738-D742 WeakPolarHBondContact CE-OD2 3.23Å; K738-D742 WeakPolarHBondContact CG-OD2 3.15Å; K738-D742 WeakPolarHBondContact O-CB 3.36Å; K738-D742 PolarHBondContact O-N 2.88Å
739	S	86.3	Confident	89.8	Confident	68 Å²	68	62.3 Å²	62.3	48%	0.476	30%	0.3	S	S	.	.	H	α-helix	trans	-62.7	-35.2	174	39.6	0	0	0	0	114	E737 L743	E737-S739 PolarHBondContact O-N 3.43Å; E737-S739 VanDerWaalsContact O-N 3.1Å; S739-L743 WeakPolarHBondContact O-CB 3.35Å; S739-L743 PolarHBondContact O-N 2.73Å
740	D	87.9	Confident	89.3	Confident	8 Å²	8	60.3 Å²	60.3	4%	0.043	29%	0.291	C	S	.	.	H	α-helix	trans	-72.6	-38.8	175.1	-46.8	-48.6	0	0	0	110.4	I688 R692 E737 K738 L743 L744	I688-D740 HydrophobicContact CD1-CB 3.94Å; R692-D740 IonicContact CZ-OD1 3.62Å; R692-D740 IonicContact CZ-OD2 3.42Å; R692-D740 IonicContact NE-OD1 3.17Å; R692-D740 IonicContact NE-OD2 3.35Å; R692-D740 VanDerWaalsContact NH1-CG 3.31Å; R692-D740 IonicContact NH1-OD1 3.58Å; R692-D740 PolarHBondContact NH1-OD1 2.61Å; R692-D740 IonicContact NH1-OD2 2.77Å; R692-D740 PolarHBondContact NH1-OD2 2.8Å; R692-D740 IonicContact NH2-OD2 3.75Å; R692-D740 PolarHBondContact NH2-OD2 3.07Å; E737-D740 PolarHBondContact N-OD2 2.91Å; E737-D740 WeakPolarHBondContact O-CA 3.3Å; E737-D740 WeakPolarHBondContact O-CB 3.41Å; E737-D740 PolarHBondContact O-N 3.46Å; K738-D740 PolarHBondContact O-N 2.99Å; D740-L743 PolarHBondContact O-N 3Å; D740-L744 VanDerWaalsContact O-CB 3.31Å; D740-L744 WeakPolarHBondContact O-CB 3.27Å; D740-L744 WeakPolarHBondContact O-CD1 3.24Å; D740-L744 WeakPolarHBondContact O-CG 3.3Å; D740-L744 PolarHBondContact O-N 3.37Å
741	I	89.8	Confident	88.9	Confident	49 Å²	49	59.5 Å²	59.5	25%	0.251	29%	0.288	S	S	.	.	H	α-helix	trans	-67.3	-50.5	-179.1	-58.7	175.7	0	0	0	110.5	P736 E737 K738 L743 L744 E745	P736-I741 HydrophobicContact CB-CD1 4.28Å; P736-I741 HydrophobicContact CB-CG1 3.96Å; E737-I741 WeakPolarHBondContact O-CG1 3.38Å; E737-I741 PolarHBondContact O-N 3.45Å; K738-I741 PolarHBondContact O-N 2.6Å; I741-L743 PolarHBondContact O-N 3.32Å; I741-L744 PolarHBondContact O-N 3.22Å; I741-E745 WeakPolarHBondContact O-CB 3.34Å; I741-E745 VanDerWaalsContact O-CG 3.28Å; I741-E745 WeakPolarHBondContact O-CG 3.46Å; I741-E745 PolarHBondContact O-N 3.33Å
742	D	88.6	Confident	88.3	Confident	90 Å²	90	67.2 Å²	67.2	48%	0.481	33%	0.33	S	S	.	.	H	α-helix	trans	-58.2	-38	178.5	-66.9	-17.7	0	0	0	110.5	K738	K738-D742 WeakPolarHBondContact CE-OD2 3.23Å; K738-D742 WeakPolarHBondContact CG-OD2 3.15Å; K738-D742 WeakPolarHBondContact O-CB 3.36Å; K738-D742 PolarHBondContact O-N 2.88Å
743	L	87.5	Confident	87.7	Confident	38 Å²	38	72 Å²	72	20%	0.199	35%	0.345	C	S	.	.	H	α-helix	trans	-72.3	-45.9	178.3	-180	72.5	0	0	0	113.6	V687 I688 S739 D740 I741 E745 E746	V687-L743 HydrophobicContact CB-CD2 4.21Å; V687-L743 HydrophobicContact CB-CG 4.43Å; V687-L743 HydrophobicContact CG1-CD1 3.76Å; V687-L743 HydrophobicContact CG1-CD2 3.86Å; V687-L743 HydrophobicContact CG1-CG 3.84Å; I688-L743 HydrophobicContact CD1-CD2 4.42Å; S739-L743 WeakPolarHBondContact O-CB 3.35Å; S739-L743 PolarHBondContact O-N 2.73Å; D740-L743 PolarHBondContact O-N 3Å; I741-L743 PolarHBondContact O-N 3.32Å; L743-E745 VanDerWaalsContact C-N 3.32Å; L743-E745 PolarHBondContact O-N 2.92Å; L743-E746 PolarHBondContact O-N 3.24Å
744	L	88.9	Confident	87.4	Confident	2 Å²	2	67.5 Å²	67.5	1%	0.01	33%	0.326	C	S	.	.	H	α-helix	trans	-76.4	-19.2	-176.9	-66.3	167.8	0	0	0	112.6	I688 D740 I741 E746 H747 K748 D758 L761 F762	I688-L744 HydrophobicContact CD1-CD1 4.21Å; I688-L744 HydrophobicContact CD1-CG 4.47Å; I688-L744 HydrophobicContact CG1-CD1 4.44Å; I688-L744 HydrophobicContact CG1-CD2 4.37Å; D740-L744 VanDerWaalsContact O-CB 3.31Å; D740-L744 WeakPolarHBondContact O-CB 3.27Å; D740-L744 WeakPolarHBondContact O-CD1 3.24Å; D740-L744 WeakPolarHBondContact O-CG 3.3Å; D740-L744 PolarHBondContact O-N 3.37Å; I741-L744 PolarHBondContact O-N 3.22Å; L744-E746 VanDerWaalsContact C-N 3.3Å; L744-E746 PolarHBondContact O-N 3.18Å; L744-H747 PolarHBondContact O-N 3.25Å; L744-K748 PolarHBondContact O-N 3.12Å; L744-D758 HydrophobicContact CD2-CB 3.99Å; L744-L761 HydrophobicContact CD1-CB 3.99Å; L744-F762 HydrophobicContact CB-CB 4.49Å; L744-F762 HydrophobicContact CB-CD2 3.91Å; L744-F762 HydrophobicContact CD1-CB 4.29Å
745	E	88.9	Confident	87.2	Confident	49 Å²	49	66.3 Å²	66.3	23%	0.229	32%	0.322	C	S	.	.	H	α-helix	trans	-61.2	-33.5	171.6	-86.7	-75.2	162.4	0	0	113.5	I741 L743 H747 K748 R766	I741-E745 WeakPolarHBondContact O-CB 3.34Å; I741-E745 VanDerWaalsContact O-CG 3.28Å; I741-E745 WeakPolarHBondContact O-CG 3.46Å; I741-E745 PolarHBondContact O-N 3.33Å; L743-E745 VanDerWaalsContact C-N 3.32Å; L743-E745 PolarHBondContact O-N 2.92Å; E745-H747 PolarHBondContact O-N 3.32Å; E745-K748 WeakPolarHBondContact O-CD 3.4Å; E745-K748 WeakPolarHBondContact O-CE 3.47Å; E745-K748 VanDerWaalsContact O-CG 3.27Å; E745-K748 WeakPolarHBondContact O-CG 3.48Å; E745-K748 PolarHBondContact O-N 3.47Å; E745-K748 WeakPolarHBondContact OE2-CD 3.22Å; E745-K748 IonicContact OE2-NZ 3.86Å; E745-K748 PolarHBondContact OE2-NZ 3.44Å; E745-R766 IonicContact OE1-CZ 3.71Å; E745-R766 IonicContact OE1-NH1 2.64Å; E745-R766 PolarHBondContact OE1-NH1 2.87Å; E745-R766 IonicContact OE1-NH2 2.69Å; E745-R766 PolarHBondContact OE1-NH2 3.17Å
746	E	86.1	Confident	87	Confident	138 Å²	138	71.5 Å²	71.5	65%	0.645	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-31.3	177.7	-59	-173.7	179.9	0	0	110.9	L743 L744 H749	L743-E746 PolarHBondContact O-N 3.24Å; L744-E746 VanDerWaalsContact C-N 3.3Å; L744-E746 PolarHBondContact O-N 3.18Å; E746-H749 PolarHBondContact O-CE1 2.87Å; E746-H749 PolarHBondContact O-ND1 2.97Å
747	H	86.6	Confident	86.9	Confident	10 Å²	10	71 Å²	71	5%	0.046	34%	0.34	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.9	7.3	-175.7	-70.7	-77.4	0	0	0	115.3	A609 L685 L744 E745 H749 E750 M754	A609-H747 WeakPolarHBondContact CB-CE1 3.33Å; L685-H747 HydrophobicContact CD2-CB 3.64Å; L685-H747 VanDerWaalsContact CD2-ND1 3.35Å; L685-H747 WeakPolarHBondContact CD2-ND1 3.39Å; L744-H747 PolarHBondContact O-N 3.25Å; E745-H747 PolarHBondContact O-N 3.32Å; H747-H749 PolarHBondContact O-N 2.95Å; H747-E750 HydrophobicContact CB-CG 4.5Å; H747-E750 IonicContact CE1-OE1 2.64Å; H747-E750 IonicContact CG-OE1 2.9Å; H747-E750 IonicContact ND1-OE1 2.64Å; H747-E750 PolarHBondContact ND1-OE1 2.97Å; H747-E750 WeakPolarHBondContact O-CG 3.47Å; H747-E750 PolarHBondContact O-N 3.36Å; H747-E750 VanDerWaalsContact O-N 3.09Å; H747-M754 HydrophobicContact CB-CE 3.67Å
748	K	85.6	Confident	87	Confident	118 Å²	118	66.3 Å²	66.3	51%	0.513	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-6.9	-175.6	70.9	-173.2	149.5	-157	0	116.6	L744 E745 L751 F762	L744-K748 PolarHBondContact O-N 3.12Å; E745-K748 WeakPolarHBondContact O-CD 3.4Å; E745-K748 WeakPolarHBondContact O-CE 3.47Å; E745-K748 VanDerWaalsContact O-CG 3.27Å; E745-K748 WeakPolarHBondContact O-CG 3.48Å; E745-K748 PolarHBondContact O-N 3.47Å; E745-K748 WeakPolarHBondContact OE2-CD 3.22Å; E745-K748 IonicContact OE2-NZ 3.86Å; E745-K748 PolarHBondContact OE2-NZ 3.44Å; K748-L751 WeakPolarHBondContact O-CG 3.41Å; K748-F762 HydrophobicContact CB-CE2 4Å; K748-F762 HydrophobicContact CB-CZ 3.88Å
749	H	84.2	Confident	87.2	Confident	149 Å²	149	61.7 Å²	61.7	69%	0.69	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.3	-6.2	-178.5	63	-84.7	0	0	0	113.4	E746 H747	E746-H749 PolarHBondContact O-CE1 2.87Å; E746-H749 PolarHBondContact O-ND1 2.97Å; H747-H749 PolarHBondContact O-N 2.95Å
750	E	84	Confident	87.6	Confident	22 Å²	22	58.5 Å²	58.5	10%	0.103	27%	0.274	C	S	.	.			trans	-131.9	34.2	-178.6	59	175.9	165.5	0	0	113	Y652 L685 H747 D752 R753	Y652-E750 WeakPolarHBondContact CE1-OE2 3.45Å; Y652-E750 PolarHBondContact OH-OE1 3.46Å; Y652-E750 PolarHBondContact OH-OE2 3.28Å; L685-E750 HydrophobicContact CD2-CG 4.15Å; H747-E750 HydrophobicContact CB-CG 4.5Å; H747-E750 IonicContact CE1-OE1 2.64Å; H747-E750 IonicContact CG-OE1 2.9Å; H747-E750 IonicContact ND1-OE1 2.64Å; H747-E750 PolarHBondContact ND1-OE1 2.97Å; H747-E750 WeakPolarHBondContact O-CG 3.47Å; H747-E750 PolarHBondContact O-N 3.36Å; H747-E750 VanDerWaalsContact O-N 3.09Å; E750-D752 PolarHBondContact O-N 2.89Å; E750-D752 VanDerWaalsContact O-N 3.08Å; E750-R753 PolarHBondContact O-N 3.38Å
751	L	83.4	Confident	87.9	Confident	40 Å²	40	58.1 Å²	58.1	21%	0.209	27%	0.272	C	S	.	.	G	3₁₀ helix	trans	-48.1	-39.8	-176.6	-58.9	-178	0	0	0	113.8	K748 R753 M754 R759 F762	K748-L751 WeakPolarHBondContact O-CG 3.41Å; L751-R753 PolarHBondContact O-N 2.97Å; L751-R753 VanDerWaalsContact O-N 3.08Å; L751-M754 HydrophobicContact CD2-CE 3.64Å; L751-M754 HydrophobicContact CD2-SD 3.71Å; L751-M754 WeakPolarHBondContact O-CB 3.41Å; L751-M754 PolarHBondContact O-N 2.69Å; L751-M754 VanDerWaalsContact O-N 3.11Å; L751-R759 WeakPolarHBondContact O-CD 3.41Å; L751-F762 HydrophobicContact CD1-CE1 4.03Å; L751-F762 HydrophobicContact CD2-CD1 3.77Å; L751-F762 HydrophobicContact CD2-CE1 3.55Å; L751-F762 HydrophobicContact CD2-CE2 4.44Å; L751-F762 HydrophobicContact CD2-CG 4.3Å; L751-F762 HydrophobicContact CD2-CZ 3.91Å; L751-F762 HydrophobicContact CG-CE1 4.47Å
752	D	81.8	Confident	88.1	Confident	162 Å²	162	56.3 Å²	56.3	87%	0.866	26%	0.263	S	S	*	.	G	3₁₀ helix	trans	-68.2	-6.3	-177.9	-54.2	-43	0	0	0	114.1	E750	E750-D752 PolarHBondContact O-N 2.89Å; E750-D752 VanDerWaalsContact O-N 3.08Å
753	R	82.3	Confident	88.3	Confident	143 Å²	143	53 Å²	53	54%	0.54	24%	0.244	S	C	.	.	G	3₁₀ helix	trans	-110.7	-4.1	176	-60.7	-178	-178.9	171.4	1.2	113.4	L685 E750 L751	L685-R753 PolarHBondContact N-O 3.44Å; E750-R753 PolarHBondContact O-N 3.38Å; L751-R753 PolarHBondContact O-N 2.97Å; L751-R753 VanDerWaalsContact O-N 3.08Å
754	M	87.3	Confident	88.6	Confident	16 Å²	16	51.1 Å²	51.1	8%	0.079	23%	0.234	C	C	.	.	B	Isolated β-bridge	trans	-65.3	137	176.9	-73.3	178.2	169.2	0	0	111.6	L685 H747 L751 R759 F762	L685-M754 HydrophobicContact CD2-CG 4.06Å; L685-M754 CarbonylContact O-C 3.59Å; L685-M754 WeakPolarHBondContact O-CA 3.27Å; H747-M754 HydrophobicContact CB-CE 3.67Å; L751-M754 HydrophobicContact CD2-CE 3.64Å; L751-M754 HydrophobicContact CD2-SD 3.71Å; L751-M754 WeakPolarHBondContact O-CB 3.41Å; L751-M754 PolarHBondContact O-N 2.69Å; L751-M754 VanDerWaalsContact O-N 3.11Å; M754-R759 HydrophobicContact CB-CB 3.89Å; M754-F762 HydrophobicContact SD-CB 4.3Å
755	A	88.6	Confident	88.9	Confident	9 Å²	9	52.2 Å²	52.2	7%	0.074	24%	0.242	C	C	.	.			trans	-59.2	152.3	168.6	0	0	0	0	0	111.3	E684 L685 A757 D758 R759	E684-A755 HydrophobicContact CG-CB 3.94Å; E684-A755 VanDerWaalsContact OE1-CA 3.27Å; E684-A755 WeakPolarHBondContact OE1-CA 3.35Å; E684-A755 VanDerWaalsContact OE1-CB 3.28Å; E684-A755 WeakPolarHBondContact OE1-CB 3.35Å; L685-A755 WeakPolarHBondContact O-CB 3.48Å; L685-A755 PolarHBondContact O-N 3.17Å; A755-A757 VanDerWaalsContact C-N 3.29Å; A755-A757 PolarHBondContact O-N 3.45Å; A755-A757 VanDerWaalsContact O-N 3.14Å; A755-D758 PolarHBondContact O-N 3.38Å; A755-D758 VanDerWaalsContact O-N 3.13Å; A755-R759 WeakPolarHBondContact O-CB 3.23Å; A755-R759 PolarHBondContact O-N 3.43Å
756	K	89.4	Confident	89	Confident	127 Å²	127	54.4 Å²	54.4	55%	0.552	25%	0.248	S	C	*	.	H	α-helix	trans	-56.4	-37.8	-167.9	-172.1	173.8	-178.1	175.6	0	114.3	L700 F760	L700-K756 HydrophobicContact CD1-CG 4.12Å; K756-F760 WeakPolarHBondContact O-CB 3.47Å; K756-F760 PolarHBondContact O-N 3.04Å; K756-F760 VanDerWaalsContact O-N 3.13Å
757	A	90.6	Very high	89.4	Confident	1 Å²	1	48.3 Å²	48.3	1%	0.008	22%	0.22	C	C	.	.	H	α-helix	trans	-71.2	-47.1	177.9	0	0	0	0	0	112.5	A693 C696 A755 F760 L761	A693-A757 HydrophobicContact CB-CB 3.88Å; C696-A757 HydrophobicContact CB-CB 3.75Å; A755-A757 VanDerWaalsContact C-N 3.29Å; A755-A757 PolarHBondContact O-N 3.45Å; A755-A757 VanDerWaalsContact O-N 3.14Å; A757-F760 PolarHBondContact O-N 2.85Å; A757-L761 PolarHBondContact O-N 3.44Å
758	D	91.6	Very high	89.7	Confident	1 Å²	1	51.1 Å²	51.1	1%	0.005	24%	0.235	C	C	.	.	H	α-helix	trans	-59.4	-46.5	176.4	-55.7	-119.7	0	0	0	110.8	V687 I688 L744 A755 F760 L761 F762	V687-D758 PolarHBondContact N-OD1 3.45Å; I688-D758 WeakPolarHBondContact CB-OD1 3.32Å; I688-D758 HydrophobicContact CG1-CB 4.37Å; I688-D758 WeakPolarHBondContact CG1-OD1 3.32Å; I688-D758 PolarHBondContact N-OD1 2.88Å; L744-D758 HydrophobicContact CD2-CB 3.99Å; A755-D758 PolarHBondContact O-N 3.38Å; A755-D758 VanDerWaalsContact O-N 3.13Å; D758-F760 VanDerWaalsContact C-N 3.35Å; D758-F760 PolarHBondContact O-N 3.22Å; D758-L761 PolarHBondContact O-N 3.03Å; D758-F762 WeakPolarHBondContact O-CB 3.31Å; D758-F762 PolarHBondContact O-N 2.68Å
759	R	91.9	Very high	90.2	Very high	56 Å²	56	48.5 Å²	48.5	21%	0.211	23%	0.225	C	C	.	.	H	α-helix	trans	-60.6	-40.7	175.9	-169.9	79.2	-172.3	88.1	9	112.3	N707 L751 M754 A755 E763	N707-R759 PolarHBondContact ND2-O 3.43Å; L751-R759 WeakPolarHBondContact O-CD 3.41Å; M754-R759 HydrophobicContact CB-CB 3.89Å; A755-R759 WeakPolarHBondContact O-CB 3.23Å; A755-R759 PolarHBondContact O-N 3.43Å; R759-E763 IonicContact CZ-OE1 3.25Å; R759-E763 VanDerWaalsContact CZ-OE1 3.25Å; R759-E763 IonicContact NH1-OE1 2.73Å; R759-E763 PolarHBondContact NH1-OE1 3.09Å; R759-E763 IonicContact NH2-OE1 2.87Å; R759-E763 PolarHBondContact NH2-OE1 3.44Å; R759-E763 PolarHBondContact O-N 3.24Å
760	F	95	Very high	90.7	Very high	1 Å²	1	42 Å²	42	0%	0.004	19%	0.194	C	C	.	.	H	α-helix	trans	-64.3	-52.4	175.4	163.9	-101.8	0	0	0	111.6	L700 I710 L731 K756 A757 D758 F762 E763 M764	L700-F760 HydrophobicContact CD1-CB 3.77Å; L700-F760 HydrophobicContact CD1-CD1 4.36Å; L700-F760 HydrophobicContact CD1-CD2 4.43Å; L700-F760 HydrophobicContact CD1-CG 3.94Å; L700-F760 HydrophobicContact CD2-CD2 3.69Å; L700-F760 HydrophobicContact CD2-CE2 4.02Å; L700-F760 HydrophobicContact CD2-CG 4.02Å; L700-F760 HydrophobicContact CG-CG 4.44Å; I710-F760 HydrophobicContact CD1-CD2 4.23Å; I710-F760 HydrophobicContact CD1-CE2 3.94Å; L731-F760 HydrophobicContact CD2-CE2 4.19Å; L731-F760 HydrophobicContact CD2-CZ 3.73Å; K756-F760 WeakPolarHBondContact O-CB 3.47Å; K756-F760 PolarHBondContact O-N 3.04Å; K756-F760 VanDerWaalsContact O-N 3.13Å; A757-F760 PolarHBondContact O-N 2.85Å; D758-F760 VanDerWaalsContact C-N 3.35Å; D758-F760 PolarHBondContact O-N 3.22Å; F760-F762 VanDerWaalsContact C-N 3.27Å; F760-F762 PolarHBondContact O-N 2.9Å; F760-E763 PolarHBondContact O-N 3.18Å; F760-M764 HydrophobicContact CD2-CE 4.14Å; F760-M764 HydrophobicContact CD2-CG 3.76Å; F760-M764 HydrophobicContact CD2-SD 4.31Å; F760-M764 HydrophobicContact CE1-CG 4.21Å; F760-M764 HydrophobicContact CE2-CE 4.11Å; F760-M764 HydrophobicContact CE2-CG 3.33Å; F760-M764 HydrophobicContact CE2-SD 3.73Å; F760-M764 HydrophobicContact CG-CG 4.38Å; F760-M764 HydrophobicContact CZ-CG 3.58Å; F760-M764 HydrophobicContact CZ-SD 4.36Å; F760-M764 WeakPolarHBondContact O-CG 3.36Å; F760-M764 PolarHBondContact O-N 3Å
761	L	93.9	Very high	91.2	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-60.7	-38.3	179.4	-69.2	174.1	0	0	0	111.4	I688 F734 P736 L744 A757 D758 S765	I688-L761 HydrophobicContact CD1-CD1 4.05Å; I688-L761 HydrophobicContact CG1-CD1 4.11Å; I688-L761 HydrophobicContact CG2-CD1 4.29Å; F734-L761 VanDerWaalsContact O-CD2 3.3Å; F734-L761 WeakPolarHBondContact O-CD2 3.24Å; P736-L761 HydrophobicContact CB-CD2 4.42Å; P736-L761 HydrophobicContact CG-CB 4.33Å; P736-L761 HydrophobicContact CG-CD2 3.97Å; P736-L761 WeakPolarHBondContact CG-O 3.2Å; L744-L761 HydrophobicContact CD1-CB 3.99Å; A757-L761 PolarHBondContact O-N 3.44Å; D758-L761 PolarHBondContact O-N 3.03Å; L761-S765 WeakPolarHBondContact O-CB 3.29Å; L761-S765 PolarHBondContact O-N 3.12Å
762	F	93.3	Very high	91.8	Very high	11 Å²	11	45.9 Å²	45.9	5%	0.048	21%	0.211	C	C	.	.	H	α-helix	trans	-61	-53.3	172.7	-175.7	-93	0	0	0	112.1	L744 K748 L751 M754 D758 F760 M764 S765 R766	L744-F762 HydrophobicContact CB-CB 4.49Å; L744-F762 HydrophobicContact CB-CD2 3.91Å; L744-F762 HydrophobicContact CD1-CB 4.29Å; K748-F762 HydrophobicContact CB-CE2 4Å; K748-F762 HydrophobicContact CB-CZ 3.88Å; L751-F762 HydrophobicContact CD1-CE1 4.03Å; L751-F762 HydrophobicContact CD2-CD1 3.77Å; L751-F762 HydrophobicContact CD2-CE1 3.55Å; L751-F762 HydrophobicContact CD2-CE2 4.44Å; L751-F762 HydrophobicContact CD2-CG 4.3Å; L751-F762 HydrophobicContact CD2-CZ 3.91Å; L751-F762 HydrophobicContact CG-CE1 4.47Å; M754-F762 HydrophobicContact SD-CB 4.3Å; D758-F762 WeakPolarHBondContact O-CB 3.31Å; D758-F762 PolarHBondContact O-N 2.68Å; F760-F762 VanDerWaalsContact C-N 3.27Å; F760-F762 PolarHBondContact O-N 2.9Å; F762-M764 VanDerWaalsContact C-N 3.35Å; F762-M764 PolarHBondContact O-N 3.22Å; F762-S765 WeakPolarHBondContact O-CB 3.32Å; F762-S765 PolarHBondContact O-N 3.26Å; F762-S765 VanDerWaalsContact O-N 3.11Å; F762-S765 PolarHBondContact O-OG 3.01Å; F762-R766 HydrophobicContact CD1-CG 4.41Å; F762-R766 HydrophobicContact CE1-CG 4.11Å; F762-R766 WeakPolarHBondContact O-CG 3.48Å; F762-R766 PolarHBondContact O-N 3.48Å
763	E	93.3	Very high	92.5	Very high	19 Å²	19	38.3 Å²	38.3	9%	0.089	17%	0.171	C	C	.	.	H	α-helix	trans	-61.4	-40	179.7	-79	-56.5	143.6	0	0	113	N707 K711 R759 F760 S765 R766	N707-E763 HydrophobicContact CB-CB 4.09Å; N707-E763 HydrophobicContact CB-CG 4.07Å; K711-E763 IonicContact NZ-OE2 3.77Å; K711-E763 PolarHBondContact NZ-OE2 3.02Å; R759-E763 IonicContact CZ-OE1 3.25Å; R759-E763 VanDerWaalsContact CZ-OE1 3.25Å; R759-E763 IonicContact NH1-OE1 2.73Å; R759-E763 PolarHBondContact NH1-OE1 3.09Å; R759-E763 IonicContact NH2-OE1 2.87Å; R759-E763 PolarHBondContact NH2-OE1 3.44Å; R759-E763 PolarHBondContact O-N 3.24Å; F760-E763 PolarHBondContact O-N 3.18Å; E763-S765 VanDerWaalsContact C-N 3.29Å; E763-S765 PolarHBondContact O-N 3.35Å; E763-R766 WeakPolarHBondContact O-CB 3.29Å; E763-R766 PolarHBondContact O-N 3.41Å; E763-R766 VanDerWaalsContact O-N 3.1Å
764	M	95.1	Very high	93.2	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-64.5	-35.2	176.2	-64	-51.1	102.9	0	0	111.4	N707 I710 P736 F760 F762 R766 I767 Y770	N707-M764 HydrophobicContact CB-CE 4.33Å; I710-M764 HydrophobicContact CB-CE 4.19Å; I710-M764 HydrophobicContact CB-SD 4.42Å; I710-M764 HydrophobicContact CG2-CE 4.05Å; I710-M764 HydrophobicContact CG2-SD 3.62Å; P736-M764 HydrophobicContact CG-CB 3.88Å; F760-M764 HydrophobicContact CD2-CE 4.14Å; F760-M764 HydrophobicContact CD2-CG 3.76Å; F760-M764 HydrophobicContact CD2-SD 4.31Å; F760-M764 HydrophobicContact CE1-CG 4.21Å; F760-M764 HydrophobicContact CE2-CE 4.11Å; F760-M764 HydrophobicContact CE2-CG 3.33Å; F760-M764 HydrophobicContact CE2-SD 3.73Å; F760-M764 HydrophobicContact CG-CG 4.38Å; F760-M764 HydrophobicContact CZ-CG 3.58Å; F760-M764 HydrophobicContact CZ-SD 4.36Å; F760-M764 WeakPolarHBondContact O-CG 3.36Å; F760-M764 PolarHBondContact O-N 3Å; F762-M764 VanDerWaalsContact C-N 3.35Å; F762-M764 PolarHBondContact O-N 3.22Å; M764-R766 PolarHBondContact O-N 2.84Å; M764-I767 HydrophobicContact CE-CD1 4.35Å; M764-I767 WeakPolarHBondContact O-CB 3.42Å; M764-I767 PolarHBondContact O-N 3.45Å; M764-I767 VanDerWaalsContact O-N 3.14Å; M764-I767 HydrophobicContact SD-CD1 4.01Å; M764-Y770 HydrophobicContact CB-CD1 4.32Å; M764-Y770 HydrophobicContact CB-CD2 4Å; M764-Y770 HydrophobicContact CB-CE1 4.05Å; M764-Y770 HydrophobicContact CB-CE2 3.69Å; M764-Y770 HydrophobicContact CB-CG 4.29Å; M764-Y770 HydrophobicContact CG-CE1 4.44Å; M764-Y770 HydrophobicContact CG-CE2 3.75Å; M764-Y770 HydrophobicContact SD-CD2 4.24Å; M764-Y770 HydrophobicContact SD-CE2 3.35Å; M764-Y770 WeakPolarHBondContact SD-CE2 3.42Å
765	S	93.3	Very high	93.6	Very high	24 Å²	24	34.7 Å²	34.7	17%	0.168	16%	0.16	C	C	.	.	H	α-helix	trans	-64.9	-19	174.2	80.7	0	0	0	0	114.2	L761 F762 E763 I767	L761-S765 WeakPolarHBondContact O-CB 3.29Å; L761-S765 PolarHBondContact O-N 3.12Å; F762-S765 WeakPolarHBondContact O-CB 3.32Å; F762-S765 PolarHBondContact O-N 3.26Å; F762-S765 VanDerWaalsContact O-N 3.11Å; F762-S765 PolarHBondContact O-OG 3.01Å; E763-S765 VanDerWaalsContact C-N 3.29Å; E763-S765 PolarHBondContact O-N 3.35Å; S765-I767 VanDerWaalsContact C-N 3.27Å
766	R	92.9	Very high	94	Very high	96 Å²	96	34.4 Å²	34.4	36%	0.362	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.3	-8.9	176.6	-56.2	-56.2	87.6	176.3	13.1	113	E745 F762 E763 M764	E745-R766 IonicContact OE1-CZ 3.71Å; E745-R766 IonicContact OE1-NH1 2.64Å; E745-R766 PolarHBondContact OE1-NH1 2.87Å; E745-R766 IonicContact OE1-NH2 2.69Å; E745-R766 PolarHBondContact OE1-NH2 3.17Å; F762-R766 HydrophobicContact CD1-CG 4.41Å; F762-R766 HydrophobicContact CE1-CG 4.11Å; F762-R766 WeakPolarHBondContact O-CG 3.48Å; F762-R766 PolarHBondContact O-N 3.48Å; E763-R766 WeakPolarHBondContact O-CB 3.29Å; E763-R766 PolarHBondContact O-N 3.41Å; E763-R766 VanDerWaalsContact O-N 3.1Å; M764-R766 PolarHBondContact O-N 2.84Å
767	I	94	Very high	94.4	Very high	10 Å²	10	28.3 Å²	28.3	5%	0.051	13%	0.131	C	C	.	.	S	Bend	trans	-88.4	117.6	179.8	-58.6	171.3	0	0	0	108.4	K711 I714 L715 M764 S765 H769 Y770	K711-I767 HydrophobicContact CB-CD1 4.02Å; K711-I767 HydrophobicContact CG-CD1 3.86Å; K711-I767 HydrophobicContact CG-CG1 4.02Å; I714-I767 HydrophobicContact CG2-CG2 4.47Å; L715-I767 HydrophobicContact CD2-CG2 4.35Å; M764-I767 HydrophobicContact CE-CD1 4.35Å; M764-I767 WeakPolarHBondContact O-CB 3.42Å; M764-I767 PolarHBondContact O-N 3.45Å; M764-I767 VanDerWaalsContact O-N 3.14Å; M764-I767 HydrophobicContact SD-CD1 4.01Å; S765-I767 VanDerWaalsContact C-N 3.27Å; I767-H769 PolarHBondContact O-N 2.98Å; I767-Y770 HydrophobicContact CB-CD2 4.05Å; I767-Y770 HydrophobicContact CD1-CD2 3.82Å; I767-Y770 HydrophobicContact CD1-CE2 4.14Å; I767-Y770 HydrophobicContact CG1-CD2 4.47Å; I767-Y770 HydrophobicContact CG2-CD2 4.31Å; I767-Y770 PolarHBondContact O-N 3.29Å
768	N	92.8	Very high	94.7	Very high	68 Å²	68	29.8 Å²	29.8	36%	0.364	14%	0.136	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.8	124.2	179.5	-176.4	31.1	0	0	0	110.9	Y770 R773 Y912	N768-Y770 VanDerWaalsContact C-N 3.26Å; N768-Y770 PolarHBondContact O-N 3.08Å; N768-R773 WeakPolarHBondContact O-CD 3.47Å; N768-R773 PolarHBondContact O-NE 3.08Å; N768-Y912 PolarHBondContact ND2-OH 2.95Å; N768-Y912 PolarHBondContact OD1-OH 3.46Å
769	H	95.1	Very high	94.9	Very high	64 Å²	64	30.2 Å²	30.2	30%	0.296	14%	0.138	S	C	.	.	T	Hydrogen-bonded Turn	trans	52	41.5	-176.8	-81.5	-145.8	0	0	0	113.5	I767 Q771 Q772 R773 E909 Y912	I767-H769 PolarHBondContact O-N 2.98Å; H769-Q771 VanDerWaalsContact C-N 3.27Å; H769-Q771 PolarHBondContact O-N 2.84Å; H769-Q771 VanDerWaalsContact O-N 3.15Å; H769-Q772 HydrophobicContact CB-CB 4.26Å; H769-Q772 PolarHBondContact O-N 3.1Å; H769-Q772 VanDerWaalsContact O-N 3.09Å; H769-Q772 PolarHBondContact O-OE1 3.25Å; H769-R773 WeakPolarHBondContact O-CG 3.37Å; H769-R773 PolarHBondContact O-N 3.4Å; H769-E909 WeakPolarHBondContact CB-OE1 3.32Å; H769-E909 IonicContact CE1-OE2 3.78Å; H769-E909 IonicContact CG-OE1 2.99Å; H769-E909 IonicContact CG-OE2 2.79Å; H769-E909 IonicContact ND1-OE1 2.8Å; H769-E909 PolarHBondContact ND1-OE1 2.82Å; H769-E909 IonicContact ND1-OE2 3.1Å; H769-E909 PolarHBondContact ND1-OE2 3.07Å; H769-Y912 HydrophobicContact CB-CE1 4.25Å; H769-Y912 AromaticContact CD2-CE1 3.53Å; H769-Y912 AromaticContact CD2-CZ 3.82Å; H769-Y912 AromaticContact CE1-CD1 3.36Å; H769-Y912 WeakPolarHBondContact CE1-CD1 3.3Å; H769-Y912 AromaticContact CE1-CE1 3.32Å; H769-Y912 WeakPolarHBondContact CE1-CE1 3.42Å; H769-Y912 AromaticContact CE1-CE2 3.96Å; H769-Y912 AromaticContact CE1-CG 3.72Å; H769-Y912 AromaticContact CE1-CZ 3.64Å; H769-Y912 AromaticContact CG-CD1 3.85Å; H769-Y912 AromaticContact CG-CE1 3.47Å; H769-Y912 VanDerWaalsContact CG-CE1 3.47Å; H769-Y912 AromaticContact ND1-CD1 3.25Å; H769-Y912 VanDerWaalsContact ND1-CD1 3.25Å; H769-Y912 WeakPolarHBondContact ND1-CD1 3.48Å; H769-Y912 AromaticContact ND1-CE1 3.33Å; H769-Y912 VanDerWaalsContact ND1-CE1 3.33Å; H769-Y912 WeakPolarHBondContact ND1-CE1 3.38Å; H769-Y912 AromaticContact ND1-CG 3.99Å; H769-Y912 AromaticContact NE2-CE1 3.48Å; H769-Y912 WeakPolarHBondContact NE2-CE1 3.49Å; H769-Y912 AromaticContact NE2-CE2 3.98Å; H769-Y912 AromaticContact NE2-CZ 3.47Å
770	Y	95.6	Very high	95.2	Very high	11 Å²	11	30.3 Å²	30.3	4%	0.043	14%	0.14	C	C	.	.	H	α-helix	trans	-41.4	-51	178	176.6	-104.3	0	0	0	113.9	I714 V735 M764 I767 N768 L774	I714-Y770 HydrophobicContact CD1-CD2 4.22Å; I714-Y770 HydrophobicContact CD1-CE2 3.44Å; I714-Y770 VanDerWaalsContact CD1-CE2 3.44Å; V735-Y770 HydrophobicContact CG1-CD1 4.29Å; V735-Y770 HydrophobicContact CG2-CD1 4.43Å; V735-Y770 HydrophobicContact CG2-CE1 4.14Å; M764-Y770 HydrophobicContact CB-CD1 4.32Å; M764-Y770 HydrophobicContact CB-CD2 4Å; M764-Y770 HydrophobicContact CB-CE1 4.05Å; M764-Y770 HydrophobicContact CB-CE2 3.69Å; M764-Y770 HydrophobicContact CB-CG 4.29Å; M764-Y770 HydrophobicContact CG-CE1 4.44Å; M764-Y770 HydrophobicContact CG-CE2 3.75Å; M764-Y770 HydrophobicContact SD-CD2 4.24Å; M764-Y770 HydrophobicContact SD-CE2 3.35Å; M764-Y770 WeakPolarHBondContact SD-CE2 3.42Å; I767-Y770 HydrophobicContact CB-CD2 4.05Å; I767-Y770 HydrophobicContact CD1-CD2 3.82Å; I767-Y770 HydrophobicContact CD1-CE2 4.14Å; I767-Y770 HydrophobicContact CG1-CD2 4.47Å; I767-Y770 HydrophobicContact CG2-CD2 4.31Å; I767-Y770 PolarHBondContact O-N 3.29Å; N768-Y770 VanDerWaalsContact C-N 3.26Å; N768-Y770 PolarHBondContact O-N 3.08Å; Y770-L774 HydrophobicContact CE1-CD2 4.03Å; Y770-L774 WeakPolarHBondContact O-CB 3.49Å; Y770-L774 PolarHBondContact O-N 2.84Å
771	Q	94.8	Very high	95.2	Very high	81 Å²	81	31.2 Å²	31.2	38%	0.379	14%	0.144	S	C	.	.	H	α-helix	trans	-63.1	-45.5	-177	-178.1	176.2	10.9	0	0	111.9	V735 H769 L774 Q775	V735-Q771 HydrophobicContact CG1-CB 3.92Å; V735-Q771 HydrophobicContact CG1-CG 4.17Å; V735-Q771 HydrophobicContact CG2-CB 4.41Å; V735-Q771 HydrophobicContact CG2-CG 4.19Å; H769-Q771 VanDerWaalsContact C-N 3.27Å; H769-Q771 PolarHBondContact O-N 2.84Å; H769-Q771 VanDerWaalsContact O-N 3.15Å; Q771-L774 PolarHBondContact O-N 2.95Å; Q771-Q775 WeakPolarHBondContact O-CB 3.4Å; Q771-Q775 WeakPolarHBondContact O-CG 3.5Å; Q771-Q775 PolarHBondContact O-N 2.89Å
772	Q	95.7	Very high	95.3	Very high	63 Å²	63	32.8 Å²	32.8	29%	0.294	15%	0.151	S	C	.	.	H	α-helix	trans	-72.4	-38.3	-175.9	-62.4	70.3	17.4	0	0	110.9	H769 Q775 S776 E909	H769-Q772 HydrophobicContact CB-CB 4.26Å; H769-Q772 PolarHBondContact O-N 3.1Å; H769-Q772 VanDerWaalsContact O-N 3.09Å; H769-Q772 PolarHBondContact O-OE1 3.25Å; Q772-Q775 PolarHBondContact O-N 3.42Å; Q772-S776 VanDerWaalsContact O-CB 3.32Å; Q772-S776 WeakPolarHBondContact O-CB 3.31Å; Q772-S776 PolarHBondContact O-N 3.07Å; Q772-S776 PolarHBondContact O-OG 3.41Å; Q772-E909 HydrophobicContact CB-CB 4.27Å; Q772-E909 HydrophobicContact CB-CG 3.73Å; Q772-E909 WeakPolarHBondContact CB-OE2 3.44Å
773	R	96.6	Very high	95.4	Very high	4 Å²	4	33 Å²	33	2%	0.015	15%	0.151	C	C	.	.	H	α-helix	trans	-62.2	-46.9	171.8	-70	178.9	174.5	-112.9	3.3	111.8	I714 N768 H769 S776 L777 D922 F924	I714-R773 HydrophobicContact CG2-CB 4.01Å; N768-R773 WeakPolarHBondContact O-CD 3.47Å; N768-R773 PolarHBondContact O-NE 3.08Å; H769-R773 WeakPolarHBondContact O-CG 3.37Å; H769-R773 PolarHBondContact O-N 3.4Å; R773-S776 PolarHBondContact O-N 2.93Å; R773-L777 WeakPolarHBondContact O-CB 3.4Å; R773-L777 PolarHBondContact O-N 3.23Å; R773-D922 IonicContact CZ-OD1 3.31Å; R773-D922 IonicContact CZ-OD2 3.97Å; R773-D922 IonicContact NH1-OD1 2.67Å; R773-D922 PolarHBondContact NH1-OD1 2.68Å; R773-D922 IonicContact NH1-OD2 2.74Å; R773-D922 PolarHBondContact NH1-OD2 3Å; R773-D922 VanDerWaalsContact NH1-OD2 3.1Å; R773-D922 IonicContact NH2-OD1 3.29Å; R773-D922 IonicContact NH2-OD2 2.77Å; R773-D922 PolarHBondContact NH2-OD2 3.47Å; R773-F924 HydrophobicContact CB-CD2 4.37Å; R773-F924 HydrophobicContact CB-CE2 4.16Å; R773-F924 HydrophobicContact CG-CD2 3.91Å; R773-F924 HydrophobicContact CG-CE2 3.89Å
774	L	96.3	Very high	95.5	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-64.2	-41.5	177.5	-175.9	69.4	0	0	0	112.1	I714 L728 L731 L732 V735 Y770 Q771 S776 L777 Y778	I714-L774 HydrophobicContact CD1-CD1 4.04Å; I714-L774 HydrophobicContact CG1-CD1 4.42Å; L728-L774 HydrophobicContact CD2-CD1 3.55Å; L731-L774 HydrophobicContact CB-CD1 4.09Å; L731-L774 HydrophobicContact CB-CD2 3.68Å; L731-L774 HydrophobicContact CB-CG 4.47Å; L731-L774 HydrophobicContact CD1-CD1 4.01Å; L732-L774 HydrophobicContact CD2-CB 4.23Å; L732-L774 HydrophobicContact CD2-CD2 3.72Å; L732-L774 HydrophobicContact CD2-CG 3.78Å; L732-L774 HydrophobicContact CG-CD2 3.85Å; L732-L774 HydrophobicContact CG-CG 3.95Å; V735-L774 HydrophobicContact CG2-CD2 4.48Å; Y770-L774 HydrophobicContact CE1-CD2 4.03Å; Y770-L774 WeakPolarHBondContact O-CB 3.49Å; Y770-L774 PolarHBondContact O-N 2.84Å; Q771-L774 PolarHBondContact O-N 2.95Å; L774-S776 VanDerWaalsContact C-N 3.34Å; L774-L777 PolarHBondContact O-N 3.46Å; L774-Y778 WeakPolarHBondContact O-CB 3.16Å; L774-Y778 PolarHBondContact O-N 3.09Å
775	Q	96.4	Very high	95.5	Very high	83 Å²	83	39.1 Å²	39.1	39%	0.388	19%	0.192	S	C	.	.	H	α-helix	trans	-61	-42.4	172.3	-77.5	174.5	-10.6	0	0	111.6	L732 Q771 Q772 Y778 F779	L732-Q775 HydrophobicContact CD2-CB 4.36Å; L732-Q775 HydrophobicContact CD2-CG 3.44Å; L732-Q775 VanDerWaalsContact CD2-CG 3.44Å; Q771-Q775 WeakPolarHBondContact O-CB 3.4Å; Q771-Q775 WeakPolarHBondContact O-CG 3.5Å; Q771-Q775 PolarHBondContact O-N 2.89Å; Q772-Q775 PolarHBondContact O-N 3.42Å; Q775-Y778 PolarHBondContact O-N 2.96Å; Q775-F779 VanDerWaalsContact O-CB 3.31Å; Q775-F779 WeakPolarHBondContact O-CB 3.45Å; Q775-F779 PolarHBondContact O-N 2.95Å
776	S	97	Very high	95.5	Very high	2 Å²	2	40.8 Å²	40.8	1%	0.014	20%	0.195	C	C	.	.	H	α-helix	trans	-66.7	-41.2	179	-60.1	0	0	0	0	112.6	Q772 R773 L774 F779 K780	Q772-S776 VanDerWaalsContact O-CB 3.32Å; Q772-S776 WeakPolarHBondContact O-CB 3.31Å; Q772-S776 PolarHBondContact O-N 3.07Å; Q772-S776 PolarHBondContact O-OG 3.41Å; R773-S776 PolarHBondContact O-N 2.93Å; L774-S776 VanDerWaalsContact C-N 3.34Å; S776-F779 PolarHBondContact O-N 2.89Å; S776-K780 WeakPolarHBondContact O-CB 3.23Å; S776-K780 PolarHBondContact O-N 2.94Å
777	L	97.1	Very high	95.6	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-64	-45.8	174.3	175.2	57.2	0	0	0	111.8	M717 D718 L723 L728 R773 L774 K780 K781	M717-L777 HydrophobicContact CE-CB 3.95Å; M717-L777 HydrophobicContact CE-CD1 4.13Å; M717-L777 WeakPolarHBondContact O-CD1 3.48Å; M717-L777 HydrophobicContact SD-CB 4.16Å; D718-L777 HydrophobicContact CB-CD1 3.8Å; D718-L777 HydrophobicContact CB-CD2 3.97Å; D718-L777 HydrophobicContact CB-CG 4.48Å; L723-L777 HydrophobicContact CD1-CD2 4.09Å; L728-L777 HydrophobicContact CD1-CD2 4.45Å; L728-L777 HydrophobicContact CD1-CG 4.03Å; L728-L777 HydrophobicContact CD2-CD2 3.7Å; L728-L777 HydrophobicContact CD2-CG 4.03Å; R773-L777 WeakPolarHBondContact O-CB 3.4Å; R773-L777 PolarHBondContact O-N 3.23Å; L774-L777 PolarHBondContact O-N 3.46Å; L777-K780 PolarHBondContact O-N 2.97Å; L777-K781 HydrophobicContact CD1-CG 4.48Å; L777-K781 PolarHBondContact O-N 2.79Å
778	Y	96.9	Very high	95.6	Very high	32 Å²	32	39.5 Å²	39.5	13%	0.125	21%	0.205	C	C	.	.	H	α-helix	trans	-61.8	-44.1	175.3	177.8	-117.4	0	0	0	112.1	K725 L728 E729 L732 L774 Q775 K781 K782	K725-Y778 WeakPolarHBondContact O-CE2 3.28Å; L728-Y778 HydrophobicContact CB-CD2 3.82Å; L728-Y778 HydrophobicContact CB-CG 4.43Å; E729-Y778 HydrophobicContact CB-CE2 3.82Å; E729-Y778 HydrophobicContact CG-CE2 4.19Å; E729-Y778 WeakPolarHBondContact CG-OH 3.2Å; E729-Y778 PolarHBondContact OE2-OH 3.04Å; L732-Y778 HydrophobicContact CD1-CD1 3.46Å; L732-Y778 VanDerWaalsContact CD1-CD1 3.46Å; L732-Y778 HydrophobicContact CD1-CD2 4.43Å; L732-Y778 HydrophobicContact CD1-CE1 4.06Å; L732-Y778 HydrophobicContact CD1-CG 3.67Å; L774-Y778 WeakPolarHBondContact O-CB 3.16Å; L774-Y778 PolarHBondContact O-N 3.09Å; Q775-Y778 PolarHBondContact O-N 2.96Å; Y778-K781 PolarHBondContact O-N 2.72Å; Y778-K782 HydrophobicContact CD2-CD 4.43Å; Y778-K782 HydrophobicContact CD2-CG 4.37Å; Y778-K782 HydrophobicContact CE1-CD 4.42Å; Y778-K782 HydrophobicContact CE2-CD 3.59Å; Y778-K782 HydrophobicContact CE2-CG 3.98Å; Y778-K782 PolarHBondContact O-N 3.38Å; Y778-K782 WeakPolarHBondContact OH-CD 3.28Å; Y778-K782 WeakPolarHBondContact OH-CE 3.24Å; Y778-K782 PolarHBondContact OH-NZ 2.84Å
779	F	97.2	Very high	95.7	Very high	10 Å²	10	41.3 Å²	41.3	4%	0.044	21%	0.212	C	C	.	.	H	α-helix	trans	-62.3	-46.4	175.3	-173.5	-97.3	0	0	0	111.5	Q775 S776 K781 K782 F783 L899 L903 V906 F931	Q775-F779 VanDerWaalsContact O-CB 3.31Å; Q775-F779 WeakPolarHBondContact O-CB 3.45Å; Q775-F779 PolarHBondContact O-N 2.95Å; S776-F779 PolarHBondContact O-N 2.89Å; F779-K781 PolarHBondContact O-N 3.22Å; F779-K782 CarbonylContact O-C 3.44Å; F779-K782 PolarHBondContact O-N 2.94Å; F779-K782 VanDerWaalsContact O-N 3.15Å; F779-F783 AromaticContact CE1-CD2 3.72Å; F779-F783 HydrophobicContact CE1-CD2 3.72Å; F779-F783 HydrophobicContact CE1-CE2 4.42Å; F779-F783 AromaticContact CZ-CD2 3.76Å; F779-F783 HydrophobicContact CZ-CD2 3.76Å; F779-F783 HydrophobicContact CZ-CE2 4.34Å; F779-F783 WeakPolarHBondContact O-CB 3.3Å; F779-F783 PolarHBondContact O-N 3.36Å; F779-L899 HydrophobicContact CE2-CD2 4.37Å; F779-L899 HydrophobicContact CZ-CD2 4.27Å; F779-L899 WeakPolarHBondContact CZ-O 3.17Å; F779-L903 HydrophobicContact CE1-CB 4.01Å; F779-L903 HydrophobicContact CE1-CD1 4.21Å; F779-L903 HydrophobicContact CZ-CB 3.94Å; F779-L903 VanDerWaalsContact CZ-N 3.26Å; F779-V906 HydrophobicContact CB-CG2 4.13Å; F779-V906 HydrophobicContact CD1-CG2 3.79Å; F779-V906 HydrophobicContact CG-CG2 4.17Å; F779-F931 AromaticContact CD1-CE1 3.85Å; F779-F931 HydrophobicContact CD1-CE1 3.85Å; F779-F931 AromaticContact CD1-CZ 3.79Å; F779-F931 HydrophobicContact CD1-CZ 3.79Å; F779-F931 HydrophobicContact CE1-CE1 4.08Å; F779-F931 AromaticContact CE1-CZ 3.87Å; F779-F931 HydrophobicContact CE1-CZ 3.87Å
780	K	96.4	Very high	95.7	Very high	57 Å²	57	38.3 Å²	38.3	25%	0.248	20%	0.198	C	C	.	.	H	α-helix	trans	-53.1	-48.9	173.6	168	173.4	170	-87.9	0	111.9	M717 S776 L777 K782 V927 F931	M717-K780 HydrophobicContact CE-CD 3.98Å; M717-K780 PolarHBondContact O-NZ 3.16Å; S776-K780 WeakPolarHBondContact O-CB 3.23Å; S776-K780 PolarHBondContact O-N 2.94Å; L777-K780 PolarHBondContact O-N 2.97Å; K780-K782 PolarHBondContact O-N 2.93Å; K780-V927 HydrophobicContact CD-CG1 4.13Å; K780-F931 HydrophobicContact CB-CD1 4.47Å; K780-F931 HydrophobicContact CB-CD2 4.22Å; K780-F931 HydrophobicContact CB-CE1 4.43Å; K780-F931 HydrophobicContact CB-CE2 4.18Å; K780-F931 HydrophobicContact CB-CG 4.37Å; K780-F931 HydrophobicContact CB-CZ 4.29Å; K780-F931 HydrophobicContact CD-CG 4.47Å; K780-F931 HydrophobicContact CG-CD2 3.98Å; K780-F931 HydrophobicContact CG-CE2 4.28Å; K780-F931 HydrophobicContact CG-CG 4.3Å
781	K	96.1	Very high	95.7	Very high	21 Å²	21	41 Å²	41	9%	0.091	21%	0.21	C	C	.	.	H	α-helix	trans	-70.1	-27.6	179.3	-65.9	-155.7	-168.9	-131.5	0	113.8	D718 E721 L723 K725 L728 L777 Y778 F779	D718-K781 WeakPolarHBondContact OD2-CE 3.42Å; D718-K781 IonicContact OD2-NZ 3.61Å; D718-K781 PolarHBondContact OD2-NZ 3.46Å; E721-K781 IonicContact OE1-NZ 2.69Å; E721-K781 PolarHBondContact OE1-NZ 3.26Å; E721-K781 IonicContact OE2-NZ 2.81Å; E721-K781 PolarHBondContact OE2-NZ 2.93Å; L723-K781 WeakPolarHBondContact O-CE 3.29Å; L723-K781 PolarHBondContact O-NZ 3Å; K725-K781 WeakPolarHBondContact CE-O 3.37Å; K725-K781 HydrophobicContact CG-CB 4.04Å; K725-K781 HydrophobicContact CG-CD 4.41Å; K725-K781 PolarHBondContact NZ-O 3.12Å; L728-K781 HydrophobicContact CD1-CD 3.91Å; L728-K781 HydrophobicContact CD1-CG 4.38Å; L777-K781 HydrophobicContact CD1-CG 4.48Å; L777-K781 PolarHBondContact O-N 2.79Å; Y778-K781 PolarHBondContact O-N 2.72Å; F779-K781 PolarHBondContact O-N 3.22Å
782	K	95.7	Very high	95.8	Very high	33 Å²	33	41 Å²	41	14%	0.143	22%	0.217	C	C	.	.	H	α-helix	trans	-97.3	-0.1	178.3	-70.5	-151.8	166.1	172	0	115.4	K725 E729 Y778 F779 K780 E785 R786	K725-K782 HydrophobicContact CD-CG 4.43Å; E729-K782 IonicContact OE2-NZ 3.6Å; E729-K782 PolarHBondContact OE2-NZ 3.16Å; Y778-K782 HydrophobicContact CD2-CD 4.43Å; Y778-K782 HydrophobicContact CD2-CG 4.37Å; Y778-K782 HydrophobicContact CE1-CD 4.42Å; Y778-K782 HydrophobicContact CE2-CD 3.59Å; Y778-K782 HydrophobicContact CE2-CG 3.98Å; Y778-K782 PolarHBondContact O-N 3.38Å; Y778-K782 WeakPolarHBondContact OH-CD 3.28Å; Y778-K782 WeakPolarHBondContact OH-CE 3.24Å; Y778-K782 PolarHBondContact OH-NZ 2.84Å; F779-K782 CarbonylContact O-C 3.44Å; F779-K782 PolarHBondContact O-N 2.94Å; F779-K782 VanDerWaalsContact O-N 3.15Å; K780-K782 PolarHBondContact O-N 2.93Å; K782-E785 HydrophobicContact CB-CG 4.26Å; K782-E785 WeakPolarHBondContact CD-OE1 3.29Å; K782-E785 WeakPolarHBondContact CE-OE1 3.47Å; K782-E785 WeakPolarHBondContact CG-OE1 3.18Å; K782-E785 VanDerWaalsContact O-CG 3.23Å; K782-E785 WeakPolarHBondContact O-CG 3.45Å; K782-R786 WeakPolarHBondContact O-CD 3.28Å; K782-R786 VanDerWaalsContact O-CG 3.28Å; K782-R786 WeakPolarHBondContact O-CG 3.32Å; K782-R786 PolarHBondContact O-N 3.4Å
783	F	96.3	Very high	95.8	Very high	15 Å²	15	40.1 Å²	40.1	7%	0.066	21%	0.212	C	C	.	.	H	α-helix	trans	-66.3	-50.6	-177.9	-177.7	-99.2	0	0	0	112.4	F779 E785 R786 V787 L899 F931 A935 F939	F779-F783 AromaticContact CE1-CD2 3.72Å; F779-F783 HydrophobicContact CE1-CD2 3.72Å; F779-F783 HydrophobicContact CE1-CE2 4.42Å; F779-F783 AromaticContact CZ-CD2 3.76Å; F779-F783 HydrophobicContact CZ-CD2 3.76Å; F779-F783 HydrophobicContact CZ-CE2 4.34Å; F779-F783 WeakPolarHBondContact O-CB 3.3Å; F779-F783 PolarHBondContact O-N 3.36Å; F783-E785 PolarHBondContact O-N 3.02Å; F783-R786 PolarHBondContact O-N 2.87Å; F783-V787 HydrophobicContact CD1-CG2 4.27Å; F783-V787 HydrophobicContact CD2-CG2 4.41Å; F783-V787 HydrophobicContact CE1-CG2 3.81Å; F783-V787 HydrophobicContact CE2-CG2 3.98Å; F783-V787 HydrophobicContact CZ-CG2 3.65Å; F783-V787 WeakPolarHBondContact O-CG2 3.45Å; F783-V787 PolarHBondContact O-N 3.21Å; F783-L899 HydrophobicContact CD2-CD2 3.82Å; F783-L899 HydrophobicContact CE2-CD2 3.98Å; F783-F931 HydrophobicContact CB-CE2 3.86Å; F783-F931 HydrophobicContact CB-CZ 3.87Å; F783-F931 HydrophobicContact CD1-CE2 4.19Å; F783-F931 HydrophobicContact CD2-CZ 4.24Å; F783-F931 HydrophobicContact CG-CE2 4Å; F783-F931 AromaticContact CG-CZ 3.96Å; F783-F931 HydrophobicContact CG-CZ 3.96Å; F783-A935 HydrophobicContact CD1-CB 4.23Å; F783-A935 HydrophobicContact CD2-CB 4.36Å; F783-A935 HydrophobicContact CE1-CB 3.85Å; F783-A935 HydrophobicContact CE2-CB 3.98Å; F783-A935 HydrophobicContact CG-CB 4.48Å; F783-A935 HydrophobicContact CZ-CB 3.71Å; F783-A935 WeakPolarHBondContact CZ-O 3.48Å; F783-F939 HydrophobicContact CE2-CB 4.43Å; F783-F939 HydrophobicContact CZ-CB 4.25Å
784	A	94	Very high	95.9	Very high	73 Å²	73	40.1 Å²	40.1	60%	0.603	21%	0.212	S	C	*	.	H	α-helix	trans	-64.4	-39.6	-175	0	0	0	0	0	113.4	A788	A784-A788 VanDerWaalsContact O-CB 3.28Å; A784-A788 WeakPolarHBondContact O-CB 3.34Å; A784-A788 PolarHBondContact O-N 2.76Å
785	E	94.8	Very high	95.9	Very high	74 Å²	74	43.6 Å²	43.6	35%	0.346	23%	0.229	S	C	.	.	H	α-helix	trans	-64.2	-43.8	176.5	59.4	-171.9	-141.1	0	0	111.7	K725 K782 F783 A788 E789	K725-E785 WeakPolarHBondContact CD-OE2 3.38Å; K725-E785 IonicContact NZ-OE2 3.68Å; K725-E785 PolarHBondContact NZ-OE2 3.49Å; K782-E785 HydrophobicContact CB-CG 4.26Å; K782-E785 WeakPolarHBondContact CD-OE1 3.29Å; K782-E785 WeakPolarHBondContact CE-OE1 3.47Å; K782-E785 WeakPolarHBondContact CG-OE1 3.18Å; K782-E785 VanDerWaalsContact O-CG 3.23Å; K782-E785 WeakPolarHBondContact O-CG 3.45Å; F783-E785 PolarHBondContact O-N 3.02Å; E785-A788 PolarHBondContact O-N 2.94Å; E785-E789 WeakPolarHBondContact O-CB 3.42Å; E785-E789 PolarHBondContact O-N 3.01Å
786	R	94.3	Very high	96	Very high	59 Å²	59	40.2 Å²	40.2	22%	0.223	22%	0.215	C	C	.	.	H	α-helix	trans	-65.8	-41.5	178.5	-71.4	171.1	177.7	179.1	-4.5	112.6	K782 F783 E789 V790 L899	K782-R786 WeakPolarHBondContact O-CD 3.28Å; K782-R786 VanDerWaalsContact O-CG 3.28Å; K782-R786 WeakPolarHBondContact O-CG 3.32Å; K782-R786 PolarHBondContact O-N 3.4Å; F783-R786 PolarHBondContact O-N 2.87Å; R786-E789 PolarHBondContact O-N 2.96Å; R786-V790 WeakPolarHBondContact O-CB 3.38Å; R786-V790 VanDerWaalsContact O-CG2 3.25Å; R786-V790 WeakPolarHBondContact O-CG2 3.36Å; R786-V790 PolarHBondContact O-N 3.02Å; R786-L899 HydrophobicContact CB-CD1 4.3Å; R786-L899 HydrophobicContact CB-CD2 3.82Å; R786-L899 HydrophobicContact CB-CG 4.23Å
787	V	94.8	Very high	96	Very high	13 Å²	13	40.1 Å²	40.1	8%	0.079	21%	0.214	C	C	.	.	H	α-helix	trans	-66.6	-39.1	176	171.4	0	0	0	0	111.2	F783 E789 V790 K791 L899 V942	F783-V787 HydrophobicContact CD1-CG2 4.27Å; F783-V787 HydrophobicContact CD2-CG2 4.41Å; F783-V787 HydrophobicContact CE1-CG2 3.81Å; F783-V787 HydrophobicContact CE2-CG2 3.98Å; F783-V787 HydrophobicContact CZ-CG2 3.65Å; F783-V787 WeakPolarHBondContact O-CG2 3.45Å; F783-V787 PolarHBondContact O-N 3.21Å; V787-E789 VanDerWaalsContact C-N 3.3Å; V787-E789 PolarHBondContact O-N 3.31Å; V787-V790 PolarHBondContact O-N 3.39Å; V787-K791 HydrophobicContact CG1-CD 4.1Å; V787-K791 HydrophobicContact CG1-CG 4.24Å; V787-K791 WeakPolarHBondContact O-CB 3.44Å; V787-K791 WeakPolarHBondContact O-CG 3.46Å; V787-K791 PolarHBondContact O-N 3.32Å; V787-L899 HydrophobicContact CG2-CD1 4.22Å; V787-L899 HydrophobicContact CG2-CD2 4.3Å; V787-V942 HydrophobicContact CG1-CG2 4.08Å
788	A	94.2	Very high	96.1	Very high	67 Å²	67	41.9 Å²	41.9	55%	0.554	22%	0.221	S	C	*	.	H	α-helix	trans	-68.2	-27	176	0	0	0	0	0	113.4	A784 E785 P792	A784-A788 VanDerWaalsContact O-CB 3.28Å; A784-A788 WeakPolarHBondContact O-CB 3.34Å; A784-A788 PolarHBondContact O-N 2.76Å; E785-A788 PolarHBondContact O-N 2.94Å; A788-P792 WeakPolarHBondContact O-CD 3.4Å; A788-P792 WeakPolarHBondContact O-CG 3.35Å
789	E	94	Very high	96.1	Very high	106 Å²	106	41 Å²	41	50%	0.495	22%	0.22	S	C	.	.	H	α-helix	trans	-79.1	-41.1	173.6	-166.4	-172.9	160.8	0	0	112.4	E785 R786 V787 K793	E785-E789 WeakPolarHBondContact O-CB 3.42Å; E785-E789 PolarHBondContact O-N 3.01Å; R786-E789 PolarHBondContact O-N 2.96Å; V787-E789 VanDerWaalsContact C-N 3.3Å; V787-E789 PolarHBondContact O-N 3.31Å; E789-K793 WeakPolarHBondContact O-CG 3.39Å; E789-K793 IonicContact OE1-NZ 3.73Å; E789-K793 PolarHBondContact OE1-NZ 3.19Å
790	V	95.7	Very high	96.1	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-72.3	-43.4	-177.9	164.4	0	0	0	0	112.6	R786 V787 K793 V794 L892 E895 I896 L899 V942	R786-V790 WeakPolarHBondContact O-CB 3.38Å; R786-V790 VanDerWaalsContact O-CG2 3.25Å; R786-V790 WeakPolarHBondContact O-CG2 3.36Å; R786-V790 PolarHBondContact O-N 3.02Å; V787-V790 PolarHBondContact O-N 3.39Å; V790-K793 WeakPolarHBondContact O-CB 3.47Å; V790-K793 PolarHBondContact O-N 2.83Å; V790-K793 VanDerWaalsContact O-N 3.13Å; V790-V794 HydrophobicContact CG1-CG2 4.1Å; V790-V794 PolarHBondContact O-N 3.13Å; V790-L892 HydrophobicContact CB-CD1 4.49Å; V790-L892 HydrophobicContact CG1-CD1 4.01Å; V790-L892 HydrophobicContact CG2-CD1 4.38Å; V790-E895 HydrophobicContact CG2-CB 3.74Å; V790-E895 VanDerWaalsContact CG2-OE2 3.27Å; V790-E895 WeakPolarHBondContact CG2-OE2 3.46Å; V790-I896 HydrophobicContact CG1-CD1 3.55Å; V790-I896 HydrophobicContact CG1-CG1 4.2Å; V790-L899 HydrophobicContact CG2-CD1 4.18Å; V790-V942 HydrophobicContact CG1-CG1 3.61Å
791	K	95.2	Very high	96.2	Very high	68 Å²	68	38 Å²	38	30%	0.296	21%	0.206	S	C	.	.	H	α-helix	trans	-57.8	-46.3	-173.9	-82.8	-169.7	170.1	-161.9	0	114.2	V787 K793 V794 E795 D941 V942	V787-K791 HydrophobicContact CG1-CD 4.1Å; V787-K791 HydrophobicContact CG1-CG 4.24Å; V787-K791 WeakPolarHBondContact O-CB 3.44Å; V787-K791 WeakPolarHBondContact O-CG 3.46Å; V787-K791 PolarHBondContact O-N 3.32Å; K791-K793 VanDerWaalsContact C-N 3.32Å; K791-K793 PolarHBondContact O-N 3.48Å; K791-V794 PolarHBondContact O-N 3.45Å; K791-E795 PolarHBondContact O-N 3.21Å; K791-D941 WeakPolarHBondContact CE-OD2 3.24Å; K791-D941 IonicContact NZ-OD2 3.43Å; K791-D941 PolarHBondContact NZ-OD2 3.04Å; K791-V942 HydrophobicContact CD-CG2 4.15Å; K791-V942 HydrophobicContact CG-CG2 3.74Å
792	P	96.4	Very high	96.3	Very high	81 Å²	81	39.1 Å²	39.1	53%	0.526	21%	0.212	S	C	.	.	H	α-helix	trans	-63.3	-34.5	176.1	-23.8	35.2	0	0	0	113.5	A788 E795 A796	A788-P792 WeakPolarHBondContact O-CD 3.4Å; A788-P792 WeakPolarHBondContact O-CG 3.35Å; P792-E795 PolarHBondContact O-N 2.9Å; P792-A796 VanDerWaalsContact O-CB 3.31Å; P792-A796 WeakPolarHBondContact O-CB 3.5Å; P792-A796 PolarHBondContact O-N 3.03Å
793	K	97.1	Very high	96.3	Very high	44 Å²	44	38.6 Å²	38.6	19%	0.191	21%	0.21	C	C	.	.	H	α-helix	trans	-63.7	-42.3	175.6	-66.3	172.8	-173.3	170.8	0	111.1	E789 V790 K791 I797 V887 L892 E895	E789-K793 WeakPolarHBondContact O-CG 3.39Å; E789-K793 IonicContact OE1-NZ 3.73Å; E789-K793 PolarHBondContact OE1-NZ 3.19Å; V790-K793 WeakPolarHBondContact O-CB 3.47Å; V790-K793 PolarHBondContact O-N 2.83Å; V790-K793 VanDerWaalsContact O-N 3.13Å; K791-K793 VanDerWaalsContact C-N 3.32Å; K791-K793 PolarHBondContact O-N 3.48Å; K793-I797 WeakPolarHBondContact O-CG1 3.46Å; K793-I797 PolarHBondContact O-N 3.41Å; K793-V887 HydrophobicContact CB-CG1 3.79Å; K793-V887 HydrophobicContact CB-CG2 4.34Å; K793-V887 HydrophobicContact CG-CG1 4.33Å; K793-L892 HydrophobicContact CB-CD1 3.79Å; K793-L892 HydrophobicContact CB-CD2 4.29Å; K793-L892 HydrophobicContact CD-CD1 4.06Å; K793-E895 IonicContact NZ-OE1 2.79Å; K793-E895 PolarHBondContact NZ-OE1 3.1Å; K793-E895 IonicContact NZ-OE2 3.76Å; K793-E895 PolarHBondContact NZ-OE2 2.98Å
794	V	97.4	Very high	96.4	Very high	4 Å²	4	37.9 Å²	37.9	2%	0.024	21%	0.207	C	C	.	.	H	α-helix	trans	-65.9	-49.6	175.3	175.1	0	0	0	0	111.3	V790 K791 A796 I797 R798 L892 L945 L946 A949	V790-V794 HydrophobicContact CG1-CG2 4.1Å; V790-V794 PolarHBondContact O-N 3.13Å; K791-V794 PolarHBondContact O-N 3.45Å; V794-A796 PolarHBondContact O-N 3.15Å; V794-I797 PolarHBondContact O-N 3.1Å; V794-R798 PolarHBondContact O-N 2.84Å; V794-L892 HydrophobicContact CG2-CD1 4.24Å; V794-L892 HydrophobicContact CG2-CD2 4.19Å; V794-L945 HydrophobicContact CG1-CB 3.83Å; V794-L945 WeakPolarHBondContact CG1-O 3.49Å; V794-L946 HydrophobicContact CG1-CB 4.42Å; V794-L946 HydrophobicContact CG2-CB 4.33Å; V794-L946 HydrophobicContact CG2-CD1 3.95Å; V794-A949 HydrophobicContact CG1-CB 4.02Å
795	E	97.3	Very high	96.4	Very high	74 Å²	74	38.6 Å²	38.6	35%	0.346	20%	0.197	S	C	.	.	H	α-helix	trans	-65.5	-36.9	-176.5	-176	56.3	-157.6	0	0	112.4	K791 P792 I797 R798 S799	K791-E795 PolarHBondContact O-N 3.21Å; P792-E795 PolarHBondContact O-N 2.9Å; E795-I797 VanDerWaalsContact C-N 3.32Å; E795-I797 PolarHBondContact O-N 2.71Å; E795-R798 VanDerWaalsContact CD-NE 3.32Å; E795-R798 PolarHBondContact O-N 3.32Å; E795-R798 VanDerWaalsContact O-N 3.16Å; E795-R798 IonicContact OE1-CZ 2.7Å; E795-R798 VanDerWaalsContact OE1-CZ 3.32Å; E795-R798 IonicContact OE1-NE 2.71Å; E795-R798 PolarHBondContact OE1-NE 2.68Å; E795-R798 VanDerWaalsContact OE1-NE 3.08Å; E795-R798 IonicContact OE1-NH2 3.41Å; E795-R798 PolarHBondContact OE1-NH2 2.78Å; E795-R798 WeakPolarHBondContact OE2-CD 3.46Å; E795-R798 IonicContact OE2-CZ 3.19Å; E795-R798 IonicContact OE2-NE 3.17Å; E795-R798 PolarHBondContact OE2-NE 3.4Å; E795-R798 IonicContact OE2-NH2 2.82Å; E795-S799 WeakPolarHBondContact O-CB 3.39Å; E795-S799 PolarHBondContact O-N 3.3Å
796	A	97.8	Very high	96.4	Very high	11 Å²	11	43 Å²	43	9%	0.091	21%	0.21	C	C	.	.	H	α-helix	trans	-61	-39.5	174.2	0	0	0	0	0	112.2	P792 V794 G800 Q883 A884 V887	P792-A796 VanDerWaalsContact O-CB 3.31Å; P792-A796 WeakPolarHBondContact O-CB 3.5Å; P792-A796 PolarHBondContact O-N 3.03Å; V794-A796 PolarHBondContact O-N 3.15Å; A796-G800 PolarHBondContact O-N 2.89Å; A796-Q883 HydrophobicContact CB-CB 4.22Å; A796-A884 HydrophobicContact CB-CB 4.47Å; A796-A884 VanDerWaalsContact O-CB 3.3Å; A796-A884 WeakPolarHBondContact O-CB 3.27Å; A796-V887 HydrophobicContact CB-CG2 4.24Å
797	I	97.9	Very high	96.5	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-67.3	-43.5	173.2	-64.3	165.1	0	0	0	110.5	K793 V794 E795 S801 V887 M889 L892 A949 F953 P969	K793-I797 WeakPolarHBondContact O-CG1 3.46Å; K793-I797 PolarHBondContact O-N 3.41Å; V794-I797 PolarHBondContact O-N 3.1Å; E795-I797 VanDerWaalsContact C-N 3.32Å; E795-I797 PolarHBondContact O-N 2.71Å; I797-S801 WeakPolarHBondContact O-CB 3.4Å; I797-S801 PolarHBondContact O-N 3.22Å; I797-S801 PolarHBondContact O-OG 3.16Å; I797-V887 HydrophobicContact CD1-CB 4.1Å; I797-V887 HydrophobicContact CD1-CG1 3.56Å; I797-V887 HydrophobicContact CG1-CB 4.11Å; I797-V887 HydrophobicContact CG1-CG1 4.09Å; I797-V887 HydrophobicContact CG1-CG2 4.46Å; I797-M889 HydrophobicContact CD1-CE 3.8Å; I797-L892 HydrophobicContact CD1-CD2 3.81Å; I797-A949 HydrophobicContact CB-CB 4.32Å; I797-A949 HydrophobicContact CG2-CB 4.1Å; I797-F953 HydrophobicContact CG2-CB 3.97Å; I797-F953 HydrophobicContact CG2-CG 4.39Å; I797-P969 HydrophobicContact CD1-CB 4.44Å; I797-P969 HydrophobicContact CD1-CG 4.13Å; I797-P969 HydrophobicContact CG1-CB 4.19Å; I797-P969 HydrophobicContact CG1-CG 4.34Å
798	R	97.9	Very high	96.5	Very high	37 Å²	37	42.8 Å²	42.8	14%	0.14	22%	0.218	C	C	.	.	H	α-helix	trans	-60.9	-55.8	-179.3	-160.9	-157	65.6	64.2	15.7	111.1	V794 E795 S801 E802 E948 A949 L952	V794-R798 PolarHBondContact O-N 2.84Å; E795-R798 VanDerWaalsContact CD-NE 3.32Å; E795-R798 PolarHBondContact O-N 3.32Å; E795-R798 VanDerWaalsContact O-N 3.16Å; E795-R798 IonicContact OE1-CZ 2.7Å; E795-R798 VanDerWaalsContact OE1-CZ 3.32Å; E795-R798 IonicContact OE1-NE 2.71Å; E795-R798 PolarHBondContact OE1-NE 2.68Å; E795-R798 VanDerWaalsContact OE1-NE 3.08Å; E795-R798 IonicContact OE1-NH2 3.41Å; E795-R798 PolarHBondContact OE1-NH2 2.78Å; E795-R798 WeakPolarHBondContact OE2-CD 3.46Å; E795-R798 IonicContact OE2-CZ 3.19Å; E795-R798 IonicContact OE2-NE 3.17Å; E795-R798 PolarHBondContact OE2-NE 3.4Å; E795-R798 IonicContact OE2-NH2 2.82Å; R798-S801 PolarHBondContact O-N 3.49Å; R798-E802 IonicContact CZ-OE2 2.64Å; R798-E802 IonicContact NH1-OE2 2.74Å; R798-E802 PolarHBondContact NH1-OE2 2.92Å; R798-E802 IonicContact NH2-OE2 3.6Å; R798-E802 PolarHBondContact NH2-OE2 3.19Å; R798-E802 PolarHBondContact O-N 2.55Å; R798-E802 VanDerWaalsContact O-N 3.14Å; R798-E948 IonicContact NH1-OE1 2.7Å; R798-A949 HydrophobicContact CB-CB 3.91Å; R798-A949 HydrophobicContact CG-CB 4.36Å; R798-L952 HydrophobicContact CG-CD1 3.76Å
799	S	97.9	Very high	96.6	Very high	15 Å²	15	39.6 Å²	39.6	11%	0.105	19%	0.192	C	C	.	.	H	α-helix	trans	-62.6	-52.8	179	-169.5	0	0	0	0	111.3	E795 S801 E802 E803 D880	E795-S799 WeakPolarHBondContact O-CB 3.39Å; E795-S799 PolarHBondContact O-N 3.3Å; S799-S801 PolarHBondContact O-N 3.28Å; S799-S801 VanDerWaalsContact O-N 3.17Å; S799-E802 CarbonylContact O-C 3.49Å; S799-E802 WeakPolarHBondContact O-CA 3.45Å; S799-E802 WeakPolarHBondContact O-CB 3.24Å; S799-E802 PolarHBondContact O-N 2.89Å; S799-E803 WeakPolarHBondContact O-CG 3.38Å; S799-E803 PolarHBondContact O-N 2.89Å; S799-D880 VanDerWaalsContact CB-OD2 3.23Å; S799-D880 WeakPolarHBondContact CB-OD2 3.28Å; S799-D880 PolarHBondContact OG-OD2 3.38Å
800	G	97.8	Very high	96.7	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-59.3	-33.1	179.9	0	0	0	0	0	113.8	A796 V804 I881 F973	A796-G800 PolarHBondContact O-N 2.89Å; G800-V804 WeakPolarHBondContact O-CG2 3.43Å; G800-V804 PolarHBondContact O-N 3.3Å; G800-V804 VanDerWaalsContact O-N 3.16Å; G800-I881 WeakPolarHBondContact O-CD1 3.47Å; G800-F973 VanDerWaalsContact C-CE1 3.49Å; G800-F973 WeakPolarHBondContact O-CE1 3.39Å
801	S	97.9	Very high	96.6	Very high	2 Å²	2	38.6 Å²	38.6	1%	0.014	19%	0.186	C	C	.	.	H	α-helix	trans	-68.9	-37.8	172.8	-59.3	0	0	0	0	112.7	I797 R798 S799 F805 F953	I797-S801 WeakPolarHBondContact O-CB 3.4Å; I797-S801 PolarHBondContact O-N 3.22Å; I797-S801 PolarHBondContact O-OG 3.16Å; R798-S801 PolarHBondContact O-N 3.49Å; S799-S801 PolarHBondContact O-N 3.28Å; S799-S801 VanDerWaalsContact O-N 3.17Å; S801-F805 WeakPolarHBondContact O-CB 3.31Å; S801-F805 PolarHBondContact O-N 3.06Å; S801-F953 VanDerWaalsContact OG-CA 3.23Å; S801-F953 WeakPolarHBondContact OG-CA 3.46Å; S801-F953 PolarHBondContact OG-N 3.39Å
802	E	97.3	Very high	96.7	Very high	45 Å²	45	37.8 Å²	37.8	21%	0.21	18%	0.183	C	C	.	.	H	α-helix	trans	-71.5	-41.1	177.8	-171.1	167.4	-151.4	0	0	111.3	R798 S799 F805 R806	R798-E802 IonicContact CZ-OE2 2.64Å; R798-E802 IonicContact NH1-OE2 2.74Å; R798-E802 PolarHBondContact NH1-OE2 2.92Å; R798-E802 IonicContact NH2-OE2 3.6Å; R798-E802 PolarHBondContact NH2-OE2 3.19Å; R798-E802 PolarHBondContact O-N 2.55Å; R798-E802 VanDerWaalsContact O-N 3.14Å; S799-E802 CarbonylContact O-C 3.49Å; S799-E802 WeakPolarHBondContact O-CA 3.45Å; S799-E802 WeakPolarHBondContact O-CB 3.24Å; S799-E802 PolarHBondContact O-N 2.89Å; E802-F805 PolarHBondContact O-N 3.24Å; E802-R806 VanDerWaalsContact O-CB 3.32Å; E802-R806 WeakPolarHBondContact O-CB 3.17Å; E802-R806 WeakPolarHBondContact O-CG 3.39Å; E802-R806 PolarHBondContact O-N 3.42Å; E802-R806 IonicContact OE1-CZ 3.05Å; E802-R806 IonicContact OE1-NH1 2.74Å; E802-R806 PolarHBondContact OE1-NH1 3.44Å; E802-R806 IonicContact OE1-NH2 3.17Å; E802-R806 PolarHBondContact OE1-NH2 2.84Å
803	E	97.4	Very high	96.6	Very high	22 Å²	22	34.3 Å²	34.3	10%	0.103	16%	0.16	C	C	.	.	H	α-helix	trans	-57.8	-61.7	174.2	-76.4	-170.8	154.2	0	0	112	S799 F805 R806 S807 E877 L878 Q879 D880 I881	S799-E803 WeakPolarHBondContact O-CG 3.38Å; S799-E803 PolarHBondContact O-N 2.89Å; E803-F805 PolarHBondContact O-N 3.27Å; E803-R806 PolarHBondContact O-N 3.33Å; E803-R806 VanDerWaalsContact O-N 3.13Å; E803-S807 WeakPolarHBondContact O-CB 3.42Å; E803-S807 PolarHBondContact O-N 3.32Å; E803-E877 WeakPolarHBondContact CB-O 3.47Å; E803-L878 HydrophobicContact CB-CD2 4.04Å; E803-L878 VanDerWaalsContact OE2-C 3.23Å; E803-L878 WeakPolarHBondContact OE2-CA 3.35Å; E803-Q879 WeakPolarHBondContact OE1-CG 3.29Å; E803-Q879 PolarHBondContact OE1-N 3.41Å; E803-Q879 PolarHBondContact OE2-N 2.84Å; E803-D880 PolarHBondContact OE1-N 3.48Å; E803-D880 PolarHBondContact OE2-N 3.02Å; E803-I881 HydrophobicContact CB-CD1 4.29Å
804	V	96.8	Very high	96.5	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-60.7	-34.1	-179.7	-59.7	0	0	0	0	112.3	G800 L810 L878 I881 A956 F960 F972 F973 F976	G800-V804 WeakPolarHBondContact O-CG2 3.43Å; G800-V804 PolarHBondContact O-N 3.3Å; G800-V804 VanDerWaalsContact O-N 3.16Å; V804-L810 HydrophobicContact CB-CD2 4.32Å; V804-L878 HydrophobicContact CB-CD2 4.5Å; V804-L878 HydrophobicContact CG1-CD2 4Å; V804-I881 HydrophobicContact CG1-CD1 3.57Å; V804-I881 HydrophobicContact CG1-CG1 4.37Å; V804-A956 HydrophobicContact CG2-CB 3.81Å; V804-F960 HydrophobicContact CB-CE2 3.78Å; V804-F960 HydrophobicContact CB-CZ 4.27Å; V804-F960 HydrophobicContact CG2-CE2 3.87Å; V804-F960 WeakPolarHBondContact O-CE2 3.42Å; V804-F960 VanDerWaalsContact O-CZ 3.28Å; V804-F960 WeakPolarHBondContact O-CZ 3.24Å; V804-F972 HydrophobicContact CG2-CE1 4.18Å; V804-F973 HydrophobicContact CG1-CD1 4.4Å; V804-F973 HydrophobicContact CG1-CE1 4.23Å; V804-F973 HydrophobicContact CG2-CE1 4.24Å; V804-F976 HydrophobicContact CG1-CD2 4.09Å; V804-F976 HydrophobicContact CG1-CE2 4.09Å; V804-F976 HydrophobicContact CG1-CG 4.41Å; V804-F976 HydrophobicContact CG1-CZ 4.41Å
805	F	93.9	Very high	96.3	Very high	89 Å²	89	39 Å²	39	39%	0.39	18%	0.184	S	C	.	.	H	α-helix	trans	-73.8	-30.1	-179.6	-172.8	-89.8	0	0	0	112.4	S801 E802 E803 K811 H959	S801-F805 WeakPolarHBondContact O-CB 3.31Å; S801-F805 PolarHBondContact O-N 3.06Å; E802-F805 PolarHBondContact O-N 3.24Å; E803-F805 PolarHBondContact O-N 3.27Å; F805-K811 WeakPolarHBondContact O-CE 3.48Å; F805-K811 PolarHBondContact O-NZ 2.99Å; F805-H959 HydrophobicContact CD2-CB 3.78Å; F805-H959 AromaticContact CD2-CD2 3.83Å; F805-H959 AromaticContact CD2-CG 3.66Å; F805-H959 HydrophobicContact CE2-CB 3.91Å; F805-H959 AromaticContact CE2-CG 3.67Å; F805-H959 AromaticContact CE2-ND1 3.71Å
806	R	95.1	Very high	96.1	Very high	165 Å²	165	35.9 Å²	35.9	62%	0.623	17%	0.169	S	C	*	.	H	α-helix	trans	-95.6	-37.4	-178.1	-70.4	-172.7	-178	151.6	16.5	113.9	E802 E803 S808 K811	E802-R806 VanDerWaalsContact O-CB 3.32Å; E802-R806 WeakPolarHBondContact O-CB 3.17Å; E802-R806 WeakPolarHBondContact O-CG 3.39Å; E802-R806 PolarHBondContact O-N 3.42Å; E802-R806 IonicContact OE1-CZ 3.05Å; E802-R806 IonicContact OE1-NH1 2.74Å; E802-R806 PolarHBondContact OE1-NH1 3.44Å; E802-R806 IonicContact OE1-NH2 3.17Å; E802-R806 PolarHBondContact OE1-NH2 2.84Å; E803-R806 PolarHBondContact O-N 3.33Å; E803-R806 VanDerWaalsContact O-N 3.13Å; R806-S808 PolarHBondContact O-N 3.33Å; R806-K811 PolarHBondContact O-NZ 2.7Å; R806-K811 VanDerWaalsContact O-NZ 3.1Å
807	S	97.2	Very high	95.9	Very high	4 Å²	4	36.2 Å²	36.2	3%	0.028	17%	0.17	C	C	.	.			trans	-38.7	123.5	-172.1	172.2	0	0	0	0	113.3	E803 L810 K811 E877	E803-S807 WeakPolarHBondContact O-CB 3.42Å; E803-S807 PolarHBondContact O-N 3.32Å; S807-L810 WeakPolarHBondContact OG-CB 3.27Å; S807-L810 PolarHBondContact OG-N 3.18Å; S807-K811 VanDerWaalsContact O-CD 3.31Å; S807-K811 WeakPolarHBondContact O-CD 3.44Å; S807-K811 WeakPolarHBondContact O-CG 3.41Å; S807-E877 VanDerWaalsContact C-OE2 3.3Å; S807-E877 WeakPolarHBondContact CA-OE2 3.46Å; S807-E877 VanDerWaalsContact CB-OE2 3.27Å; S807-E877 WeakPolarHBondContact CB-OE2 3.4Å; S807-E877 PolarHBondContact OG-OE2 3.2Å
808	S	94.8	Very high	95.5	Very high	64 Å²	64	38.1 Å²	38.1	45%	0.448	18%	0.18	S	C	.	.	H	α-helix	trans	-82.8	-37.5	176.9	76.1	0	0	0	0	110.8	R806 K811 Q812 E877	R806-S808 PolarHBondContact O-N 3.33Å; S808-K811 PolarHBondContact O-N 3.46Å; S808-Q812 WeakPolarHBondContact O-CB 3.45Å; S808-Q812 PolarHBondContact O-N 3.29Å; S808-E877 PolarHBondContact N-OE1 3.47Å; S808-E877 PolarHBondContact N-OE2 2.9Å; S808-E877 PolarHBondContact OG-OE1 3.01Å
809	A	95.2	Very high	95.2	Very high	0 Å²	0	39 Å²	39	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-59.3	-48.5	175	0	0	0	0	0	111.4	K811 Q812 L813 V871 L874 E877	A809-K811 PolarHBondContact O-N 2.75Å; A809-Q812 PolarHBondContact O-N 2.69Å; A809-L813 VanDerWaalsContact O-CB 3.31Å; A809-L813 WeakPolarHBondContact O-CB 3.35Å; A809-L813 PolarHBondContact O-N 3.14Å; A809-V871 HydrophobicContact CB-CB 4.49Å; A809-V871 HydrophobicContact CB-CG1 4.43Å; A809-L874 HydrophobicContact CB-CB 3.94Å; A809-L874 HydrophobicContact CB-CD1 3.86Å; A809-E877 VanDerWaalsContact CB-OE2 3.24Å; A809-E877 WeakPolarHBondContact CB-OE2 3.46Å; A809-E877 PolarHBondContact N-OE2 3.22Å
810	L	96	Very high	94.8	Very high	1 Å²	1	40.2 Å²	40.2	1%	0.005	20%	0.199	C	C	.	.	H	α-helix	trans	-61.9	-43.7	-179.6	-179.7	57.4	0	0	0	111.8	V804 S807 L813 L814 L874 L878 F960 F976	V804-L810 HydrophobicContact CB-CD2 4.32Å; S807-L810 WeakPolarHBondContact OG-CB 3.27Å; S807-L810 PolarHBondContact OG-N 3.18Å; L810-L813 PolarHBondContact O-N 3.01Å; L810-L814 HydrophobicContact CD1-CD1 4.11Å; L810-L814 HydrophobicContact CD1-CG 4.28Å; L810-L814 HydrophobicContact CG-CD1 4.03Å; L810-L814 WeakPolarHBondContact O-CB 3.37Å; L810-L814 VanDerWaalsContact O-CG 3.23Å; L810-L814 WeakPolarHBondContact O-CG 3.38Å; L810-L814 PolarHBondContact O-N 3.48Å; L810-L874 HydrophobicContact CB-CD1 3.8Å; L810-L874 HydrophobicContact CD1-CD1 4.34Å; L810-L878 HydrophobicContact CB-CD1 4.45Å; L810-L878 HydrophobicContact CD2-CD1 4.29Å; L810-L878 HydrophobicContact CD2-CD2 4.46Å; L810-F960 HydrophobicContact CD2-CE1 4.04Å; L810-F960 HydrophobicContact CD2-CZ 3.64Å; L810-F960 HydrophobicContact CG-CE1 4.47Å; L810-F960 HydrophobicContact CG-CZ 4.44Å; L810-F976 HydrophobicContact CD1-CD1 4.38Å; L810-F976 HydrophobicContact CD1-CE1 4.09Å; L810-F976 HydrophobicContact CD2-CD1 4.29Å; L810-F976 HydrophobicContact CD2-CE1 3.77Å; L810-F976 HydrophobicContact CD2-CZ 4.4Å
811	K	95.2	Very high	94.1	Very high	84 Å²	84	41.6 Å²	41.6	37%	0.365	21%	0.213	S	C	.	.	H	α-helix	trans	-66.3	-45.5	179.7	-70.3	167.5	-169.5	156.5	0	111.9	F805 R806 S807 S808 A809 L813 L814 E815	F805-K811 WeakPolarHBondContact O-CE 3.48Å; F805-K811 PolarHBondContact O-NZ 2.99Å; R806-K811 PolarHBondContact O-NZ 2.7Å; R806-K811 VanDerWaalsContact O-NZ 3.1Å; S807-K811 VanDerWaalsContact O-CD 3.31Å; S807-K811 WeakPolarHBondContact O-CD 3.44Å; S807-K811 WeakPolarHBondContact O-CG 3.41Å; S808-K811 PolarHBondContact O-N 3.46Å; A809-K811 PolarHBondContact O-N 2.75Å; K811-L813 VanDerWaalsContact C-N 3.31Å; K811-L813 PolarHBondContact O-N 3.15Å; K811-L814 PolarHBondContact O-N 2.85Å; K811-E815 PolarHBondContact O-N 2.94Å; K811-E815 VanDerWaalsContact O-N 3.12Å
812	Q	95.6	Very high	93.5	Very high	52 Å²	52	43.7 Å²	43.7	24%	0.243	22%	0.224	C	C	.	.	H	α-helix	trans	-65.3	-35.3	177.1	-178	63.8	96.3	0	0	111.8	S808 A809 E815 V816 Y868 V871	S808-Q812 WeakPolarHBondContact O-CB 3.45Å; S808-Q812 PolarHBondContact O-N 3.29Å; A809-Q812 PolarHBondContact O-N 2.69Å; Q812-E815 PolarHBondContact NE2-OE1 3.29Å; Q812-V816 WeakPolarHBondContact O-CG2 3.38Å; Q812-V816 PolarHBondContact O-N 3.28Å; Q812-Y868 VanDerWaalsContact CD-CD1 3.47Å; Q812-Y868 HydrophobicContact CG-CD1 3.72Å; Q812-Y868 HydrophobicContact CG-CE1 4.45Å; Q812-Y868 HydrophobicContact CG-CG 4.2Å; Q812-V871 HydrophobicContact CB-CG2 3.79Å; Q812-V871 HydrophobicContact CG-CG2 3.71Å
813	L	95.4	Very high	92.9	Very high	8 Å²	8	49.5 Å²	49.5	4%	0.042	25%	0.245	C	C	.	.	H	α-helix	trans	-64.3	-47.6	174	-175	66.7	0	0	0	112.1	A809 L810 K811 E815 V816 V817 L860 V864 V871 L874 F979	A809-L813 VanDerWaalsContact O-CB 3.31Å; A809-L813 WeakPolarHBondContact O-CB 3.35Å; A809-L813 PolarHBondContact O-N 3.14Å; L810-L813 PolarHBondContact O-N 3.01Å; K811-L813 VanDerWaalsContact C-N 3.31Å; K811-L813 PolarHBondContact O-N 3.15Å; L813-E815 VanDerWaalsContact C-N 3.25Å; L813-E815 PolarHBondContact O-N 3.16Å; L813-V816 PolarHBondContact O-N 3.07Å; L813-V816 VanDerWaalsContact O-N 3.12Å; L813-V817 HydrophobicContact CG-CG2 4.48Å; L813-V817 WeakPolarHBondContact O-CG2 3.27Å; L813-V817 PolarHBondContact O-N 3.49Å; L813-L860 HydrophobicContact CD1-CD1 4.19Å; L813-L860 HydrophobicContact CD1-CD2 3.88Å; L813-L860 HydrophobicContact CD1-CG 4.03Å; L813-V864 HydrophobicContact CD1-CG2 4.03Å; L813-V871 HydrophobicContact CB-CG1 3.88Å; L813-V871 HydrophobicContact CD1-CG1 4.07Å; L813-V871 HydrophobicContact CG-CG1 4.4Å; L813-L874 HydrophobicContact CD2-CD2 3.87Å; L813-F979 HydrophobicContact CD2-CE1 3.48Å; L813-F979 VanDerWaalsContact CD2-CE1 3.48Å; L813-F979 HydrophobicContact CD2-CZ 3.8Å
814	L	94.4	Very high	92.4	Very high	29 Å²	29	53 Å²	53	15%	0.152	26%	0.262	C	S	.	.	H	α-helix	trans	-59.6	-36.2	178.8	-72.4	166.7	0	0	0	112	L810 K811 V817 L818 F835 L840 F960	L810-L814 HydrophobicContact CD1-CD1 4.11Å; L810-L814 HydrophobicContact CD1-CG 4.28Å; L810-L814 HydrophobicContact CG-CD1 4.03Å; L810-L814 WeakPolarHBondContact O-CB 3.37Å; L810-L814 VanDerWaalsContact O-CG 3.23Å; L810-L814 WeakPolarHBondContact O-CG 3.38Å; L810-L814 PolarHBondContact O-N 3.48Å; K811-L814 PolarHBondContact O-N 2.85Å; L814-V817 PolarHBondContact O-N 3.12Å; L814-L818 WeakPolarHBondContact O-CB 3.27Å; L814-L818 PolarHBondContact O-N 3.32Å; L814-F835 HydrophobicContact CB-CZ 4.48Å; L814-F835 HydrophobicContact CD2-CE2 3.57Å; L814-F835 HydrophobicContact CD2-CZ 3.48Å; L814-F835 VanDerWaalsContact CD2-CZ 3.48Å; L814-L840 HydrophobicContact CD2-CD1 4.36Å; L814-L840 HydrophobicContact CD2-CD2 3.86Å; L814-L840 HydrophobicContact CD2-CG 4.36Å; L814-F960 HydrophobicContact CD1-CD1 4.29Å; L814-F960 HydrophobicContact CD1-CE1 3.71Å
815	E	93.4	Very high	91.8	Very high	118 Å²	118	56.2 Å²	56.2	55%	0.551	28%	0.28	S	S	*	.	H	α-helix	trans	-62.7	-45.5	173.1	-173.4	-178.2	88.6	0	0	112.4	K811 Q812 L813 L818 A819	K811-E815 PolarHBondContact O-N 2.94Å; K811-E815 VanDerWaalsContact O-N 3.12Å; Q812-E815 PolarHBondContact NE2-OE1 3.29Å; L813-E815 VanDerWaalsContact C-N 3.25Å; L813-E815 PolarHBondContact O-N 3.16Å; E815-L818 WeakPolarHBondContact O-CB 3.48Å; E815-L818 PolarHBondContact O-N 3.2Å; E815-A819 PolarHBondContact O-N 2.66Å
816	V	94	Very high	91.1	Very high	8 Å²	8	59 Å²	59	5%	0.048	29%	0.292	C	S	.	.	H	α-helix	trans	-66.2	-40	177	179.5	0	0	0	0	111.2	Q812 L813 L818 A819 F820 L860 V864 Y868	Q812-V816 WeakPolarHBondContact O-CG2 3.38Å; Q812-V816 PolarHBondContact O-N 3.28Å; L813-V816 PolarHBondContact O-N 3.07Å; L813-V816 VanDerWaalsContact O-N 3.12Å; V816-L818 VanDerWaalsContact C-N 3.34Å; V816-L818 PolarHBondContact O-N 3.25Å; V816-A819 PolarHBondContact O-N 2.75Å; V816-F820 HydrophobicContact CG1-CD1 4.25Å; V816-F820 HydrophobicContact CG1-CE1 3.87Å; V816-F820 HydrophobicContact CG1-CZ 4.03Å; V816-F820 WeakPolarHBondContact O-CD1 3.38Å; V816-F820 PolarHBondContact O-N 2.85Å; V816-L860 HydrophobicContact CB-CD1 4.21Å; V816-L860 HydrophobicContact CG1-CD1 3.54Å; V816-V864 HydrophobicContact CG1-CG2 4.38Å; V816-Y868 HydrophobicContact CG2-CD2 3.82Å; V816-Y868 HydrophobicContact CG2-CE1 4.4Å; V816-Y868 HydrophobicContact CG2-CE2 3.59Å; V816-Y868 HydrophobicContact CG2-CG 4.34Å
817	V	93.5	Very high	90.1	Very high	18 Å²	18	53.7 Å²	53.7	11%	0.109	29%	0.288	C	S	.	.	H	α-helix	trans	-62.9	-40.3	173.9	174.8	0	0	0	0	111.3	L813 L814 F820 G821 F835 I843 L860	L813-V817 HydrophobicContact CG-CG2 4.48Å; L813-V817 WeakPolarHBondContact O-CG2 3.27Å; L813-V817 PolarHBondContact O-N 3.49Å; L814-V817 PolarHBondContact O-N 3.12Å; V817-F820 PolarHBondContact O-N 2.95Å; V817-G821 PolarHBondContact O-N 3.13Å; V817-F835 HydrophobicContact CB-CE1 4.13Å; V817-F835 HydrophobicContact CB-CZ 3.8Å; V817-F835 HydrophobicContact CG1-CE1 3.71Å; V817-F835 HydrophobicContact CG1-CE2 4.13Å; V817-F835 HydrophobicContact CG1-CZ 3.38Å; V817-I843 HydrophobicContact CB-CD1 4.48Å; V817-I843 HydrophobicContact CG1-CD1 3.81Å; V817-I843 HydrophobicContact CG1-CG1 4.4Å; V817-I843 HydrophobicContact CG2-CD1 3.71Å; V817-L860 HydrophobicContact CG2-CD1 4.15Å; V817-L860 HydrophobicContact CG2-CD2 3.52Å
818	L	89.4	Confident	89.1	Confident	40 Å²	40	63 Å²	63	21%	0.209	33%	0.331	C	S	.	.	H	α-helix	trans	-63.8	-42.3	176.2	-173.2	64.9	0	0	0	111.4	L814 E815 V816 G821 N822 A832 F835	L814-L818 WeakPolarHBondContact O-CB 3.27Å; L814-L818 PolarHBondContact O-N 3.32Å; E815-L818 WeakPolarHBondContact O-CB 3.48Å; E815-L818 PolarHBondContact O-N 3.2Å; V816-L818 VanDerWaalsContact C-N 3.34Å; V816-L818 PolarHBondContact O-N 3.25Å; L818-G821 PolarHBondContact O-N 3.27Å; L818-N822 WeakPolarHBondContact O-CB 3.11Å; L818-N822 PolarHBondContact O-N 3.01Å; L818-N822 PolarHBondContact O-ND2 3.18Å; L818-A832 HydrophobicContact CD1-CB 4.12Å; L818-A832 WeakPolarHBondContact CD1-O 3.3Å; L818-F835 HydrophobicContact CB-CE1 4.03Å; L818-F835 HydrophobicContact CD1-CD1 3.92Å; L818-F835 HydrophobicContact CD1-CE1 4.26Å
819	A	90.3	Very high	88	Confident	56 Å²	56	70 Å²	70	46%	0.463	35%	0.348	S	S	.	.	H	α-helix	trans	-62.4	-44.2	175.3	0	0	0	0	0	112.1	E815 V816 Y823	E815-A819 PolarHBondContact O-N 2.66Å; V816-A819 PolarHBondContact O-N 2.75Å; A819-Y823 WeakPolarHBondContact O-CB 3.22Å; A819-Y823 PolarHBondContact O-N 2.85Å
820	F	89.8	Confident	87.3	Confident	40 Å²	40	70.7 Å²	70.7	18%	0.175	36%	0.355	C	S	.	.	H	α-helix	trans	-61.7	-49.7	174.5	-76.5	12.7	0	0	0	111.2	V816 V817 N822 Y823 M824 L856 Y859 L860 I863	V816-F820 HydrophobicContact CG1-CD1 4.25Å; V816-F820 HydrophobicContact CG1-CE1 3.87Å; V816-F820 HydrophobicContact CG1-CZ 4.03Å; V816-F820 WeakPolarHBondContact O-CD1 3.38Å; V816-F820 PolarHBondContact O-N 2.85Å; V817-F820 PolarHBondContact O-N 2.95Å; F820-N822 VanDerWaalsContact C-N 3.35Å; F820-N822 PolarHBondContact O-N 2.73Å; F820-Y823 PolarHBondContact O-N 3.32Å; F820-M824 WeakPolarHBondContact O-CB 3.3Å; F820-M824 VanDerWaalsContact O-CG 3.25Å; F820-M824 WeakPolarHBondContact O-CG 3.33Å; F820-M824 PolarHBondContact O-N 3.17Å; F820-L856 HydrophobicContact CD2-CD1 3.78Å; F820-L856 HydrophobicContact CD2-CG 4.36Å; F820-L856 HydrophobicContact CE2-CD1 4.2Å; F820-Y859 AromaticContact CE2-CD1 3.87Å; F820-Y859 HydrophobicContact CE2-CD1 3.87Å; F820-Y859 HydrophobicContact CE2-CE1 4.23Å; F820-Y859 HydrophobicContact CZ-CD1 4.04Å; F820-Y859 AromaticContact CZ-CE1 3.96Å; F820-Y859 HydrophobicContact CZ-CE1 3.96Å; F820-L860 HydrophobicContact CD2-CD1 4.06Å; F820-L860 HydrophobicContact CE2-CB 3.97Å; F820-L860 HydrophobicContact CE2-CD1 3.69Å; F820-L860 HydrophobicContact CE2-CG 4.46Å; F820-L860 HydrophobicContact CZ-CD1 4.23Å; F820-I863 HydrophobicContact CZ-CB 4.35Å; F820-I863 HydrophobicContact CZ-CG1 4.38Å; F820-I863 HydrophobicContact CZ-CG2 4.31Å
821	G	83.8	Confident	86.7	Confident	28 Å²	28	77 Å²	77	29%	0.289	39%	0.389	S	S	.	.	H	α-helix	trans	-56.6	-45.8	179.2	0	0	0	0	0	112.7	V817 L818 N825	V817-G821 PolarHBondContact O-N 3.13Å; L818-G821 PolarHBondContact O-N 3.27Å; G821-N825 VanDerWaalsContact O-CB 3.31Å; G821-N825 WeakPolarHBondContact O-CB 3.36Å; G821-N825 PolarHBondContact O-N 2.88Å; G821-N825 PolarHBondContact O-ND2 3.46Å
822	N	85.1	Confident	86.3	Confident	46 Å²	46	75 Å²	75	25%	0.246	39%	0.388	C	S	.	.	H	α-helix	trans	-69.4	-37.8	177.6	-80.1	-33.6	0	0	0	113.4	L818 F820 N831 A832	L818-N822 WeakPolarHBondContact O-CB 3.11Å; L818-N822 PolarHBondContact O-N 3.01Å; L818-N822 PolarHBondContact O-ND2 3.18Å; F820-N822 VanDerWaalsContact C-N 3.35Å; F820-N822 PolarHBondContact O-N 2.73Å; N822-N831 WeakPolarHBondContact OD1-CA 3.46Å; N822-N831 PolarHBondContact OD1-N 3.3Å; N822-A832 PolarHBondContact ND2-O 2.81Å; N822-A832 PolarHBondContact OD1-N 3.14Å
823	Y	85.6	Confident	85.9	Confident	167 Å²	167	83.3 Å²	83.3	66%	0.655	42%	0.418	S	S	*	.	H	α-helix	trans	-71.9	-35	178.7	-175.9	-102.5	0	0	0	112.9	A819 F820 K826	A819-Y823 WeakPolarHBondContact O-CB 3.22Å; A819-Y823 PolarHBondContact O-N 2.85Å; F820-Y823 PolarHBondContact O-N 3.32Å; Y823-K826 WeakPolarHBondContact O-CE 3.38Å; Y823-K826 VanDerWaalsContact O-CG 3.29Å; Y823-K826 WeakPolarHBondContact O-CG 3.42Å
824	M	86.3	Confident	85.6	Confident	95 Å²	95	85.1 Å²	85.1	47%	0.468	44%	0.439	S	S	.	.	H	α-helix	trans	-80.7	-46	-178.8	-65.9	173.9	71.5	0	0	112.1	F820 K826 T846 L856	F820-M824 WeakPolarHBondContact O-CB 3.3Å; F820-M824 VanDerWaalsContact O-CG 3.25Å; F820-M824 WeakPolarHBondContact O-CG 3.33Å; F820-M824 PolarHBondContact O-N 3.17Å; M824-K826 VanDerWaalsContact C-N 3.28Å; M824-K826 PolarHBondContact O-N 3.22Å; M824-T846 HydrophobicContact CE-CG2 3.75Å; M824-L856 HydrophobicContact CE-CD1 4.24Å; M824-L856 HydrophobicContact CE-CD2 4.08Å; M824-L856 HydrophobicContact SD-CD1 3.83Å; M824-L856 HydrophobicContact SD-CD2 3.8Å; M824-L856 HydrophobicContact SD-CG 4.5Å
825	N	83.2	Confident	85.5	Confident	69 Å²	69	86.7 Å²	86.7	37%	0.369	45%	0.445	S	S	.	.	S	Bend	trans	-87	54.4	-175.4	-62.5	-75.6	0	0	0	112.9	G821 R829 G830	G821-N825 VanDerWaalsContact O-CB 3.31Å; G821-N825 WeakPolarHBondContact O-CB 3.36Å; G821-N825 PolarHBondContact O-N 2.88Å; G821-N825 PolarHBondContact O-ND2 3.46Å; N825-R829 HydrophobicContact CB-CB 4.01Å; N825-R829 VanDerWaalsContact CB-O 3.27Å; N825-R829 WeakPolarHBondContact CB-O 3.41Å; N825-R829 CarbonylContact O-C 3.58Å; N825-G830 VanDerWaalsContact O-CA 3.31Å; N825-G830 WeakPolarHBondContact O-CA 3.46Å; N825-G830 PolarHBondContact O-N 3.48Å
826	K	79.4	Confident	85.6	Confident	148 Å²	148	86.3 Å²	86.3	64%	0.643	44%	0.441	S	S	*	.			trans	-56.8	144.5	-173.7	-60.6	-172.9	-179.4	-178.9	0	113.3	Y823 M824	Y823-K826 WeakPolarHBondContact O-CE 3.38Å; Y823-K826 VanDerWaalsContact O-CG 3.29Å; Y823-K826 WeakPolarHBondContact O-CG 3.42Å; M824-K826 VanDerWaalsContact C-N 3.28Å; M824-K826 PolarHBondContact O-N 3.22Å
827	G	74.1	Confident	85.6	Confident	52 Å²	52	86 Å²	86	54%	0.536	44%	0.44	S	S	.	.	S	Bend	trans	89.8	-148.3	-177.1	0	0	0	0	0	112.6	R829 G830	G827-R829 PolarHBondContact O-N 2.98Å; G827-G830 PolarHBondContact O-N 2.89Å
828	Q	75.9	Confident	85.6	Confident	200 Å²	200	87.2 Å²	87.2	94%	0.935	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-1.7	-175.8	-67.9	-70	-10.2	0	0	115.1
829	R	72.6	Confident	85.9	Confident	211 Å²	211	87.4 Å²	87.4	80%	0.796	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.3	1.4	174.8	-64.6	-175.5	66.1	166.4	-0.5	113.3	N825 G827	N825-R829 HydrophobicContact CB-CB 4.01Å; N825-R829 VanDerWaalsContact CB-O 3.27Å; N825-R829 WeakPolarHBondContact CB-O 3.41Å; N825-R829 CarbonylContact O-C 3.58Å; G827-R829 PolarHBondContact O-N 2.98Å
830	G	80.2	Confident	86.1	Confident	15 Å²	15	84.8 Å²	84.8	16%	0.155	43%	0.431	C	S	.	.			trans	-118	-153.4	175.1	0	0	0	0	0	110.5	N825 G827 A832	N825-G830 VanDerWaalsContact O-CA 3.31Å; N825-G830 WeakPolarHBondContact O-CA 3.46Å; N825-G830 PolarHBondContact O-N 3.48Å; G827-G830 PolarHBondContact O-N 2.89Å; G830-A832 PolarHBondContact O-N 2.92Å
831	N	82.9	Confident	86.4	Confident	134 Å²	134	84.9 Å²	84.9	72%	0.717	43%	0.434	S	S	*	.			trans	54.1	30	-171.8	-58.8	-18.2	0	0	0	113.3	N822	N822-N831 WeakPolarHBondContact OD1-CA 3.46Å; N822-N831 PolarHBondContact OD1-N 3.3Å
832	A	86.5	Confident	86.9	Confident	41 Å²	41	89.3 Å²	89.3	34%	0.339	45%	0.445	S	S	.	.			trans	-74.4	141.7	173.7	0	0	0	0	0	110.6	L818 N822 G830	L818-A832 HydrophobicContact CD1-CB 4.12Å; L818-A832 WeakPolarHBondContact CD1-O 3.3Å; N822-A832 PolarHBondContact ND2-O 2.81Å; N822-A832 PolarHBondContact OD1-N 3.14Å; G830-A832 PolarHBondContact O-N 2.92Å
833	Y	88.9	Confident	87.3	Confident	226 Å²	226	87.7 Å²	87.7	89%	0.886	44%	0.437	S	S	*	.	S	Bend	trans	-97.3	-4	173.1	-62.7	-85.4	0	0	0	112.8
834	G	87.6	Confident	87.6	Confident	47 Å²	47	81.4 Å²	81.4	49%	0.485	42%	0.419	S	S	.	.			trans	175.8	172.6	-179.2	0	0	0	0	0	110.5
835	F	93.7	Very high	87.9	Confident	62 Å²	62	82.4 Å²	82.4	27%	0.272	43%	0.426	S	S	.	.			trans	-147.1	155.8	178.6	52.6	-95.8	0	0	0	110.6	L814 V817 L818 L840	L814-F835 HydrophobicContact CB-CZ 4.48Å; L814-F835 HydrophobicContact CD2-CE2 3.57Å; L814-F835 HydrophobicContact CD2-CZ 3.48Å; L814-F835 VanDerWaalsContact CD2-CZ 3.48Å; V817-F835 HydrophobicContact CB-CE1 4.13Å; V817-F835 HydrophobicContact CB-CZ 3.8Å; V817-F835 HydrophobicContact CG1-CE1 3.71Å; V817-F835 HydrophobicContact CG1-CE2 4.13Å; V817-F835 HydrophobicContact CG1-CZ 3.38Å; L818-F835 HydrophobicContact CB-CE1 4.03Å; L818-F835 HydrophobicContact CD1-CD1 3.92Å; L818-F835 HydrophobicContact CD1-CE1 4.26Å; F835-L840 HydrophobicContact CE2-CD2 4.3Å
836	K	94.1	Very high	88.2	Confident	109 Å²	109	82 Å²	82	47%	0.474	43%	0.426	S	S	.	.			trans	-61.8	135.4	173.3	-76.3	-178.3	155.5	-78.6	0	110.4	S838 S839 E962	K836-S838 PolarHBondContact O-N 2.63Å; K836-S838 VanDerWaalsContact O-N 3.11Å; K836-S839 WeakPolarHBondContact O-CB 3.25Å; K836-S839 PolarHBondContact O-N 3.01Å; K836-S839 PolarHBondContact O-OG 2.95Å; K836-E962 WeakPolarHBondContact CB-OE1 3.18Å; K836-E962 WeakPolarHBondContact CG-OE1 3.28Å; K836-E962 IonicContact NZ-OE1 2.75Å; K836-E962 PolarHBondContact NZ-OE1 3.44Å; K836-E962 IonicContact NZ-OE2 2.76Å; K836-E962 PolarHBondContact NZ-OE2 3.17Å
837	I	95.1	Very high	88.7	Confident	3 Å²	3	81.5 Å²	81.5	2%	0.015	42%	0.424	C	S	.	.	G	3₁₀ helix	trans	-56.8	-29.7	-176.9	48.2	166.2	0	0	0	113.7	S839 L840 F960 E962 F972 I975 F976	I837-S839 PolarHBondContact O-N 2.97Å; I837-L840 VanDerWaalsContact O-CB 3.24Å; I837-L840 WeakPolarHBondContact O-CB 3.24Å; I837-L840 VanDerWaalsContact O-CG 3.29Å; I837-L840 WeakPolarHBondContact O-CG 3.47Å; I837-L840 PolarHBondContact O-N 3.28Å; I837-F960 HydrophobicContact CD1-CB 4.31Å; I837-F960 HydrophobicContact CG2-CB 3.77Å; I837-F960 HydrophobicContact CG2-CD1 3.56Å; I837-F960 HydrophobicContact CG2-CE1 4.49Å; I837-F960 HydrophobicContact CG2-CG 3.91Å; I837-E962 HydrophobicContact CD1-CG 4.32Å; I837-E962 HydrophobicContact CG1-CG 4.12Å; I837-F972 HydrophobicContact CD1-CD2 3.81Å; I837-F972 HydrophobicContact CD1-CE2 3.59Å; I837-F972 HydrophobicContact CD1-CZ 4.39Å; I837-I975 HydrophobicContact CB-CG2 4.15Å; I837-I975 HydrophobicContact CD1-CD1 4.07Å; I837-I975 HydrophobicContact CD1-CG2 4.24Å; I837-I975 HydrophobicContact CG1-CD1 4.18Å; I837-I975 HydrophobicContact CG1-CG2 4.17Å; I837-F976 HydrophobicContact CB-CZ 4.25Å; I837-F976 HydrophobicContact CD1-CD2 4.43Å; I837-F976 HydrophobicContact CD1-CE2 3.56Å; I837-F976 HydrophobicContact CD1-CZ 3.69Å; I837-F976 HydrophobicContact CG2-CE1 4.22Å; I837-F976 HydrophobicContact CG2-CZ 3.9Å
838	S	93.2	Very high	89.5	Confident	42 Å²	42	80.9 Å²	80.9	29%	0.294	41%	0.412	S	S	.	.	G	3₁₀ helix	trans	-63.3	-2.3	171.8	55.7	0	0	0	0	115.1	K836	K836-S838 PolarHBondContact O-N 2.63Å; K836-S838 VanDerWaalsContact O-N 3.11Å
839	S	94.9	Very high	90.1	Very high	44 Å²	44	77.4 Å²	77.4	31%	0.308	41%	0.409	S	S	.	.	G	3₁₀ helix	trans	-80	-20.4	168.4	-44.6	0	0	0	0	112.8	K836 I837 N841 K842	K836-S839 WeakPolarHBondContact O-CB 3.25Å; K836-S839 PolarHBondContact O-N 3.01Å; K836-S839 PolarHBondContact O-OG 2.95Å; I837-S839 PolarHBondContact O-N 2.97Å; S839-N841 VanDerWaalsContact C-N 3.32Å; S839-N841 PolarHBondContact O-N 3.13Å; S839-K842 WeakPolarHBondContact O-CB 3.29Å; S839-K842 PolarHBondContact O-N 3.1Å
840	L	95.2	Very high	90.8	Very high	1 Å²	1	75 Å²	75	1%	0.005	41%	0.411	C	S	.	.	G	3₁₀ helix	trans	-56.2	-46.4	177.1	-73.9	173.9	0	0	0	111.4	L814 F835 I837 K842 I843 F976 F979	L814-L840 HydrophobicContact CD2-CD1 4.36Å; L814-L840 HydrophobicContact CD2-CD2 3.86Å; L814-L840 HydrophobicContact CD2-CG 4.36Å; F835-L840 HydrophobicContact CE2-CD2 4.3Å; I837-L840 VanDerWaalsContact O-CB 3.24Å; I837-L840 WeakPolarHBondContact O-CB 3.24Å; I837-L840 VanDerWaalsContact O-CG 3.29Å; I837-L840 WeakPolarHBondContact O-CG 3.47Å; I837-L840 PolarHBondContact O-N 3.28Å; L840-K842 PolarHBondContact O-N 2.96Å; L840-K842 VanDerWaalsContact O-N 3.08Å; L840-I843 HydrophobicContact CD2-CD1 4Å; L840-I843 WeakPolarHBondContact O-CB 3.44Å; L840-I843 WeakPolarHBondContact O-CD1 3.36Å; L840-I843 VanDerWaalsContact O-CG1 3.24Å; L840-I843 WeakPolarHBondContact O-CG1 3.18Å; L840-I843 PolarHBondContact O-N 3.34Å; L840-I843 VanDerWaalsContact O-N 3.11Å; L840-F976 HydrophobicContact CD1-CD1 4.32Å; L840-F976 HydrophobicContact CD1-CE1 4.26Å; L840-F979 HydrophobicContact CB-CB 4.32Å; L840-F979 HydrophobicContact CB-CD1 4.46Å; L840-F979 HydrophobicContact CB-CD2 3.59Å; L840-F979 HydrophobicContact CB-CE2 3.98Å; L840-F979 HydrophobicContact CB-CG 3.85Å; L840-F979 HydrophobicContact CD1-CD1 4.14Å; L840-F979 HydrophobicContact CD1-CG 4.21Å; L840-F979 HydrophobicContact CD2-CD2 4.49Å; L840-F979 HydrophobicContact CD2-CE1 4.21Å; L840-F979 HydrophobicContact CD2-CE2 4.15Å; L840-F979 HydrophobicContact CD2-CZ 4Å; L840-F979 HydrophobicContact CG-CD2 4.47Å; L840-F979 HydrophobicContact CG-CG 4.47Å
841	N	95.8	Very high	90.9	Very high	42 Å²	42	76.6 Å²	76.6	23%	0.225	42%	0.416	C	S	.	.	G	3₁₀ helix	trans	-70.3	-6	-179.8	-60.7	-14.4	0	0	0	113.3	S839 I975 Q978 F979	S839-N841 VanDerWaalsContact C-N 3.32Å; S839-N841 PolarHBondContact O-N 3.13Å; N841-I975 PolarHBondContact ND2-O 2.92Å; N841-I975 PolarHBondContact OD1-O 2.78Å; N841-Q978 VanDerWaalsContact ND2-CB 3.35Å; N841-Q978 WeakPolarHBondContact ND2-CB 3.23Å; N841-Q978 PolarHBondContact ND2-OE1 2.87Å; N841-Q978 VanDerWaalsContact ND2-OE1 3.07Å; N841-F979 VanDerWaalsContact OD1-CA 3.24Å; N841-F979 WeakPolarHBondContact OD1-CA 3.43Å; N841-F979 WeakPolarHBondContact OD1-CB 3.43Å; N841-F979 PolarHBondContact OD1-N 2.95Å
842	K	94.6	Very high	91.1	Very high	121 Å²	121	78.2 Å²	78.2	53%	0.526	42%	0.416	S	S	.	.	G	3₁₀ helix	trans	-102.2	-1.7	177	-58.2	175.7	-173.9	170.3	0	113	S839 L840 A844 D845	S839-K842 WeakPolarHBondContact O-CB 3.29Å; S839-K842 PolarHBondContact O-N 3.1Å; L840-K842 PolarHBondContact O-N 2.96Å; L840-K842 VanDerWaalsContact O-N 3.08Å; K842-A844 PolarHBondContact O-N 2.89Å; K842-D845 WeakPolarHBondContact CA-OD2 3.47Å; K842-D845 WeakPolarHBondContact CB-OD2 3.38Å; K842-D845 WeakPolarHBondContact O-CB 3.32Å; K842-D845 PolarHBondContact O-N 3.14Å
843	I	93.3	Very high	91	Very high	13 Å²	13	81.8 Å²	81.8	7%	0.067	43%	0.43	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-35.2	173.8	-60.5	170	0	0	0	109.8	V817 L840 D845 T846 L856 L857 L860 F979	V817-I843 HydrophobicContact CB-CD1 4.48Å; V817-I843 HydrophobicContact CG1-CD1 3.81Å; V817-I843 HydrophobicContact CG1-CG1 4.4Å; V817-I843 HydrophobicContact CG2-CD1 3.71Å; L840-I843 HydrophobicContact CD2-CD1 4Å; L840-I843 WeakPolarHBondContact O-CB 3.44Å; L840-I843 WeakPolarHBondContact O-CD1 3.36Å; L840-I843 VanDerWaalsContact O-CG1 3.24Å; L840-I843 WeakPolarHBondContact O-CG1 3.18Å; L840-I843 PolarHBondContact O-N 3.34Å; L840-I843 VanDerWaalsContact O-N 3.11Å; I843-D845 VanDerWaalsContact C-N 3.31Å; I843-D845 PolarHBondContact O-N 3.11Å; I843-T846 PolarHBondContact O-N 3.36Å; I843-L856 HydrophobicContact CG2-CB 4.08Å; I843-L856 HydrophobicContact CG2-CD2 4.2Å; I843-L856 HydrophobicContact CG2-CG 3.98Å; I843-L856 WeakPolarHBondContact O-CB 3.22Å; I843-L857 HydrophobicContact CB-CB 4.49Å; I843-L857 HydrophobicContact CG2-CB 3.93Å; I843-L857 HydrophobicContact CG2-CD1 4.21Å; I843-L860 HydrophobicContact CD1-CD2 4.18Å; I843-L860 HydrophobicContact CG2-CD2 4.4Å; I843-F979 HydrophobicContact CD1-CE2 4.13Å
844	A	92.1	Very high	91.1	Very high	35 Å²	35	73.7 Å²	73.7	29%	0.289	40%	0.401	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-25.7	177.2	0	0	0	0	0	114.2	K842 T846 T855 L857	K842-A844 PolarHBondContact O-N 2.89Å; A844-T846 PolarHBondContact O-N 3.08Å; A844-T855 WeakPolarHBondContact O-CB 3.21Å; A844-T855 VanDerWaalsContact O-CG2 3.23Å; A844-T855 WeakPolarHBondContact O-CG2 3.32Å; A844-L857 HydrophobicContact CB-CD2 4.4Å
845	D	91.9	Very high	91.4	Very high	115 Å²	115	72.2 Å²	72.2	62%	0.615	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-28.6	179	-64.1	-29.9	0	0	0	112.4	K842 I843 K847	K842-D845 WeakPolarHBondContact CA-OD2 3.47Å; K842-D845 WeakPolarHBondContact CB-OD2 3.38Å; K842-D845 WeakPolarHBondContact O-CB 3.32Å; K842-D845 PolarHBondContact O-N 3.14Å; I843-D845 VanDerWaalsContact C-N 3.31Å; I843-D845 PolarHBondContact O-N 3.11Å; D845-K847 PolarHBondContact O-N 3.43Å
846	T	90	Very high	91.3	Very high	61 Å²	61	70.8 Å²	70.8	37%	0.374	38%	0.378	S	S	.	.	S	Bend	trans	-82.9	107.2	-178.1	-59.1	0	0	0	0	109.9	M824 I843 A844 T855 L856	M824-T846 HydrophobicContact CE-CG2 3.75Å; I843-T846 PolarHBondContact O-N 3.36Å; A844-T846 PolarHBondContact O-N 3.08Å; T846-T855 CarbonylContact O-C 3.58Å; T846-T855 WeakPolarHBondContact O-CA 3.31Å; T846-L856 HydrophobicContact CG2-CB 4.09Å; T846-L856 HydrophobicContact CG2-CD2 4.16Å; T846-L856 PolarHBondContact O-N 3.36Å
847	K	90.7	Very high	91.4	Very high	138 Å²	138	65.8 Å²	65.8	60%	0.6	36%	0.356	S	S	*	.	B	Isolated β-bridge	trans	-97.2	147	-175.5	-53.9	-165.7	173.6	-152.6	0	112.4	D845	D845-K847 PolarHBondContact O-N 3.43Å
848	S	89.8	Confident	91.3	Very high	39 Å²	39	66.2 Å²	66.2	27%	0.273	36%	0.358	S	S	.	.			trans	-68.5	147.1	177.2	176.1	0	0	0	0	111.6	I850 D851 I854	S848-I850 VanDerWaalsContact C-N 3.31Å; S848-I850 PolarHBondContact OG-N 3.15Å; S848-D851 WeakPolarHBondContact CB-O 3.36Å; S848-I854 WeakPolarHBondContact CB-O 3.42Å; S848-I854 PolarHBondContact N-O 3.16Å
849	S	89.6	Confident	91.4	Very high	126 Å²	126	70 Å²	70	88%	0.881	37%	0.367	S	S	*	.	S	Bend	trans	-79.6	-13.1	173.7	54.3	0	0	0	0	113.5
850	I	85.9	Confident	91.3	Very high	162 Å²	162	68 Å²	68	83%	0.831	35%	0.353	S	S	*	.	S	Bend	trans	-89.5	-45.6	-179.5	-57	175.8	0	0	0	110.6	S848	S848-I850 VanDerWaalsContact C-N 3.31Å; S848-I850 PolarHBondContact OG-N 3.15Å
851	D	83.9	Confident	91.3	Very high	47 Å²	47	68.7 Å²	68.7	25%	0.251	36%	0.356	S	S	.	.			trans	-139.6	124.2	174.7	-177.9	-7.4	0	0	0	108.4	S848 N853 I854	S848-D851 WeakPolarHBondContact CB-O 3.36Å; D851-N853 PolarHBondContact O-N 2.59Å; D851-N853 WeakPolarHBondContact OD1-CB 3.49Å; D851-N853 PolarHBondContact OD1-N 2.67Å; D851-N853 PolarHBondContact OD1-ND2 2.87Å; D851-N853 VanDerWaalsContact OD1-ND2 3.12Å; D851-I854 HydrophobicContact CB-CB 4.47Å; D851-I854 HydrophobicContact CB-CD1 4.03Å; D851-I854 HydrophobicContact CB-CG1 4.04Å; D851-I854 PolarHBondContact O-N 2.67Å
852	K	85.6	Confident	91.1	Very high	168 Å²	168	69.2 Å²	69.2	73%	0.73	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.9	-13.6	-178.3	-66.1	178.5	-179.8	176.8	0	113.3
853	N	85.4	Confident	90.9	Very high	117 Å²	117	65.7 Å²	65.7	63%	0.626	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.2	-31.1	174.4	-54.6	-38.1	0	0	0	111.2	D851 T855	D851-N853 PolarHBondContact O-N 2.59Å; D851-N853 WeakPolarHBondContact OD1-CB 3.49Å; D851-N853 PolarHBondContact OD1-N 2.67Å; D851-N853 PolarHBondContact OD1-ND2 2.87Å; D851-N853 VanDerWaalsContact OD1-ND2 3.12Å; N853-T855 PolarHBondContact O-N 3.11Å
854	I	90.7	Very high	90.9	Very high	56 Å²	56	65.5 Å²	65.5	29%	0.287	35%	0.347	S	S	.	.			trans	-79	117.1	178.7	-58.9	178.7	0	0	0	109.3	S848 D851 H858 M993	S848-I854 WeakPolarHBondContact CB-O 3.42Å; S848-I854 PolarHBondContact N-O 3.16Å; D851-I854 HydrophobicContact CB-CB 4.47Å; D851-I854 HydrophobicContact CB-CD1 4.03Å; D851-I854 HydrophobicContact CB-CG1 4.04Å; D851-I854 PolarHBondContact O-N 2.67Å; I854-H858 HydrophobicContact CG2-CB 3.99Å; I854-M993 HydrophobicContact CD1-CE 4.47Å
855	T	94.8	Very high	90.7	Very high	16 Å²	16	66.3 Å²	66.3	10%	0.098	34%	0.344	C	S	.	.	B	Isolated β-bridge	trans	-94.8	169.2	175.5	70.7	0	0	0	0	111.9	A844 T846 N853 L857 H858 Y859	A844-T855 WeakPolarHBondContact O-CB 3.21Å; A844-T855 VanDerWaalsContact O-CG2 3.23Å; A844-T855 WeakPolarHBondContact O-CG2 3.32Å; T846-T855 CarbonylContact O-C 3.58Å; T846-T855 WeakPolarHBondContact O-CA 3.31Å; N853-T855 PolarHBondContact O-N 3.11Å; T855-L857 PolarHBondContact O-N 3.46Å; T855-L857 PolarHBondContact OG1-N 3.01Å; T855-H858 PolarHBondContact N-ND1 3.27Å; T855-H858 WeakPolarHBondContact O-CB 3.23Å; T855-H858 PolarHBondContact O-N 2.9Å; T855-H858 PolarHBondContact OG1-N 2.96Å; T855-H858 PolarHBondContact OG1-ND1 2.75Å; T855-Y859 PolarHBondContact O-N 2.8Å; T855-Y859 VanDerWaalsContact O-N 3.11Å
856	L	91.6	Very high	90.6	Very high	31 Å²	31	66.3 Å²	66.3	16%	0.162	35%	0.345	C	S	.	.	H	α-helix	trans	-61.8	-26	172	-176.9	63.7	0	0	0	111.5	F820 M824 I843 T846 Y859 L860	F820-L856 HydrophobicContact CD2-CD1 3.78Å; F820-L856 HydrophobicContact CD2-CG 4.36Å; F820-L856 HydrophobicContact CE2-CD1 4.2Å; M824-L856 HydrophobicContact CE-CD1 4.24Å; M824-L856 HydrophobicContact CE-CD2 4.08Å; M824-L856 HydrophobicContact SD-CD1 3.83Å; M824-L856 HydrophobicContact SD-CD2 3.8Å; M824-L856 HydrophobicContact SD-CG 4.5Å; I843-L856 HydrophobicContact CG2-CB 4.08Å; I843-L856 HydrophobicContact CG2-CD2 4.2Å; I843-L856 HydrophobicContact CG2-CG 3.98Å; I843-L856 WeakPolarHBondContact O-CB 3.22Å; T846-L856 HydrophobicContact CG2-CB 4.09Å; T846-L856 HydrophobicContact CG2-CD2 4.16Å; T846-L856 PolarHBondContact O-N 3.36Å; L856-Y859 HydrophobicContact CD1-CD1 4.42Å; L856-Y859 PolarHBondContact O-N 3.43Å; L856-L860 WeakPolarHBondContact O-CB 3.43Å; L856-L860 PolarHBondContact O-N 3.18Å
857	L	94.9	Very high	90.8	Very high	4 Å²	4	70.6 Å²	70.6	2%	0.021	36%	0.358	C	S	.	.	H	α-helix	trans	-69.4	-44.5	175	-173.1	58.1	0	0	0	111.3	I843 A844 T855 Y859 L860 I861 F979 A982 V983 A986	I843-L857 HydrophobicContact CB-CB 4.49Å; I843-L857 HydrophobicContact CG2-CB 3.93Å; I843-L857 HydrophobicContact CG2-CD1 4.21Å; A844-L857 HydrophobicContact CB-CD2 4.4Å; T855-L857 PolarHBondContact O-N 3.46Å; T855-L857 PolarHBondContact OG1-N 3.01Å; L857-Y859 VanDerWaalsContact C-N 3.32Å; L857-Y859 PolarHBondContact O-N 2.73Å; L857-L860 HydrophobicContact CD1-CD2 4.19Å; L857-L860 WeakPolarHBondContact O-CB 3.49Å; L857-L860 PolarHBondContact O-N 3.47Å; L857-I861 HydrophobicContact CD1-CD1 4.38Å; L857-I861 HydrophobicContact CG-CD1 4.13Å; L857-I861 VanDerWaalsContact O-CG1 3.32Å; L857-I861 WeakPolarHBondContact O-CG1 3Å; L857-I861 PolarHBondContact O-N 3.41Å; L857-F979 HydrophobicContact CD1-CE2 3.8Å; L857-F979 HydrophobicContact CD1-CZ 4.1Å; L857-A982 HydrophobicContact CD2-CB 3.89Å; L857-V983 HydrophobicContact CD1-CG2 4.04Å; L857-A986 HydrophobicContact CD2-CB 4.17Å; L857-A986 HydrophobicContact CG-CB 4.11Å
858	H	94.3	Very high	90.9	Very high	13 Å²	13	68 Å²	68	6%	0.06	35%	0.345	C	S	.	.	H	α-helix	trans	-56.7	-45.5	171.8	-73.2	92.6	0	0	0	112	I854 T855 T862 A986 E989 N990	I854-H858 HydrophobicContact CG2-CB 3.99Å; T855-H858 PolarHBondContact N-ND1 3.27Å; T855-H858 WeakPolarHBondContact O-CB 3.23Å; T855-H858 PolarHBondContact O-N 2.9Å; T855-H858 PolarHBondContact OG1-N 2.96Å; T855-H858 PolarHBondContact OG1-ND1 2.75Å; H858-T862 WeakPolarHBondContact O-CB 3.37Å; H858-T862 PolarHBondContact O-N 2.94Å; H858-T862 PolarHBondContact O-OG1 3.43Å; H858-A986 PolarHBondContact CD2-O 2.6Å; H858-A986 WeakPolarHBondContact NE2-CA 3.3Å; H858-E989 IonicContact CE1-OE2 2.85Å; H858-E989 PolarHBondContact CE1-OE2 2.99Å; H858-E989 WeakPolarHBondContact NE2-CB 3.43Å; H858-E989 IonicContact NE2-OE2 3.45Å; H858-E989 PolarHBondContact NE2-OE2 2.88Å; H858-N990 WeakPolarHBondContact CB-OD1 3.14Å; H858-N990 PolarHBondContact CD2-OD1 3.09Å; H858-N990 PolarHBondContact O-ND2 3.16Å
859	Y	93.9	Very high	91	Very high	122 Å²	122	69.7 Å²	69.7	48%	0.478	36%	0.355	S	S	.	.	H	α-helix	trans	-66.3	-42.7	177.5	-174	-103.5	0	0	0	112.4	F820 T855 L856 L857 T862 I863	F820-Y859 AromaticContact CE2-CD1 3.87Å; F820-Y859 HydrophobicContact CE2-CD1 3.87Å; F820-Y859 HydrophobicContact CE2-CE1 4.23Å; F820-Y859 HydrophobicContact CZ-CD1 4.04Å; F820-Y859 AromaticContact CZ-CE1 3.96Å; F820-Y859 HydrophobicContact CZ-CE1 3.96Å; T855-Y859 PolarHBondContact O-N 2.8Å; T855-Y859 VanDerWaalsContact O-N 3.11Å; L856-Y859 HydrophobicContact CD1-CD1 4.42Å; L856-Y859 PolarHBondContact O-N 3.43Å; L857-Y859 VanDerWaalsContact C-N 3.32Å; L857-Y859 PolarHBondContact O-N 2.73Å; Y859-T862 PolarHBondContact O-N 2.68Å; Y859-I863 HydrophobicContact CD1-CG1 4.13Å; Y859-I863 HydrophobicContact CE1-CD1 4.35Å; Y859-I863 HydrophobicContact CE1-CG1 3.69Å; Y859-I863 HydrophobicContact CE2-CD1 4.23Å; Y859-I863 HydrophobicContact CE2-CG1 4.11Å; Y859-I863 WeakPolarHBondContact O-CG1 3.16Å; Y859-I863 PolarHBondContact O-N 2.66Å
860	L	93.4	Very high	90.9	Very high	1 Å²	1	66.8 Å²	66.8	1%	0.005	34%	0.335	C	S	.	.	H	α-helix	trans	-56.7	-52.6	175.3	177	66.4	0	0	0	111	L813 V816 V817 F820 I843 L856 L857 T862 I863 V864	L813-L860 HydrophobicContact CD1-CD1 4.19Å; L813-L860 HydrophobicContact CD1-CD2 3.88Å; L813-L860 HydrophobicContact CD1-CG 4.03Å; V816-L860 HydrophobicContact CB-CD1 4.21Å; V816-L860 HydrophobicContact CG1-CD1 3.54Å; V817-L860 HydrophobicContact CG2-CD1 4.15Å; V817-L860 HydrophobicContact CG2-CD2 3.52Å; F820-L860 HydrophobicContact CD2-CD1 4.06Å; F820-L860 HydrophobicContact CE2-CB 3.97Å; F820-L860 HydrophobicContact CE2-CD1 3.69Å; F820-L860 HydrophobicContact CE2-CG 4.46Å; F820-L860 HydrophobicContact CZ-CD1 4.23Å; I843-L860 HydrophobicContact CD1-CD2 4.18Å; I843-L860 HydrophobicContact CG2-CD2 4.4Å; L856-L860 WeakPolarHBondContact O-CB 3.43Å; L856-L860 PolarHBondContact O-N 3.18Å; L857-L860 HydrophobicContact CD1-CD2 4.19Å; L857-L860 WeakPolarHBondContact O-CB 3.49Å; L857-L860 PolarHBondContact O-N 3.47Å; L860-T862 VanDerWaalsContact C-N 3.34Å; L860-T862 PolarHBondContact O-N 3.49Å; L860-I863 PolarHBondContact O-N 3.06Å; L860-V864 HydrophobicContact CD1-CG2 3.94Å; L860-V864 HydrophobicContact CG-CG2 4.3Å; L860-V864 VanDerWaalsContact O-CB 3.26Å; L860-V864 WeakPolarHBondContact O-CB 3.3Å; L860-V864 WeakPolarHBondContact O-CG2 3.44Å; L860-V864 PolarHBondContact O-N 3.07Å
861	I	94.3	Very high	91.2	Very high	16 Å²	16	59.4 Å²	59.4	8%	0.082	30%	0.298	C	S	.	.	H	α-helix	trans	-56	-49.9	176.7	-67.1	162.2	0	0	0	109.9	L857 I863 V864 E865 V983 A986 K987	L857-I861 HydrophobicContact CD1-CD1 4.38Å; L857-I861 HydrophobicContact CG-CD1 4.13Å; L857-I861 VanDerWaalsContact O-CG1 3.32Å; L857-I861 WeakPolarHBondContact O-CG1 3Å; L857-I861 PolarHBondContact O-N 3.41Å; I861-I863 VanDerWaalsContact C-N 3.33Å; I861-I863 PolarHBondContact O-N 2.96Å; I861-V864 PolarHBondContact O-N 2.91Å; I861-V864 VanDerWaalsContact O-N 3.17Å; I861-E865 HydrophobicContact CG2-CG 4.19Å; I861-E865 VanDerWaalsContact O-CG 3.3Å; I861-E865 WeakPolarHBondContact O-CG 3.49Å; I861-E865 PolarHBondContact O-N 3.43Å; I861-V983 HydrophobicContact CD1-CG1 4.23Å; I861-V983 WeakPolarHBondContact CD1-O 3.31Å; I861-V983 HydrophobicContact CG1-CG1 4.49Å; I861-A986 HydrophobicContact CD1-CB 3.63Å; I861-K987 HydrophobicContact CD1-CB 4.42Å; I861-K987 HydrophobicContact CG2-CB 4.22Å; I861-K987 HydrophobicContact CG2-CG 4.23Å
862	T	91.8	Very high	91.3	Very high	53 Å²	53	60.3 Å²	60.3	33%	0.325	30%	0.302	S	S	.	.	H	α-helix	trans	-57.7	-42.2	179.7	-57.3	0	0	0	0	112.7	H858 Y859 L860 N866 N990	H858-T862 WeakPolarHBondContact O-CB 3.37Å; H858-T862 PolarHBondContact O-N 2.94Å; H858-T862 PolarHBondContact O-OG1 3.43Å; Y859-T862 PolarHBondContact O-N 2.68Å; L860-T862 VanDerWaalsContact C-N 3.34Å; L860-T862 PolarHBondContact O-N 3.49Å; T862-N866 PolarHBondContact O-N 2.94Å; T862-N866 PolarHBondContact O-ND2 3.43Å; T862-N990 PolarHBondContact OG1-ND2 3.27Å
863	I	91.3	Very high	91.5	Very high	47 Å²	47	55.7 Å²	55.7	24%	0.241	29%	0.285	C	S	.	.	H	α-helix	trans	-70.6	-43	177.6	-68.5	-62.2	0	0	0	111.1	F820 Y859 L860 I861 N866 K867	F820-I863 HydrophobicContact CZ-CB 4.35Å; F820-I863 HydrophobicContact CZ-CG1 4.38Å; F820-I863 HydrophobicContact CZ-CG2 4.31Å; Y859-I863 HydrophobicContact CD1-CG1 4.13Å; Y859-I863 HydrophobicContact CE1-CD1 4.35Å; Y859-I863 HydrophobicContact CE1-CG1 3.69Å; Y859-I863 HydrophobicContact CE2-CD1 4.23Å; Y859-I863 HydrophobicContact CE2-CG1 4.11Å; Y859-I863 WeakPolarHBondContact O-CG1 3.16Å; Y859-I863 PolarHBondContact O-N 2.66Å; L860-I863 PolarHBondContact O-N 3.06Å; I861-I863 VanDerWaalsContact C-N 3.33Å; I861-I863 PolarHBondContact O-N 2.96Å; I863-N866 CarbonylContact O-C 3.44Å; I863-N866 PolarHBondContact O-N 3.35Å; I863-K867 HydrophobicContact CG2-CG 4.33Å; I863-K867 VanDerWaalsContact O-CB 3.28Å; I863-K867 WeakPolarHBondContact O-CB 3.47Å; I863-K867 WeakPolarHBondContact O-CG 3.39Å; I863-K867 PolarHBondContact O-N 3.3Å
864	V	92.1	Very high	91.9	Very high	8 Å²	8	50.3 Å²	50.3	5%	0.048	26%	0.256	C	S	.	.	H	α-helix	trans	-62.3	-46.8	-179.9	165.7	0	0	0	0	111.2	L813 V816 L860 I861 N866 K867 Y868 V871	L813-V864 HydrophobicContact CD1-CG2 4.03Å; V816-V864 HydrophobicContact CG1-CG2 4.38Å; L860-V864 HydrophobicContact CD1-CG2 3.94Å; L860-V864 HydrophobicContact CG-CG2 4.3Å; L860-V864 VanDerWaalsContact O-CB 3.26Å; L860-V864 WeakPolarHBondContact O-CB 3.3Å; L860-V864 WeakPolarHBondContact O-CG2 3.44Å; L860-V864 PolarHBondContact O-N 3.07Å; I861-V864 PolarHBondContact O-N 2.91Å; I861-V864 VanDerWaalsContact O-N 3.17Å; V864-N866 PolarHBondContact O-N 3.26Å; V864-K867 PolarHBondContact O-N 3.41Å; V864-Y868 CarbonylContact O-C 3.56Å; V864-Y868 WeakPolarHBondContact O-CA 3.33Å; V864-Y868 PolarHBondContact O-N 3.13Å; V864-V871 HydrophobicContact CG1-CB 3.44Å; V864-V871 VanDerWaalsContact CG1-CB 3.44Å; V864-V871 HydrophobicContact CG1-CG1 3.58Å; V864-V871 HydrophobicContact CG1-CG2 4.08Å
865	E	89.9	Confident	91.9	Very high	52 Å²	52	50.9 Å²	50.9	24%	0.243	26%	0.26	C	S	.	.	H	α-helix	trans	-56.5	-34.2	175.1	-70	-173.8	151.3	0	0	113	I861 L872 K987	I861-E865 HydrophobicContact CG2-CG 4.19Å; I861-E865 VanDerWaalsContact O-CG 3.3Å; I861-E865 WeakPolarHBondContact O-CG 3.49Å; I861-E865 PolarHBondContact O-N 3.43Å; E865-L872 HydrophobicContact CG-CD2 3.84Å; E865-K987 VanDerWaalsContact OE1-CE 3.23Å; E865-K987 WeakPolarHBondContact OE1-CE 3.32Å
866	N	89.9	Confident	91.8	Very high	116 Å²	116	56 Å²	56	62%	0.62	28%	0.283	S	S	*	.	H	α-helix	trans	-95.8	-8.3	-176	-75	-84.2	0	0	0	114.6	T862 I863 V864	T862-N866 PolarHBondContact O-N 2.94Å; T862-N866 PolarHBondContact O-ND2 3.43Å; I863-N866 CarbonylContact O-C 3.44Å; I863-N866 PolarHBondContact O-N 3.35Å; V864-N866 PolarHBondContact O-N 3.26Å
867	K	92.8	Very high	91.9	Very high	150 Å²	150	57.2 Å²	57.2	65%	0.652	29%	0.288	S	S	*	.	H	α-helix	trans	-134.6	-28	-173.6	-64.7	-63.8	178.6	-170.6	0	115.1	I863 V864	I863-K867 HydrophobicContact CG2-CG 4.33Å; I863-K867 VanDerWaalsContact O-CB 3.28Å; I863-K867 WeakPolarHBondContact O-CB 3.47Å; I863-K867 WeakPolarHBondContact O-CG 3.39Å; I863-K867 PolarHBondContact O-N 3.3Å; V864-K867 PolarHBondContact O-N 3.41Å
868	Y	93.6	Very high	92	Very high	83 Å²	83	57.2 Å²	57.2	33%	0.325	29%	0.288	S	S	.	.			trans	-134	62.5	-178.3	-57.7	-86.2	0	0	0	110.7	Q812 V816 V864 S870 V871	Q812-Y868 VanDerWaalsContact CD-CD1 3.47Å; Q812-Y868 HydrophobicContact CG-CD1 3.72Å; Q812-Y868 HydrophobicContact CG-CE1 4.45Å; Q812-Y868 HydrophobicContact CG-CG 4.2Å; V816-Y868 HydrophobicContact CG2-CD2 3.82Å; V816-Y868 HydrophobicContact CG2-CE1 4.4Å; V816-Y868 HydrophobicContact CG2-CE2 3.59Å; V816-Y868 HydrophobicContact CG2-CG 4.34Å; V864-Y868 CarbonylContact O-C 3.56Å; V864-Y868 WeakPolarHBondContact O-CA 3.33Å; V864-Y868 PolarHBondContact O-N 3.13Å; Y868-S870 PolarHBondContact O-N 2.94Å; Y868-V871 WeakPolarHBondContact O-CB 3.35Å; Y868-V871 WeakPolarHBondContact O-CG2 3.23Å; Y868-V871 PolarHBondContact O-N 2.75Å
869	P	90.4	Very high	92	Very high	75 Å²	75	62.9 Å²	62.9	49%	0.487	31%	0.314	S	S	.	.	G	3₁₀ helix	trans	-62.4	-21	-169.7	-23.3	35.6	0	0	0	114.6	V871 L872	P869-V871 PolarHBondContact O-N 3.39Å; P869-L872 HydrophobicContact CB-CD1 4.44Å; P869-L872 VanDerWaalsContact O-CB 3.23Å; P869-L872 WeakPolarHBondContact O-CB 3.37Å; P869-L872 WeakPolarHBondContact O-CG 3.27Å; P869-L872 PolarHBondContact O-N 2.65Å
870	S	88.2	Confident	92.1	Very high	65 Å²	65	59.5 Å²	59.5	46%	0.455	30%	0.304	S	S	.	.	G	3₁₀ helix	trans	-58.4	-23.7	172.7	47.3	0	0	0	0	113.7	Y868 L872	Y868-S870 PolarHBondContact O-N 2.94Å; S870-L872 VanDerWaalsContact C-N 3.25Å; S870-L872 PolarHBondContact O-N 2.74Å
871	V	92.7	Very high	92.3	Very high	8 Å²	8	59.4 Å²	59.4	5%	0.048	30%	0.304	C	S	.	.	G	3₁₀ helix	trans	-76.8	-12	177.7	-175.7	0	0	0	0	112.2	A809 Q812 L813 V864 Y868 P869 N873 L874	A809-V871 HydrophobicContact CB-CB 4.49Å; A809-V871 HydrophobicContact CB-CG1 4.43Å; Q812-V871 HydrophobicContact CB-CG2 3.79Å; Q812-V871 HydrophobicContact CG-CG2 3.71Å; L813-V871 HydrophobicContact CB-CG1 3.88Å; L813-V871 HydrophobicContact CD1-CG1 4.07Å; L813-V871 HydrophobicContact CG-CG1 4.4Å; V864-V871 HydrophobicContact CG1-CB 3.44Å; V864-V871 VanDerWaalsContact CG1-CB 3.44Å; V864-V871 HydrophobicContact CG1-CG1 3.58Å; V864-V871 HydrophobicContact CG1-CG2 4.08Å; Y868-V871 WeakPolarHBondContact O-CB 3.35Å; Y868-V871 WeakPolarHBondContact O-CG2 3.23Å; Y868-V871 PolarHBondContact O-N 2.75Å; P869-V871 PolarHBondContact O-N 3.39Å; V871-N873 PolarHBondContact O-N 3.43Å; V871-L874 VanDerWaalsContact O-CB 3.28Å; V871-L874 WeakPolarHBondContact O-CB 3.45Å; V871-L874 PolarHBondContact O-N 2.74Å; V871-L874 VanDerWaalsContact O-N 3.12Å
872	L	86	Confident	92.4	Very high	65 Å²	65	60.5 Å²	60.5	34%	0.34	31%	0.312	S	S	.	.	G	3₁₀ helix	trans	-58.7	-32.6	172.8	-78.8	168.5	0	0	0	112.4	E865 P869 S870 L874	E865-L872 HydrophobicContact CG-CD2 3.84Å; P869-L872 HydrophobicContact CB-CD1 4.44Å; P869-L872 VanDerWaalsContact O-CB 3.23Å; P869-L872 WeakPolarHBondContact O-CB 3.37Å; P869-L872 WeakPolarHBondContact O-CG 3.27Å; P869-L872 PolarHBondContact O-N 2.65Å; S870-L872 VanDerWaalsContact C-N 3.25Å; S870-L872 PolarHBondContact O-N 2.74Å; L872-L874 PolarHBondContact O-N 3.03Å
873	N	90.3	Very high	92.7	Very high	72 Å²	72	63 Å²	63	39%	0.385	32%	0.32	S	S	.	.	G	3₁₀ helix	trans	-75.1	5.5	179.3	-60.6	65.9	0	0	0	113.5	V871 N875 E876 E877	V871-N873 PolarHBondContact O-N 3.43Å; N873-N875 PolarHBondContact O-N 2.91Å; N873-E876 WeakPolarHBondContact CA-OE2 3.2Å; N873-E876 WeakPolarHBondContact CB-OE2 3.48Å; N873-E876 PolarHBondContact ND2-OE2 3.18Å; N873-E876 WeakPolarHBondContact O-CA 3.46Å; N873-E876 WeakPolarHBondContact O-CB 3.23Å; N873-E876 PolarHBondContact O-N 3.01Å; N873-E877 PolarHBondContact O-N 3.28Å
874	L	93.1	Very high	93	Very high	4 Å²	4	60.8 Å²	60.8	2%	0.021	31%	0.309	C	S	.	.	G	3₁₀ helix	trans	-52.6	-40.9	-178.7	-175.9	71.8	0	0	0	113.1	A809 L810 L813 V871 L872 E876 L878 F979 L980	A809-L874 HydrophobicContact CB-CB 3.94Å; A809-L874 HydrophobicContact CB-CD1 3.86Å; L810-L874 HydrophobicContact CB-CD1 3.8Å; L810-L874 HydrophobicContact CD1-CD1 4.34Å; L813-L874 HydrophobicContact CD2-CD2 3.87Å; V871-L874 VanDerWaalsContact O-CB 3.28Å; V871-L874 WeakPolarHBondContact O-CB 3.45Å; V871-L874 PolarHBondContact O-N 2.74Å; V871-L874 VanDerWaalsContact O-N 3.12Å; L872-L874 PolarHBondContact O-N 3.03Å; L874-E876 VanDerWaalsContact C-N 3.25Å; L874-E876 PolarHBondContact O-N 3Å; L874-L878 HydrophobicContact CD1-CD1 3.59Å; L874-L878 HydrophobicContact CD1-CG 4.41Å; L874-L878 HydrophobicContact CG-CD1 4.03Å; L874-L878 VanDerWaalsContact O-CB 3.27Å; L874-L878 WeakPolarHBondContact O-CB 3.49Å; L874-L878 WeakPolarHBondContact O-CG 3.27Å; L874-L878 PolarHBondContact O-N 2.96Å; L874-F979 HydrophobicContact CD2-CE1 4.33Å; L874-L980 HydrophobicContact CD2-CD2 3.99Å; L874-L980 HydrophobicContact CG-CD2 3.94Å
875	N	91.1	Very high	93.3	Very high	67 Å²	67	61.1 Å²	61.1	36%	0.358	31%	0.312	S	S	.	.	G	3₁₀ helix	trans	-73.8	-17.4	179.9	-64.5	12	0	0	0	112.9	N873 L980	N873-N875 PolarHBondContact O-N 2.91Å; N875-L980 WeakPolarHBondContact OD1-CD2 3.45Å
876	E	91.4	Very high	93.6	Very high	123 Å²	123	65.2 Å²	65.2	58%	0.575	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.5	-32.3	-180	-63.4	141.4	-152.5	0	0	111.1	N873 L874 L878	N873-E876 WeakPolarHBondContact CA-OE2 3.2Å; N873-E876 WeakPolarHBondContact CB-OE2 3.48Å; N873-E876 PolarHBondContact ND2-OE2 3.18Å; N873-E876 WeakPolarHBondContact O-CA 3.46Å; N873-E876 WeakPolarHBondContact O-CB 3.23Å; N873-E876 PolarHBondContact O-N 3.01Å; L874-E876 VanDerWaalsContact C-N 3.25Å; L874-E876 PolarHBondContact O-N 3Å; E876-L878 VanDerWaalsContact C-N 3.28Å
877	E	94.5	Very high	94	Very high	58 Å²	58	60.2 Å²	60.2	27%	0.271	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.3	-9.2	171.4	-69.2	-170.4	161.4	0	0	113.5	E803 S807 S808 A809 N873	E803-E877 WeakPolarHBondContact CB-O 3.47Å; S807-E877 VanDerWaalsContact C-OE2 3.3Å; S807-E877 WeakPolarHBondContact CA-OE2 3.46Å; S807-E877 VanDerWaalsContact CB-OE2 3.27Å; S807-E877 WeakPolarHBondContact CB-OE2 3.4Å; S807-E877 PolarHBondContact OG-OE2 3.2Å; S808-E877 PolarHBondContact N-OE1 3.47Å; S808-E877 PolarHBondContact N-OE2 2.9Å; S808-E877 PolarHBondContact OG-OE1 3.01Å; A809-E877 VanDerWaalsContact CB-OE2 3.24Å; A809-E877 WeakPolarHBondContact CB-OE2 3.46Å; A809-E877 PolarHBondContact N-OE2 3.22Å; N873-E877 PolarHBondContact O-N 3.28Å
878	L	96.2	Very high	94.1	Very high	4 Å²	4	55.9 Å²	55.9	2%	0.021	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-134.7	41	-174.7	-60.7	-179.3	0	0	0	111.9	E803 V804 L810 L874 E876 I881 L980	E803-L878 HydrophobicContact CB-CD2 4.04Å; E803-L878 VanDerWaalsContact OE2-C 3.23Å; E803-L878 WeakPolarHBondContact OE2-CA 3.35Å; V804-L878 HydrophobicContact CB-CD2 4.5Å; V804-L878 HydrophobicContact CG1-CD2 4Å; L810-L878 HydrophobicContact CB-CD1 4.45Å; L810-L878 HydrophobicContact CD2-CD1 4.29Å; L810-L878 HydrophobicContact CD2-CD2 4.46Å; L874-L878 HydrophobicContact CD1-CD1 3.59Å; L874-L878 HydrophobicContact CD1-CG 4.41Å; L874-L878 HydrophobicContact CG-CD1 4.03Å; L874-L878 VanDerWaalsContact O-CB 3.27Å; L874-L878 WeakPolarHBondContact O-CB 3.49Å; L874-L878 WeakPolarHBondContact O-CG 3.27Å; L874-L878 PolarHBondContact O-N 2.96Å; E876-L878 VanDerWaalsContact C-N 3.28Å; L878-I881 HydrophobicContact CB-CG1 3.75Å; L878-I881 HydrophobicContact CD2-CG1 4.22Å; L878-I881 HydrophobicContact CG-CG1 4.5Å; L878-I881 WeakPolarHBondContact O-CG1 3.38Å; L878-L980 HydrophobicContact CB-CD1 4.1Å; L878-L980 HydrophobicContact CD1-CD1 4.47Å; L878-L980 HydrophobicContact CD1-CD2 4.24Å
879	Q	95.5	Very high	94.1	Very high	132 Å²	132	52.6 Å²	52.6	62%	0.617	27%	0.274	S	S	*	.	S	Bend	trans	-75.5	-28.3	-170.2	54.7	166.3	11.3	0	0	114	E803 P882	E803-Q879 WeakPolarHBondContact OE1-CG 3.29Å; E803-Q879 PolarHBondContact OE1-N 3.41Å; E803-Q879 PolarHBondContact OE2-N 2.84Å; Q879-P882 WeakPolarHBondContact O-CD 3.44Å
880	D	95.5	Very high	94.2	Very high	50 Å²	50	53.6 Å²	53.6	27%	0.267	28%	0.279	S	S	.	.	S	Bend	trans	-90	-13.3	-177.5	-77.3	-36.7	0	0	0	113.1	S799 E803 P882 Q883 A884	S799-D880 VanDerWaalsContact CB-OD2 3.23Å; S799-D880 WeakPolarHBondContact CB-OD2 3.28Å; S799-D880 PolarHBondContact OG-OD2 3.38Å; E803-D880 PolarHBondContact OE1-N 3.48Å; E803-D880 PolarHBondContact OE2-N 3.02Å; D880-P882 VanDerWaalsContact C-CD 3.46Å; D880-P882 VanDerWaalsContact C-N 3.35Å; D880-Q883 WeakPolarHBondContact O-CA 3.29Å; D880-Q883 PolarHBondContact O-N 3.08Å; D880-A884 PolarHBondContact O-N 3.45Å
881	I	97.8	Very high	94.5	Very high	0 Å²	0	56 Å²	56	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-48.9	-44.3	177.6	-54.3	-52	0	0	0	113.7	G800 E803 V804 L878 Q883 A884 A885 F973 F976 D977 L980	G800-I881 WeakPolarHBondContact O-CD1 3.47Å; E803-I881 HydrophobicContact CB-CD1 4.29Å; V804-I881 HydrophobicContact CG1-CD1 3.57Å; V804-I881 HydrophobicContact CG1-CG1 4.37Å; L878-I881 HydrophobicContact CB-CG1 3.75Å; L878-I881 HydrophobicContact CD2-CG1 4.22Å; L878-I881 HydrophobicContact CG-CG1 4.5Å; L878-I881 WeakPolarHBondContact O-CG1 3.38Å; I881-Q883 PolarHBondContact O-N 3Å; I881-A884 PolarHBondContact O-N 2.87Å; I881-A885 WeakPolarHBondContact O-CB 3.36Å; I881-A885 PolarHBondContact O-N 3.12Å; I881-F973 HydrophobicContact CD1-CD1 3.85Å; I881-F973 HydrophobicContact CD1-CE1 4.09Å; I881-F973 HydrophobicContact CG2-CB 4.16Å; I881-F973 HydrophobicContact CG2-CD1 4.45Å; I881-F976 HydrophobicContact CG2-CB 3.74Å; I881-D977 HydrophobicContact CG2-CB 4.38Å; I881-L980 HydrophobicContact CB-CD1 4.27Å; I881-L980 HydrophobicContact CG2-CD1 4.34Å
882	P	97.1	Very high	94.6	Very high	39 Å²	39	55.7 Å²	55.7	25%	0.253	28%	0.281	S	S	.	.	H	α-helix	trans	-67.7	-14.7	178.7	-20.6	35.3	0	0	0	113.9	Q879 D880 K886 D977	Q879-P882 WeakPolarHBondContact O-CD 3.44Å; D880-P882 VanDerWaalsContact C-CD 3.46Å; D880-P882 VanDerWaalsContact C-N 3.35Å; P882-K886 WeakPolarHBondContact O-CE 3.47Å; P882-K886 PolarHBondContact O-NZ 2.95Å; P882-D977 WeakPolarHBondContact CB-OD1 3.42Å
883	Q	97.1	Very high	95	Very high	106 Å²	106	55.5 Å²	55.5	50%	0.495	28%	0.281	S	S	.	.	H	α-helix	trans	-92.8	-40.8	170.2	-49.9	-56.9	-7.2	0	0	111	A796 D880 I881 A885 K886	A796-Q883 HydrophobicContact CB-CB 4.22Å; D880-Q883 WeakPolarHBondContact O-CA 3.29Å; D880-Q883 PolarHBondContact O-N 3.08Å; I881-Q883 PolarHBondContact O-N 3Å; Q883-A885 VanDerWaalsContact C-N 3.25Å; Q883-A885 PolarHBondContact O-N 2.96Å; Q883-K886 WeakPolarHBondContact O-CB 3.17Å; Q883-K886 PolarHBondContact O-N 2.91Å
884	A	97.6	Very high	95.2	Very high	0 Å²	0	59 Å²	59	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-57.5	-38.5	175.5	0	0	0	0	0	112.1	A796 D880 I881 K886 V887 F973	A796-A884 HydrophobicContact CB-CB 4.47Å; A796-A884 VanDerWaalsContact O-CB 3.3Å; A796-A884 WeakPolarHBondContact O-CB 3.27Å; D880-A884 PolarHBondContact O-N 3.45Å; I881-A884 PolarHBondContact O-N 2.87Å; A884-K886 PolarHBondContact O-N 3Å; A884-K886 VanDerWaalsContact O-N 3.1Å; A884-V887 PolarHBondContact O-N 2.72Å; A884-V887 VanDerWaalsContact O-N 3.13Å; A884-F973 HydrophobicContact CB-CB 4.1Å; A884-F973 HydrophobicContact CB-CD1 4.32Å; A884-F973 HydrophobicContact CB-CD2 3.44Å; A884-F973 VanDerWaalsContact CB-CD2 3.44Å; A884-F973 HydrophobicContact CB-CE2 3.87Å; A884-F973 HydrophobicContact CB-CG 3.7Å; A884-F973 HydrophobicContact CB-CZ 4.47Å
885	A	97.7	Very high	95.3	Very high	15 Å²	15	60.4 Å²	60.4	12%	0.124	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63	-9.7	174.6	0	0	0	0	0	115	I881 Q883 D970 F973 D977	I881-A885 WeakPolarHBondContact O-CB 3.36Å; I881-A885 PolarHBondContact O-N 3.12Å; Q883-A885 VanDerWaalsContact C-N 3.25Å; Q883-A885 PolarHBondContact O-N 2.96Å; A885-D970 WeakPolarHBondContact O-CA 3.5Å; A885-F973 HydrophobicContact CB-CB 3.91Å; A885-D977 HydrophobicContact CB-CB 3.98Å
886	K	97.3	Very high	95.5	Very high	138 Å²	138	57.2 Å²	57.2	60%	0.6	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.3	-6.6	176.9	-57.7	178.5	-178.3	106.4	0	113.2	P882 Q883 A884 N888	P882-K886 WeakPolarHBondContact O-CE 3.47Å; P882-K886 PolarHBondContact O-NZ 2.95Å; Q883-K886 WeakPolarHBondContact O-CB 3.17Å; Q883-K886 PolarHBondContact O-N 2.91Å; A884-K886 PolarHBondContact O-N 3Å; A884-K886 VanDerWaalsContact O-N 3.1Å; K886-N888 PolarHBondContact O-N 3.34Å
887	V	97.7	Very high	95.6	Very high	11 Å²	11	54.2 Å²	54.2	7%	0.067	27%	0.274	C	S	.	.			trans	-91.6	104	-171.4	-171.5	0	0	0	0	111.3	K793 A796 I797 A884 M889 L892	K793-V887 HydrophobicContact CB-CG1 3.79Å; K793-V887 HydrophobicContact CB-CG2 4.34Å; K793-V887 HydrophobicContact CG-CG1 4.33Å; A796-V887 HydrophobicContact CB-CG2 4.24Å; I797-V887 HydrophobicContact CD1-CB 4.1Å; I797-V887 HydrophobicContact CD1-CG1 3.56Å; I797-V887 HydrophobicContact CG1-CB 4.11Å; I797-V887 HydrophobicContact CG1-CG1 4.09Å; I797-V887 HydrophobicContact CG1-CG2 4.46Å; A884-V887 PolarHBondContact O-N 2.72Å; A884-V887 VanDerWaalsContact O-N 3.13Å; V887-M889 PolarHBondContact O-N 2.67Å; V887-L892 HydrophobicContact CG1-CD2 4.03Å
888	N	94.6	Very high	95.6	Very high	58 Å²	58	54.1 Å²	54.1	31%	0.31	28%	0.278	S	S	.	.			trans	-76.5	115.4	171.3	-170.6	-90.9	0	0	0	111.3	K886 T890 E891 L892 D970	K886-N888 PolarHBondContact O-N 3.34Å; N888-T890 VanDerWaalsContact C-N 3.31Å; N888-T890 PolarHBondContact O-N 3.21Å; N888-T890 WeakPolarHBondContact OD1-CB 3.34Å; N888-T890 PolarHBondContact OD1-N 2.8Å; N888-T890 VanDerWaalsContact OD1-N 3.14Å; N888-E891 HydrophobicContact CB-CB 4.29Å; N888-E891 PolarHBondContact O-N 2.96Å; N888-E891 PolarHBondContact OD1-N 3.24Å; N888-E891 VanDerWaalsContact OD1-N 3.11Å; N888-L892 PolarHBondContact O-N 3.33Å; N888-L892 VanDerWaalsContact O-N 3.08Å; N888-D970 PolarHBondContact ND2-OD2 3.36Å
889	M	94.2	Very high	95.5	Very high	14 Å²	14	54 Å²	54	7%	0.069	28%	0.277	C	S	.	.	H	α-helix	trans	-62.8	-34.3	-177.8	-175.6	61.7	77.8	0	0	113.4	I797 V887 L892 D893 K950 P969	I797-M889 HydrophobicContact CD1-CE 3.8Å; V887-M889 PolarHBondContact O-N 2.67Å; M889-L892 PolarHBondContact O-N 3.48Å; M889-L892 HydrophobicContact SD-CD2 4.4Å; M889-D893 WeakPolarHBondContact O-CB 3.41Å; M889-D893 PolarHBondContact O-N 3.46Å; M889-K950 HydrophobicContact CE-CG 3.91Å; M889-K950 HydrophobicContact SD-CD 4.43Å; M889-K950 WeakPolarHBondContact SD-CE 3.32Å; M889-K950 HydrophobicContact SD-CG 4.37Å; M889-P969 HydrophobicContact CB-CG 4.17Å; M889-P969 HydrophobicContact CE-CG 3.83Å
890	T	93.1	Very high	95.6	Very high	96 Å²	96	53.3 Å²	53.3	59%	0.589	27%	0.269	S	S	*	.	H	α-helix	trans	-70.2	-36.3	-178.3	-54.8	0	0	0	0	111.7	N888 K894	N888-T890 VanDerWaalsContact C-N 3.31Å; N888-T890 PolarHBondContact O-N 3.21Å; N888-T890 WeakPolarHBondContact OD1-CB 3.34Å; N888-T890 PolarHBondContact OD1-N 2.8Å; N888-T890 VanDerWaalsContact OD1-N 3.14Å; T890-K894 WeakPolarHBondContact O-CB 3.46Å; T890-K894 PolarHBondContact O-N 3.37Å
891	E	94.1	Very high	95.5	Very high	116 Å²	116	54.2 Å²	54.2	54%	0.542	28%	0.28	S	S	.	.	H	α-helix	trans	-70.8	-44.3	173.3	-168.9	164.3	-137.5	0	0	111.3	N888 D893 K894 E895	N888-E891 HydrophobicContact CB-CB 4.29Å; N888-E891 PolarHBondContact O-N 2.96Å; N888-E891 PolarHBondContact OD1-N 3.24Å; N888-E891 VanDerWaalsContact OD1-N 3.11Å; E891-D893 PolarHBondContact O-N 3.43Å; E891-K894 WeakPolarHBondContact O-CA 3.37Å; E891-K894 WeakPolarHBondContact O-CB 3.25Å; E891-K894 PolarHBondContact O-N 3.09Å; E891-E895 PolarHBondContact O-N 3.5Å
892	L	95.5	Very high	95.4	Very high	1 Å²	1	55 Å²	55	1%	0.005	29%	0.288	C	S	.	.	H	α-helix	trans	-58.1	-46.2	175.6	-177	59.7	0	0	0	112.7	V790 K793 V794 I797 V887 N888 M889 K894 E895 I896 L946	V790-L892 HydrophobicContact CB-CD1 4.49Å; V790-L892 HydrophobicContact CG1-CD1 4.01Å; V790-L892 HydrophobicContact CG2-CD1 4.38Å; K793-L892 HydrophobicContact CB-CD1 3.79Å; K793-L892 HydrophobicContact CB-CD2 4.29Å; K793-L892 HydrophobicContact CD-CD1 4.06Å; V794-L892 HydrophobicContact CG2-CD1 4.24Å; V794-L892 HydrophobicContact CG2-CD2 4.19Å; I797-L892 HydrophobicContact CD1-CD2 3.81Å; V887-L892 HydrophobicContact CG1-CD2 4.03Å; N888-L892 PolarHBondContact O-N 3.33Å; N888-L892 VanDerWaalsContact O-N 3.08Å; M889-L892 PolarHBondContact O-N 3.48Å; M889-L892 HydrophobicContact SD-CD2 4.4Å; L892-K894 VanDerWaalsContact C-N 3.26Å; L892-K894 PolarHBondContact O-N 3.12Å; L892-E895 PolarHBondContact O-N 3.42Å; L892-I896 WeakPolarHBondContact O-CB 3.05Å; L892-I896 VanDerWaalsContact O-CG1 3.23Å; L892-I896 WeakPolarHBondContact O-CG1 3.39Å; L892-I896 PolarHBondContact O-N 3.26Å; L892-L946 HydrophobicContact CD2-CD1 4Å; L892-L946 HydrophobicContact CG-CD1 4.35Å
893	D	93.7	Very high	95.3	Very high	62 Å²	62	53.5 Å²	53.5	33%	0.332	28%	0.277	S	S	.	.	H	α-helix	trans	-64	-30.3	175.9	-93.2	-36.9	0	0	0	112.9	M889 E891 S897 K950	M889-D893 WeakPolarHBondContact O-CB 3.41Å; M889-D893 PolarHBondContact O-N 3.46Å; E891-D893 PolarHBondContact O-N 3.43Å; D893-S897 WeakPolarHBondContact O-CB 3.48Å; D893-S897 PolarHBondContact O-N 3.18Å; D893-K950 IonicContact OD1-NZ 2.72Å; D893-K950 PolarHBondContact OD1-NZ 2.85Å; D893-K950 IonicContact OD2-NZ 3.65Å; D893-K950 PolarHBondContact OD2-NZ 2.83Å
894	K	94.8	Very high	95.2	Very high	145 Å²	145	55 Å²	55	63%	0.63	28%	0.282	S	S	*	.	H	α-helix	trans	-73	-38.7	175.6	-178.3	-172.5	173.3	-165.5	0	111.5	T890 E891 L892 T898	T890-K894 WeakPolarHBondContact O-CB 3.46Å; T890-K894 PolarHBondContact O-N 3.37Å; E891-K894 WeakPolarHBondContact O-CA 3.37Å; E891-K894 WeakPolarHBondContact O-CB 3.25Å; E891-K894 PolarHBondContact O-N 3.09Å; L892-K894 VanDerWaalsContact C-N 3.26Å; L892-K894 PolarHBondContact O-N 3.12Å; K894-T898 WeakPolarHBondContact O-CB 3.47Å; K894-T898 PolarHBondContact O-N 3.4Å; K894-T898 PolarHBondContact O-OG1 2.64Å
895	E	94.3	Very high	95.1	Very high	34 Å²	34	57.3 Å²	57.3	16%	0.159	30%	0.302	C	S	.	.	H	α-helix	trans	-62.8	-49.5	171.8	-71.4	165.2	-138.6	0	0	111.3	V790 K793 E891 L892 S897 T898 L899	V790-E895 HydrophobicContact CG2-CB 3.74Å; V790-E895 VanDerWaalsContact CG2-OE2 3.27Å; V790-E895 WeakPolarHBondContact CG2-OE2 3.46Å; K793-E895 IonicContact NZ-OE1 2.79Å; K793-E895 PolarHBondContact NZ-OE1 3.1Å; K793-E895 IonicContact NZ-OE2 3.76Å; K793-E895 PolarHBondContact NZ-OE2 2.98Å; E891-E895 PolarHBondContact O-N 3.5Å; L892-E895 PolarHBondContact O-N 3.42Å; E895-S897 PolarHBondContact O-N 2.85Å; E895-T898 WeakPolarHBondContact O-CB 3.41Å; E895-T898 PolarHBondContact O-N 2.72Å; E895-T898 VanDerWaalsContact O-N 3.12Å; E895-L899 PolarHBondContact O-N 2.87Å
896	I	95.3	Very high	95	Very high	0 Å²	0	56.8 Å²	56.8	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-57.2	-47.1	174.9	-69.4	-78.2	0	0	0	111.2	V790 L892 T898 L899 R900 F939 V942 L946	V790-I896 HydrophobicContact CG1-CD1 3.55Å; V790-I896 HydrophobicContact CG1-CG1 4.2Å; L892-I896 WeakPolarHBondContact O-CB 3.05Å; L892-I896 VanDerWaalsContact O-CG1 3.23Å; L892-I896 WeakPolarHBondContact O-CG1 3.39Å; L892-I896 PolarHBondContact O-N 3.26Å; I896-T898 VanDerWaalsContact C-N 3.28Å; I896-T898 PolarHBondContact O-N 2.97Å; I896-L899 PolarHBondContact O-N 2.92Å; I896-R900 WeakPolarHBondContact O-CB 3.32Å; I896-R900 PolarHBondContact O-N 2.94Å; I896-F939 HydrophobicContact CD1-CE2 4.47Å; I896-F939 HydrophobicContact CG2-CZ 4.4Å; I896-V942 HydrophobicContact CD1-CG1 3.47Å; I896-V942 VanDerWaalsContact CD1-CG1 3.47Å; I896-L946 HydrophobicContact CB-CD2 4.32Å; I896-L946 HydrophobicContact CD1-CD2 3.93Å; I896-L946 HydrophobicContact CG1-CD2 3.8Å; I896-L946 HydrophobicContact CG2-CD2 3.88Å
897	S	94.7	Very high	94.9	Very high	59 Å²	59	53.8 Å²	53.8	41%	0.413	29%	0.285	S	S	.	.	H	α-helix	trans	-63	-34.9	177	-172.4	0	0	0	0	112.4	D893 E895 S901	D893-S897 WeakPolarHBondContact O-CB 3.48Å; D893-S897 PolarHBondContact O-N 3.18Å; E895-S897 PolarHBondContact O-N 2.85Å; S897-S901 VanDerWaalsContact O-CB 3.3Å; S897-S901 WeakPolarHBondContact O-CB 3.39Å; S897-S901 PolarHBondContact O-N 3.38Å; S897-S901 PolarHBondContact O-OG 2.86Å
898	T	93.5	Very high	94.8	Very high	57 Å²	57	57.6 Å²	57.6	35%	0.35	31%	0.308	S	S	.	.	H	α-helix	trans	-70.3	-35.8	175.7	-57.7	0	0	0	0	111.9	K894 E895 I896 G902	K894-T898 WeakPolarHBondContact O-CB 3.47Å; K894-T898 PolarHBondContact O-N 3.4Å; K894-T898 PolarHBondContact O-OG1 2.64Å; E895-T898 WeakPolarHBondContact O-CB 3.41Å; E895-T898 PolarHBondContact O-N 2.72Å; E895-T898 VanDerWaalsContact O-N 3.12Å; I896-T898 VanDerWaalsContact C-N 3.28Å; I896-T898 PolarHBondContact O-N 2.97Å; T898-G902 PolarHBondContact O-N 3.22Å; T898-G902 VanDerWaalsContact O-N 3.12Å
899	L	95.2	Very high	94.9	Very high	1 Å²	1	55.3 Å²	55.3	1%	0.005	30%	0.295	C	S	.	.	H	α-helix	trans	-66.6	-51.9	170.7	-78	168.3	0	0	0	111.4	F779 F783 R786 V787 V790 E895 I896 S901 G902 L903 F939	F779-L899 HydrophobicContact CE2-CD2 4.37Å; F779-L899 HydrophobicContact CZ-CD2 4.27Å; F779-L899 WeakPolarHBondContact CZ-O 3.17Å; F783-L899 HydrophobicContact CD2-CD2 3.82Å; F783-L899 HydrophobicContact CE2-CD2 3.98Å; R786-L899 HydrophobicContact CB-CD1 4.3Å; R786-L899 HydrophobicContact CB-CD2 3.82Å; R786-L899 HydrophobicContact CB-CG 4.23Å; V787-L899 HydrophobicContact CG2-CD1 4.22Å; V787-L899 HydrophobicContact CG2-CD2 4.3Å; V790-L899 HydrophobicContact CG2-CD1 4.18Å; E895-L899 PolarHBondContact O-N 2.87Å; I896-L899 PolarHBondContact O-N 2.92Å; L899-S901 PolarHBondContact O-N 2.57Å; L899-G902 PolarHBondContact O-N 3.38Å; L899-L903 WeakPolarHBondContact O-CB 3.08Å; L899-L903 PolarHBondContact O-N 2.95Å; L899-F939 HydrophobicContact CB-CD2 3.9Å; L899-F939 HydrophobicContact CB-CE2 3.38Å; L899-F939 HydrophobicContact CB-CZ 3.94Å; L899-F939 HydrophobicContact CD1-CD2 4.22Å; L899-F939 HydrophobicContact CD1-CE2 3.97Å; L899-F939 HydrophobicContact CG-CE2 4.29Å
900	R	96.1	Very high	95	Very high	117 Å²	117	55 Å²	55	44%	0.442	29%	0.294	S	S	.	.	H	α-helix	trans	-58.2	-49.9	-179.4	-169	-173.2	-66.5	136.3	-2.2	112.5	I896 K904 F939 E943	I896-R900 WeakPolarHBondContact O-CB 3.32Å; I896-R900 PolarHBondContact O-N 2.94Å; R900-K904 WeakPolarHBondContact O-CB 3.49Å; R900-K904 PolarHBondContact O-N 3.19Å; R900-K904 VanDerWaalsContact O-N 3.13Å; R900-F939 HydrophobicContact CB-CE1 3.74Å; R900-F939 HydrophobicContact CB-CZ 3.75Å; R900-F939 HydrophobicContact CG-CE1 4.05Å; R900-F939 HydrophobicContact CG-CZ 4.48Å; R900-E943 IonicContact CZ-OE1 2.81Å; R900-E943 IonicContact NE-OE1 3.9Å; R900-E943 PolarHBondContact NE-OE1 2.98Å; R900-E943 IonicContact NH2-OE1 3.74Å; R900-E943 PolarHBondContact NH2-OE1 2.96Å
901	S	95.1	Very high	95.1	Very high	70 Å²	70	55.8 Å²	55.8	49%	0.49	29%	0.291	S	S	.	.	H	α-helix	trans	-69.8	-36.8	-179.8	58.2	0	0	0	0	112.6	S897 L899 A905	S897-S901 VanDerWaalsContact O-CB 3.3Å; S897-S901 WeakPolarHBondContact O-CB 3.39Å; S897-S901 PolarHBondContact O-N 3.38Å; S897-S901 PolarHBondContact O-OG 2.86Å; L899-S901 PolarHBondContact O-N 2.57Å; S901-A905 WeakPolarHBondContact O-CB 3.31Å; S901-A905 PolarHBondContact O-N 3.35Å
902	G	94.2	Very high	95.2	Very high	16 Å²	16	53.5 Å²	53.5	17%	0.165	28%	0.278	C	S	.	.	H	α-helix	trans	-64.9	-48.6	174.9	0	0	0	0	0	112.3	T898 L899 K904 A905 V906	T898-G902 PolarHBondContact O-N 3.22Å; T898-G902 VanDerWaalsContact O-N 3.12Å; L899-G902 PolarHBondContact O-N 3.38Å; G902-K904 PolarHBondContact O-N 3.46Å; G902-A905 WeakPolarHBondContact O-CB 3.19Å; G902-A905 PolarHBondContact O-N 3.12Å; G902-A905 VanDerWaalsContact O-N 3.14Å; G902-V906 WeakPolarHBondContact O-CG2 3.2Å; G902-V906 PolarHBondContact O-N 3.46Å; G902-V906 VanDerWaalsContact O-N 3.08Å
903	L	95.6	Very high	95.1	Very high	7 Å²	7	53.9 Å²	53.9	4%	0.037	28%	0.28	C	S	.	.	H	α-helix	trans	-59.7	-47.3	178.6	-176.3	59.7	0	0	0	111.1	F779 L899 A905 V906 E907 I932 A935 S936 F939	F779-L903 HydrophobicContact CE1-CB 4.01Å; F779-L903 HydrophobicContact CE1-CD1 4.21Å; F779-L903 HydrophobicContact CZ-CB 3.94Å; F779-L903 VanDerWaalsContact CZ-N 3.26Å; L899-L903 WeakPolarHBondContact O-CB 3.08Å; L899-L903 PolarHBondContact O-N 2.95Å; L903-A905 VanDerWaalsContact C-N 3.28Å; L903-A905 PolarHBondContact O-N 2.69Å; L903-V906 PolarHBondContact O-N 2.93Å; L903-E907 WeakPolarHBondContact O-CG 3.35Å; L903-E907 PolarHBondContact O-N 2.88Å; L903-I932 HydrophobicContact CD1-CG1 4.29Å; L903-A935 HydrophobicContact CD1-CB 3.85Å; L903-S936 WeakPolarHBondContact CD2-OG 3.48Å; L903-F939 HydrophobicContact CD2-CB 4.09Å; L903-F939 HydrophobicContact CD2-CD1 4.03Å; L903-F939 HydrophobicContact CD2-CG 4.32Å
904	K	95.1	Very high	95.1	Very high	138 Å²	138	55.7 Å²	55.7	60%	0.6	29%	0.285	S	S	*	.	H	α-helix	trans	-61.1	-32.7	176.3	-173.5	171	-177	172.9	0	113.5	R900 G902 T908	R900-K904 WeakPolarHBondContact O-CB 3.49Å; R900-K904 PolarHBondContact O-N 3.19Å; R900-K904 VanDerWaalsContact O-N 3.13Å; G902-K904 PolarHBondContact O-N 3.46Å; K904-T908 WeakPolarHBondContact O-CB 3.38Å; K904-T908 PolarHBondContact O-N 3.01Å; K904-T908 PolarHBondContact O-OG1 3.39Å
905	A	94.8	Very high	95	Very high	49 Å²	49	52.6 Å²	52.6	41%	0.405	28%	0.281	S	S	.	.	H	α-helix	trans	-67.6	-40.7	173.3	0	0	0	0	0	111.6	S901 G902 L903 T908 E909	S901-A905 WeakPolarHBondContact O-CB 3.31Å; S901-A905 PolarHBondContact O-N 3.35Å; G902-A905 WeakPolarHBondContact O-CB 3.19Å; G902-A905 PolarHBondContact O-N 3.12Å; G902-A905 VanDerWaalsContact O-N 3.14Å; L903-A905 VanDerWaalsContact C-N 3.28Å; L903-A905 PolarHBondContact O-N 2.69Å; A905-T908 PolarHBondContact O-N 3.02Å; A905-E909 WeakPolarHBondContact O-CB 3.36Å; A905-E909 PolarHBondContact O-N 3.44Å
906	V	96.6	Very high	94.9	Very high	3 Å²	3	54.3 Å²	54.3	2%	0.018	29%	0.289	C	S	.	.	H	α-helix	trans	-67.5	-37.3	174.8	-174.6	0	0	0	0	111.7	F779 G902 L903 E909 L910 V928 F931 I932	F779-V906 HydrophobicContact CB-CG2 4.13Å; F779-V906 HydrophobicContact CD1-CG2 3.79Å; F779-V906 HydrophobicContact CG-CG2 4.17Å; G902-V906 WeakPolarHBondContact O-CG2 3.2Å; G902-V906 PolarHBondContact O-N 3.46Å; G902-V906 VanDerWaalsContact O-N 3.08Å; L903-V906 PolarHBondContact O-N 2.93Å; V906-E909 PolarHBondContact O-N 3.18Å; V906-L910 VanDerWaalsContact O-CB 3.29Å; V906-L910 WeakPolarHBondContact O-CB 3.44Å; V906-L910 PolarHBondContact O-N 3.49Å; V906-V928 HydrophobicContact CG1-CG1 3.39Å; V906-F931 HydrophobicContact CG1-CD1 4.33Å; V906-F931 HydrophobicContact CG1-CE1 4.36Å; V906-I932 HydrophobicContact CB-CD1 4.5Å; V906-I932 HydrophobicContact CG1-CD1 3.97Å; V906-I932 HydrophobicContact CG1-CG1 4.32Å
907	E	95.4	Very high	94.7	Very high	76 Å²	76	58.6 Å²	58.6	36%	0.355	32%	0.317	S	S	.	.	H	α-helix	trans	-62.6	-44.1	172.9	-71	171.2	163.4	0	0	111.8	L903 L910 E911 I932 S936	L903-E907 WeakPolarHBondContact O-CG 3.35Å; L903-E907 PolarHBondContact O-N 2.88Å; E907-L910 PolarHBondContact O-N 3.03Å; E907-E911 PolarHBondContact O-N 2.65Å; E907-I932 HydrophobicContact CB-CD1 4.26Å; E907-I932 HydrophobicContact CG-CD1 3.72Å; E907-I932 HydrophobicContact CG-CG1 4.18Å; E907-I932 HydrophobicContact CG-CG2 4.32Å; E907-S936 PolarHBondContact OE1-OG 3.09Å; E907-S936 VanDerWaalsContact OE1-OG 3.12Å
908	T	95.9	Very high	94.4	Very high	91 Å²	91	62.2 Å²	62.2	56%	0.558	34%	0.339	S	S	*	.	H	α-helix	trans	-64	-43.4	178.1	-54.6	0	0	0	0	111.4	K904 A905 E911 Y912	K904-T908 WeakPolarHBondContact O-CB 3.38Å; K904-T908 PolarHBondContact O-N 3.01Å; K904-T908 PolarHBondContact O-OG1 3.39Å; A905-T908 PolarHBondContact O-N 3.02Å; T908-E911 PolarHBondContact O-N 3.31Å; T908-Y912 PolarHBondContact O-N 2.92Å
909	E	95.6	Very high	94.2	Very high	9 Å²	9	65.3 Å²	65.3	4%	0.042	35%	0.35	C	S	.	.	H	α-helix	trans	-70.2	-36	176.9	-178.4	59.4	-162.3	0	0	112.2	H769 Q772 A905 V906 Y912 Q913 F924	H769-E909 WeakPolarHBondContact CB-OE1 3.32Å; H769-E909 IonicContact CE1-OE2 3.78Å; H769-E909 IonicContact CG-OE1 2.99Å; H769-E909 IonicContact CG-OE2 2.79Å; H769-E909 IonicContact ND1-OE1 2.8Å; H769-E909 PolarHBondContact ND1-OE1 2.82Å; H769-E909 IonicContact ND1-OE2 3.1Å; H769-E909 PolarHBondContact ND1-OE2 3.07Å; Q772-E909 HydrophobicContact CB-CB 4.27Å; Q772-E909 HydrophobicContact CB-CG 3.73Å; Q772-E909 WeakPolarHBondContact CB-OE2 3.44Å; A905-E909 WeakPolarHBondContact O-CB 3.36Å; A905-E909 PolarHBondContact O-N 3.44Å; V906-E909 PolarHBondContact O-N 3.18Å; E909-Y912 PolarHBondContact O-N 3.44Å; E909-Q913 HydrophobicContact CG-CG 4.39Å; E909-Q913 WeakPolarHBondContact O-CG 3.28Å; E909-Q913 PolarHBondContact O-N 2.85Å; E909-Q913 WeakPolarHBondContact OE1-CG 3.37Å; E909-Q913 PolarHBondContact OE1-NE2 3.17Å; E909-F924 HydrophobicContact CB-CZ 4.35Å; E909-F924 HydrophobicContact CG-CE1 3.87Å; E909-F924 HydrophobicContact CG-CE2 4.49Å; E909-F924 HydrophobicContact CG-CZ 3.55Å
910	L	95.7	Very high	93.8	Very high	8 Å²	8	71.3 Å²	71.3	4%	0.042	39%	0.389	C	S	.	.	H	α-helix	trans	-60.4	-45.9	172.9	175.8	61	0	0	0	111.2	V906 E907 Y912 Q913 K914 V925 V928 I932	V906-L910 VanDerWaalsContact O-CB 3.29Å; V906-L910 WeakPolarHBondContact O-CB 3.44Å; V906-L910 PolarHBondContact O-N 3.49Å; E907-L910 PolarHBondContact O-N 3.03Å; L910-Y912 VanDerWaalsContact C-N 3.34Å; L910-Q913 PolarHBondContact O-N 2.88Å; L910-K914 HydrophobicContact CD1-CG 4.29Å; L910-K914 WeakPolarHBondContact O-CG 3.28Å; L910-K914 PolarHBondContact O-N 3.27Å; L910-V925 HydrophobicContact CD1-CB 4.29Å; L910-V925 HydrophobicContact CD1-CG1 4.06Å; L910-V925 HydrophobicContact CD1-CG2 4.4Å; L910-V928 HydrophobicContact CB-CG1 3.98Å; L910-V928 HydrophobicContact CD1-CB 4.28Å; L910-V928 HydrophobicContact CD1-CG1 4.21Å; L910-V928 HydrophobicContact CD2-CG1 4.36Å; L910-V928 HydrophobicContact CG-CG1 4.39Å; L910-I932 HydrophobicContact CB-CD1 4.02Å; L910-I932 HydrophobicContact CD2-CD1 3.61Å; L910-I932 HydrophobicContact CG-CD1 4.44Å
911	E	95.5	Very high	93.2	Very high	112 Å²	112	68 Å²	68	52%	0.523	39%	0.392	S	S	.	.	H	α-helix	trans	-67.4	-36.9	179.9	-156.9	59.6	-147.5	0	0	111.9	E907 T908 K914 S915	E907-E911 PolarHBondContact O-N 2.65Å; T908-E911 PolarHBondContact O-N 3.31Å; E911-K914 WeakPolarHBondContact OE2-CD 3.37Å; E911-K914 IonicContact OE2-NZ 2.9Å; E911-K914 PolarHBondContact OE2-NZ 3.24Å; E911-S915 PolarHBondContact O-N 3.11Å
912	Y	96.1	Very high	93.2	Very high	68 Å²	68	66.9 Å²	66.9	27%	0.267	38%	0.38	S	S	.	.	H	α-helix	trans	-59.4	-50.9	169.1	172.4	-102.3	0	0	0	111.7	N768 H769 T908 E909 L910 K914 S915 Q916	N768-Y912 PolarHBondContact ND2-OH 2.95Å; N768-Y912 PolarHBondContact OD1-OH 3.46Å; H769-Y912 HydrophobicContact CB-CE1 4.25Å; H769-Y912 AromaticContact CD2-CE1 3.53Å; H769-Y912 AromaticContact CD2-CZ 3.82Å; H769-Y912 AromaticContact CE1-CD1 3.36Å; H769-Y912 WeakPolarHBondContact CE1-CD1 3.3Å; H769-Y912 AromaticContact CE1-CE1 3.32Å; H769-Y912 WeakPolarHBondContact CE1-CE1 3.42Å; H769-Y912 AromaticContact CE1-CE2 3.96Å; H769-Y912 AromaticContact CE1-CG 3.72Å; H769-Y912 AromaticContact CE1-CZ 3.64Å; H769-Y912 AromaticContact CG-CD1 3.85Å; H769-Y912 AromaticContact CG-CE1 3.47Å; H769-Y912 VanDerWaalsContact CG-CE1 3.47Å; H769-Y912 AromaticContact ND1-CD1 3.25Å; H769-Y912 VanDerWaalsContact ND1-CD1 3.25Å; H769-Y912 WeakPolarHBondContact ND1-CD1 3.48Å; H769-Y912 AromaticContact ND1-CE1 3.33Å; H769-Y912 VanDerWaalsContact ND1-CE1 3.33Å; H769-Y912 WeakPolarHBondContact ND1-CE1 3.38Å; H769-Y912 AromaticContact ND1-CG 3.99Å; H769-Y912 AromaticContact NE2-CE1 3.48Å; H769-Y912 WeakPolarHBondContact NE2-CE1 3.49Å; H769-Y912 AromaticContact NE2-CE2 3.98Å; H769-Y912 AromaticContact NE2-CZ 3.47Å; T908-Y912 PolarHBondContact O-N 2.92Å; E909-Y912 PolarHBondContact O-N 3.44Å; L910-Y912 VanDerWaalsContact C-N 3.34Å; Y912-K914 VanDerWaalsContact C-N 3.35Å; Y912-K914 PolarHBondContact O-N 3.17Å; Y912-S915 WeakPolarHBondContact O-CB 3.23Å; Y912-S915 PolarHBondContact O-N 3.36Å; Y912-S915 PolarHBondContact O-OG 2.86Å; Y912-Q916 HydrophobicContact CE1-CG 4.26Å
913	Q	93.6	Very high	93.2	Very high	9 Å²	9	69.9 Å²	69.9	4%	0.042	39%	0.388	C	S	.	.	H	α-helix	trans	-69.8	-27.6	-177.5	-63.5	-63.9	-12.4	0	0	113.3	E909 L910 S915 Q916 F924 V925	E909-Q913 HydrophobicContact CG-CG 4.39Å; E909-Q913 WeakPolarHBondContact O-CG 3.28Å; E909-Q913 PolarHBondContact O-N 2.85Å; E909-Q913 WeakPolarHBondContact OE1-CG 3.37Å; E909-Q913 PolarHBondContact OE1-NE2 3.17Å; L910-Q913 PolarHBondContact O-N 2.88Å; Q913-S915 PolarHBondContact O-N 2.71Å; Q913-Q916 PolarHBondContact O-N 3.25Å; Q913-F924 HydrophobicContact CB-CD1 3.81Å; Q913-F924 HydrophobicContact CB-CE1 4.2Å; Q913-F924 HydrophobicContact CG-CD1 3.7Å; Q913-F924 HydrophobicContact CG-CE1 3.85Å; Q913-F924 HydrophobicContact CG-CG 4.45Å; Q913-V925 HydrophobicContact CB-CG2 3.77Å
914	K	93.4	Very high	93.2	Very high	100 Å²	100	69.5 Å²	69.5	44%	0.435	39%	0.387	S	S	.	.	H	α-helix	trans	-62	-30.7	168.3	-76.5	175.9	-168.4	159.5	0	113.1	L910 E911 Y912 Q916 V925	L910-K914 HydrophobicContact CD1-CG 4.29Å; L910-K914 WeakPolarHBondContact O-CG 3.28Å; L910-K914 PolarHBondContact O-N 3.27Å; E911-K914 WeakPolarHBondContact OE2-CD 3.37Å; E911-K914 IonicContact OE2-NZ 2.9Å; E911-K914 PolarHBondContact OE2-NZ 3.24Å; Y912-K914 VanDerWaalsContact C-N 3.35Å; Y912-K914 PolarHBondContact O-N 3.17Å; K914-Q916 PolarHBondContact O-N 3.46Å; K914-V925 HydrophobicContact CG-CG1 3.87Å
915	S	93.8	Very high	93.3	Very high	80 Å²	80	65.2 Å²	65.2	56%	0.559	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75	-10.6	178.6	77.8	0	0	0	0	113.6	E911 Y912 Q913	E911-S915 PolarHBondContact O-N 3.11Å; Y912-S915 WeakPolarHBondContact O-CB 3.23Å; Y912-S915 PolarHBondContact O-N 3.36Å; Y912-S915 PolarHBondContact O-OG 2.86Å; Q913-S915 PolarHBondContact O-N 2.71Å
916	Q	92.9	Very high	93.2	Very high	71 Å²	71	67.1 Å²	67.1	33%	0.332	38%	0.382	S	S	.	.	S	Bend	trans	-94.4	150.3	-177.3	-57.5	-54.4	-63.9	0	0	111.8	Y912 Q913 K914	Y912-Q916 HydrophobicContact CE1-CG 4.26Å; Q913-Q916 PolarHBondContact O-N 3.25Å; K914-Q916 PolarHBondContact O-N 3.46Å
917	P	90.8	Very high	93.2	Very high	90 Å²	90	68.7 Å²	68.7	58%	0.584	39%	0.391	S	S	*	.	P	Polyproline II helix	trans	-61.3	132.5	173.9	-21.9	33.5	0	0	0	111.7	Q919	P917-Q919 PolarHBondContact O-N 3.05Å
918	P	88.6	Confident	93.3	Very high	134 Å²	134	65.1 Å²	65.1	87%	0.87	38%	0.375	S	S	*	.	P	Polyproline II helix	trans	-57	130.4	178.2	-26.9	35.2	0	0	0	112.9
919	Q	88.3	Confident	93.2	Very high	122 Å²	122	62.6 Å²	62.6	57%	0.57	36%	0.361	S	S	*	.			trans	-109	139.9	179.8	-67.1	-64.8	-27.6	0	0	111.4	P917 G921 D922	P917-Q919 PolarHBondContact O-N 3.05Å; Q919-G921 PolarHBondContact O-N 2.8Å; Q919-D922 HydrophobicContact CB-CB 4.1Å; Q919-D922 PolarHBondContact O-N 2.98Å; Q919-D922 VanDerWaalsContact O-N 3.17Å
920	P	86.4	Confident	93.2	Very high	127 Å²	127	68.9 Å²	68.9	83%	0.825	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	124.7	176.7	27.5	-33.6	0	0	0	110.8
921	G	84.4	Confident	93.2	Very high	49 Å²	49	69.8 Å²	69.8	51%	0.505	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	94	-11.9	-177.1	0	0	0	0	0	114.9	Q919	Q919-G921 PolarHBondContact O-N 2.8Å
922	D	93.8	Very high	93.3	Very high	45 Å²	45	65.5 Å²	65.5	24%	0.241	37%	0.374	C	S	.	.			trans	-84.9	111.9	171.7	-171.8	-0.8	0	0	0	110.6	R773 Q919 F924	R773-D922 IonicContact CZ-OD1 3.31Å; R773-D922 IonicContact CZ-OD2 3.97Å; R773-D922 IonicContact NH1-OD1 2.67Å; R773-D922 PolarHBondContact NH1-OD1 2.68Å; R773-D922 IonicContact NH1-OD2 2.74Å; R773-D922 PolarHBondContact NH1-OD2 3Å; R773-D922 VanDerWaalsContact NH1-OD2 3.1Å; R773-D922 IonicContact NH2-OD1 3.29Å; R773-D922 IonicContact NH2-OD2 2.77Å; R773-D922 PolarHBondContact NH2-OD2 3.47Å; Q919-D922 HydrophobicContact CB-CB 4.1Å; Q919-D922 PolarHBondContact O-N 2.98Å; Q919-D922 VanDerWaalsContact O-N 3.17Å; D922-F924 WeakPolarHBondContact OD1-CB 3.37Å; D922-F924 PolarHBondContact OD1-N 2.82Å
923	K	95.1	Very high	93.2	Very high	79 Å²	79	67.3 Å²	67.3	34%	0.343	39%	0.393	S	S	.	.			trans	-103.3	4.2	178.5	-61.1	-176.7	171.5	176.1	0	112.7	L715 T716 E719 V925 S926 V927	L715-K923 PolarHBondContact O-N 2.92Å; T716-K923 HydrophobicContact CG2-CD 4.31Å; E719-K923 IonicContact OE1-NZ 2.88Å; E719-K923 PolarHBondContact OE1-NZ 2.59Å; E719-K923 IonicContact OE2-NZ 2.79Å; E719-K923 PolarHBondContact OE2-NZ 2.9Å; K923-V925 PolarHBondContact O-N 2.98Å; K923-S926 WeakPolarHBondContact O-CB 3.46Å; K923-S926 PolarHBondContact O-N 3.35Å; K923-V927 HydrophobicContact CB-CG2 4.21Å; K923-V927 PolarHBondContact O-N 3.23Å
924	F	96.3	Very high	93.2	Very high	0 Å²	0	71.4 Å²	71.4	0%	0	42%	0.418	C	S	.	.	H	α-helix	trans	-53.6	-58.1	-171.2	-172.2	-88.7	0	0	0	112.7	M717 R773 E909 Q913 D922 S926 V927 V928	M717-F924 HydrophobicContact CE-CE2 4.45Å; M717-F924 HydrophobicContact CG-CD2 4.04Å; M717-F924 HydrophobicContact SD-CD2 3.43Å; M717-F924 WeakPolarHBondContact SD-CD2 3.44Å; M717-F924 HydrophobicContact SD-CE2 3.71Å; M717-F924 HydrophobicContact SD-CG 4.49Å; R773-F924 HydrophobicContact CB-CD2 4.37Å; R773-F924 HydrophobicContact CB-CE2 4.16Å; R773-F924 HydrophobicContact CG-CD2 3.91Å; R773-F924 HydrophobicContact CG-CE2 3.89Å; E909-F924 HydrophobicContact CB-CZ 4.35Å; E909-F924 HydrophobicContact CG-CE1 3.87Å; E909-F924 HydrophobicContact CG-CE2 4.49Å; E909-F924 HydrophobicContact CG-CZ 3.55Å; Q913-F924 HydrophobicContact CB-CD1 3.81Å; Q913-F924 HydrophobicContact CB-CE1 4.2Å; Q913-F924 HydrophobicContact CG-CD1 3.7Å; Q913-F924 HydrophobicContact CG-CE1 3.85Å; Q913-F924 HydrophobicContact CG-CG 4.45Å; D922-F924 WeakPolarHBondContact OD1-CB 3.37Å; D922-F924 PolarHBondContact OD1-N 2.82Å; F924-S926 PolarHBondContact O-N 2.95Å; F924-V927 PolarHBondContact O-N 3.32Å; F924-V928 HydrophobicContact CD1-CB 4.35Å; F924-V928 HydrophobicContact CD1-CG2 4.11Å; F924-V928 HydrophobicContact CD2-CG2 3.95Å; F924-V928 HydrophobicContact CE1-CB 4.16Å; F924-V928 HydrophobicContact CE1-CG1 4.18Å; F924-V928 HydrophobicContact CE1-CG2 3.94Å; F924-V928 HydrophobicContact CE2-CG2 3.76Å; F924-V928 HydrophobicContact CG-CG2 4.11Å; F924-V928 HydrophobicContact CZ-CB 4.39Å; F924-V928 HydrophobicContact CZ-CG1 4.3Å; F924-V928 HydrophobicContact CZ-CG2 3.76Å; F924-V928 WeakPolarHBondContact O-CB 3.33Å; F924-V928 VanDerWaalsContact O-CG2 3.26Å; F924-V928 WeakPolarHBondContact O-CG2 3.11Å; F924-V928 PolarHBondContact O-N 3.28Å
925	V	95.8	Very high	93.3	Very high	48 Å²	48	66.6 Å²	66.6	29%	0.291	40%	0.397	S	S	.	.	H	α-helix	trans	-58.4	-36.9	-177.5	177.2	0	0	0	0	112	L910 Q913 K914 K923 S929	L910-V925 HydrophobicContact CD1-CB 4.29Å; L910-V925 HydrophobicContact CD1-CG1 4.06Å; L910-V925 HydrophobicContact CD1-CG2 4.4Å; Q913-V925 HydrophobicContact CB-CG2 3.77Å; K914-V925 HydrophobicContact CG-CG1 3.87Å; K923-V925 PolarHBondContact O-N 2.98Å; V925-S929 WeakPolarHBondContact O-CB 3.44Å; V925-S929 PolarHBondContact O-N 3.2Å; V925-S929 VanDerWaalsContact O-N 3.09Å; V925-S929 PolarHBondContact O-OG 3.42Å
926	S	93.7	Very high	93.3	Very high	89 Å²	89	64.4 Å²	64.4	62%	0.622	38%	0.382	S	S	*	.	H	α-helix	trans	-66.7	-58.2	178.6	-175.5	0	0	0	0	111.7	K923 F924 V928 Q930	K923-S926 WeakPolarHBondContact O-CB 3.46Å; K923-S926 PolarHBondContact O-N 3.35Å; F924-S926 PolarHBondContact O-N 2.95Å; S926-V928 PolarHBondContact O-N 3.45Å; S926-Q930 PolarHBondContact O-N 2.88Å
927	V	96.8	Very high	93.3	Very high	35 Å²	35	68.9 Å²	68.9	21%	0.212	40%	0.401	C	S	.	.	H	α-helix	trans	-67.7	-37.3	-176	177.2	0	0	0	0	111.6	M717 K780 K923 F924 F931	M717-V927 HydrophobicContact CB-CB 3.95Å; M717-V927 HydrophobicContact CB-CG1 3.77Å; M717-V927 HydrophobicContact CB-CG2 4.23Å; M717-V927 HydrophobicContact CG-CB 4.17Å; M717-V927 HydrophobicContact CG-CG1 4.31Å; K780-V927 HydrophobicContact CD-CG1 4.13Å; K923-V927 HydrophobicContact CB-CG2 4.21Å; K923-V927 PolarHBondContact O-N 3.23Å; F924-V927 PolarHBondContact O-N 3.32Å; V927-F931 WeakPolarHBondContact O-CB 3.15Å; V927-F931 PolarHBondContact O-N 3.1Å
928	V	96.5	Very high	93.5	Very high	1 Å²	1	66 Å²	66	1%	0.006	38%	0.383	C	S	.	.	H	α-helix	trans	-77.5	-33.1	-177.1	177.5	0	0	0	0	112.1	M717 V906 L910 F924 S926 F931 I932	M717-V928 HydrophobicContact CE-CG2 3.62Å; M717-V928 HydrophobicContact CG-CG2 4.29Å; M717-V928 HydrophobicContact SD-CG2 4.11Å; V906-V928 HydrophobicContact CG1-CG1 3.39Å; L910-V928 HydrophobicContact CB-CG1 3.98Å; L910-V928 HydrophobicContact CD1-CB 4.28Å; L910-V928 HydrophobicContact CD1-CG1 4.21Å; L910-V928 HydrophobicContact CD2-CG1 4.36Å; L910-V928 HydrophobicContact CG-CG1 4.39Å; F924-V928 HydrophobicContact CD1-CB 4.35Å; F924-V928 HydrophobicContact CD1-CG2 4.11Å; F924-V928 HydrophobicContact CD2-CG2 3.95Å; F924-V928 HydrophobicContact CE1-CB 4.16Å; F924-V928 HydrophobicContact CE1-CG1 4.18Å; F924-V928 HydrophobicContact CE1-CG2 3.94Å; F924-V928 HydrophobicContact CE2-CG2 3.76Å; F924-V928 HydrophobicContact CG-CG2 4.11Å; F924-V928 HydrophobicContact CZ-CB 4.39Å; F924-V928 HydrophobicContact CZ-CG1 4.3Å; F924-V928 HydrophobicContact CZ-CG2 3.76Å; F924-V928 WeakPolarHBondContact O-CB 3.33Å; F924-V928 VanDerWaalsContact O-CG2 3.26Å; F924-V928 WeakPolarHBondContact O-CG2 3.11Å; F924-V928 PolarHBondContact O-N 3.28Å; S926-V928 PolarHBondContact O-N 3.45Å; V928-F931 PolarHBondContact O-N 3.25Å; V928-I932 HydrophobicContact CG1-CD1 3.93Å; V928-I932 HydrophobicContact CG1-CG1 4.5Å; V928-I932 WeakPolarHBondContact O-CB 3.35Å; V928-I932 PolarHBondContact O-N 3.36Å
929	S	94.6	Very high	93.8	Very high	39 Å²	39	59.9 Å²	59.9	27%	0.273	34%	0.343	S	S	.	.	H	α-helix	trans	-63.3	-42.4	170.9	-60.9	0	0	0	0	111.7	V925 T933	V925-S929 WeakPolarHBondContact O-CB 3.44Å; V925-S929 PolarHBondContact O-N 3.2Å; V925-S929 VanDerWaalsContact O-N 3.09Å; V925-S929 PolarHBondContact O-OG 3.42Å; S929-T933 PolarHBondContact O-N 2.87Å; S929-T933 PolarHBondContact O-OG1 3.23Å
930	Q	94.9	Very high	94.1	Very high	140 Å²	140	57 Å²	57	65%	0.654	34%	0.335	S	S	*	.	H	α-helix	trans	-65.2	-42.3	175.5	-170.8	-177.9	14.7	0	0	111.7	S926 V934	S926-Q930 PolarHBondContact O-N 2.88Å; Q930-V934 PolarHBondContact O-N 3.07Å
931	F	97	Very high	94.5	Very high	27 Å²	27	54.1 Å²	54.1	12%	0.118	31%	0.313	C	S	.	.	H	α-helix	trans	-60.8	-49.5	176.5	169.4	-106.4	0	0	0	112.1	F779 K780 F783 V906 V927 V928 T933 V934 A935	F779-F931 AromaticContact CD1-CE1 3.85Å; F779-F931 HydrophobicContact CD1-CE1 3.85Å; F779-F931 AromaticContact CD1-CZ 3.79Å; F779-F931 HydrophobicContact CD1-CZ 3.79Å; F779-F931 HydrophobicContact CE1-CE1 4.08Å; F779-F931 AromaticContact CE1-CZ 3.87Å; F779-F931 HydrophobicContact CE1-CZ 3.87Å; K780-F931 HydrophobicContact CB-CD1 4.47Å; K780-F931 HydrophobicContact CB-CD2 4.22Å; K780-F931 HydrophobicContact CB-CE1 4.43Å; K780-F931 HydrophobicContact CB-CE2 4.18Å; K780-F931 HydrophobicContact CB-CG 4.37Å; K780-F931 HydrophobicContact CB-CZ 4.29Å; K780-F931 HydrophobicContact CD-CG 4.47Å; K780-F931 HydrophobicContact CG-CD2 3.98Å; K780-F931 HydrophobicContact CG-CE2 4.28Å; K780-F931 HydrophobicContact CG-CG 4.3Å; F783-F931 HydrophobicContact CB-CE2 3.86Å; F783-F931 HydrophobicContact CB-CZ 3.87Å; F783-F931 HydrophobicContact CD1-CE2 4.19Å; F783-F931 HydrophobicContact CD2-CZ 4.24Å; F783-F931 HydrophobicContact CG-CE2 4Å; F783-F931 AromaticContact CG-CZ 3.96Å; F783-F931 HydrophobicContact CG-CZ 3.96Å; V906-F931 HydrophobicContact CG1-CD1 4.33Å; V906-F931 HydrophobicContact CG1-CE1 4.36Å; V927-F931 WeakPolarHBondContact O-CB 3.15Å; V927-F931 PolarHBondContact O-N 3.1Å; V928-F931 PolarHBondContact O-N 3.25Å; F931-T933 PolarHBondContact O-N 2.85Å; F931-V934 PolarHBondContact O-N 3.31Å; F931-A935 HydrophobicContact CD1-CB 4.47Å; F931-A935 HydrophobicContact CD2-CB 4.28Å; F931-A935 HydrophobicContact CE1-CB 4.05Å; F931-A935 HydrophobicContact CE2-CB 3.84Å; F931-A935 HydrophobicContact CZ-CB 3.71Å; F931-A935 WeakPolarHBondContact O-CB 3.46Å; F931-A935 PolarHBondContact O-N 2.92Å
932	I	96	Very high	95	Very high	22 Å²	22	51.9 Å²	51.9	11%	0.113	29%	0.29	C	S	.	.	H	α-helix	trans	-60	-42.8	-180	-83	166.6	0	0	0	111.6	L903 V906 E907 L910 V928 V934 A935 S936	L903-I932 HydrophobicContact CD1-CG1 4.29Å; V906-I932 HydrophobicContact CB-CD1 4.5Å; V906-I932 HydrophobicContact CG1-CD1 3.97Å; V906-I932 HydrophobicContact CG1-CG1 4.32Å; E907-I932 HydrophobicContact CB-CD1 4.26Å; E907-I932 HydrophobicContact CG-CD1 3.72Å; E907-I932 HydrophobicContact CG-CG1 4.18Å; E907-I932 HydrophobicContact CG-CG2 4.32Å; L910-I932 HydrophobicContact CB-CD1 4.02Å; L910-I932 HydrophobicContact CD2-CD1 3.61Å; L910-I932 HydrophobicContact CG-CD1 4.44Å; V928-I932 HydrophobicContact CG1-CD1 3.93Å; V928-I932 HydrophobicContact CG1-CG1 4.5Å; V928-I932 WeakPolarHBondContact O-CB 3.35Å; V928-I932 PolarHBondContact O-N 3.36Å; I932-V934 VanDerWaalsContact C-N 3.25Å; I932-V934 PolarHBondContact O-N 2.92Å; I932-A935 PolarHBondContact O-N 3.46Å; I932-S936 WeakPolarHBondContact O-CB 3.5Å; I932-S936 PolarHBondContact O-N 3.44Å; I932-S936 PolarHBondContact O-OG 3.24Å
933	T	93.9	Very high	95.1	Very high	106 Å²	106	52.6 Å²	52.6	65%	0.65	29%	0.292	S	S	*	.	H	α-helix	trans	-54.5	-41.3	177.1	-59	0	0	0	0	112.5	S929 F931	S929-T933 PolarHBondContact O-N 2.87Å; S929-T933 PolarHBondContact O-OG1 3.23Å; F931-T933 PolarHBondContact O-N 2.85Å
934	V	94.6	Very high	95.1	Very high	95 Å²	95	53.7 Å²	53.7	58%	0.576	30%	0.301	S	S	*	.	H	α-helix	trans	-81.1	-40.5	178.4	-178.8	0	0	0	0	111.6	Q930 F931 I932 S938	Q930-V934 PolarHBondContact O-N 3.07Å; F931-V934 PolarHBondContact O-N 3.31Å; I932-V934 VanDerWaalsContact C-N 3.25Å; I932-V934 PolarHBondContact O-N 2.92Å; V934-S938 VanDerWaalsContact O-CB 3.25Å; V934-S938 WeakPolarHBondContact O-CB 3.48Å; V934-S938 PolarHBondContact O-N 3.47Å
935	A	95	Very high	95.1	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-70.1	-45.5	-175.3	0	0	0	0	0	112.5	F783 L903 F931 I932 S938 F939	F783-A935 HydrophobicContact CD1-CB 4.23Å; F783-A935 HydrophobicContact CD2-CB 4.36Å; F783-A935 HydrophobicContact CE1-CB 3.85Å; F783-A935 HydrophobicContact CE2-CB 3.98Å; F783-A935 HydrophobicContact CG-CB 4.48Å; F783-A935 HydrophobicContact CZ-CB 3.71Å; F783-A935 WeakPolarHBondContact CZ-O 3.48Å; L903-A935 HydrophobicContact CD1-CB 3.85Å; F931-A935 HydrophobicContact CD1-CB 4.47Å; F931-A935 HydrophobicContact CD2-CB 4.28Å; F931-A935 HydrophobicContact CE1-CB 4.05Å; F931-A935 HydrophobicContact CE2-CB 3.84Å; F931-A935 HydrophobicContact CZ-CB 3.71Å; F931-A935 WeakPolarHBondContact O-CB 3.46Å; F931-A935 PolarHBondContact O-N 2.92Å; I932-A935 PolarHBondContact O-N 3.46Å; A935-S938 PolarHBondContact O-N 2.94Å; A935-F939 WeakPolarHBondContact O-CB 3.38Å; A935-F939 PolarHBondContact O-N 3.45Å
936	S	93.8	Very high	95.1	Very high	34 Å²	34	54.1 Å²	54.1	24%	0.238	30%	0.302	C	S	.	.	H	α-helix	trans	-68.5	-35.9	179.5	-53.9	0	0	0	0	111.7	L903 E907 I932 F939 S940	L903-S936 WeakPolarHBondContact CD2-OG 3.48Å; E907-S936 PolarHBondContact OE1-OG 3.09Å; E907-S936 VanDerWaalsContact OE1-OG 3.12Å; I932-S936 WeakPolarHBondContact O-CB 3.5Å; I932-S936 PolarHBondContact O-N 3.44Å; I932-S936 PolarHBondContact O-OG 3.24Å; S936-F939 PolarHBondContact O-N 2.95Å; S936-S940 WeakPolarHBondContact O-CB 3.27Å; S936-S940 PolarHBondContact O-N 2.91Å
937	F	93.3	Very high	95.2	Very high	165 Å²	165	52.8 Å²	52.8	72%	0.724	30%	0.296	S	S	*	.	H	α-helix	trans	-63.4	-51	170.4	-180	-96.8	0	0	0	111.7	F939 S940 D941	F937-F939 PolarHBondContact O-N 3.37Å; F937-S940 PolarHBondContact O-N 3.44Å; F937-D941 PolarHBondContact O-N 2.85Å
938	S	94.1	Very high	95.2	Very high	30 Å²	30	55.2 Å²	55.2	21%	0.21	31%	0.305	C	S	.	.	H	α-helix	trans	-66.3	-22.9	179.7	-176.2	0	0	0	0	113.6	V934 A935 V942	V934-S938 VanDerWaalsContact O-CB 3.25Å; V934-S938 WeakPolarHBondContact O-CB 3.48Å; V934-S938 PolarHBondContact O-N 3.47Å; A935-S938 PolarHBondContact O-N 2.94Å; S938-V942 WeakPolarHBondContact O-CG2 3.35Å
939	F	95.3	Very high	95.3	Very high	5 Å²	5	55.2 Å²	55.2	2%	0.022	31%	0.305	C	S	.	.	H	α-helix	trans	-87.4	-37.3	177.4	-173	-114.2	0	0	0	112.3	F783 I896 L899 R900 L903 A935 S936 F937 D941 V942 E943	F783-F939 HydrophobicContact CE2-CB 4.43Å; F783-F939 HydrophobicContact CZ-CB 4.25Å; I896-F939 HydrophobicContact CD1-CE2 4.47Å; I896-F939 HydrophobicContact CG2-CZ 4.4Å; L899-F939 HydrophobicContact CB-CD2 3.9Å; L899-F939 HydrophobicContact CB-CE2 3.38Å; L899-F939 HydrophobicContact CB-CZ 3.94Å; L899-F939 HydrophobicContact CD1-CD2 4.22Å; L899-F939 HydrophobicContact CD1-CE2 3.97Å; L899-F939 HydrophobicContact CG-CE2 4.29Å; R900-F939 HydrophobicContact CB-CE1 3.74Å; R900-F939 HydrophobicContact CB-CZ 3.75Å; R900-F939 HydrophobicContact CG-CE1 4.05Å; R900-F939 HydrophobicContact CG-CZ 4.48Å; L903-F939 HydrophobicContact CD2-CB 4.09Å; L903-F939 HydrophobicContact CD2-CD1 4.03Å; L903-F939 HydrophobicContact CD2-CG 4.32Å; A935-F939 WeakPolarHBondContact O-CB 3.38Å; A935-F939 PolarHBondContact O-N 3.45Å; S936-F939 PolarHBondContact O-N 2.95Å; F937-F939 PolarHBondContact O-N 3.37Å; F939-D941 VanDerWaalsContact C-N 3.3Å; F939-D941 PolarHBondContact O-N 3.06Å; F939-V942 HydrophobicContact CD2-CB 4.38Å; F939-V942 WeakPolarHBondContact O-CA 3.39Å; F939-V942 WeakPolarHBondContact O-CB 3.38Å; F939-V942 PolarHBondContact O-N 2.65Å; F939-E943 HydrophobicContact CD1-CG 4.02Å; F939-E943 HydrophobicContact CE1-CG 3.55Å; F939-E943 WeakPolarHBondContact CE1-OE2 3.43Å; F939-E943 HydrophobicContact CE2-CG 4.16Å; F939-E943 HydrophobicContact CZ-CG 3.62Å; F939-E943 WeakPolarHBondContact O-CG 3.45Å; F939-E943 PolarHBondContact O-N 3.29Å
940	S	95.1	Very high	95.3	Very high	60 Å²	60	56.2 Å²	56.2	42%	0.42	31%	0.305	S	S	.	.	H	α-helix	trans	-54.2	-49.2	172.7	-168.8	0	0	0	0	111	S936 F937 V942 E943 D944	S936-S940 WeakPolarHBondContact O-CB 3.27Å; S936-S940 PolarHBondContact O-N 2.91Å; F937-S940 PolarHBondContact O-N 3.44Å; S940-V942 PolarHBondContact O-N 2.87Å; S940-E943 WeakPolarHBondContact O-CA 3.5Å; S940-E943 PolarHBondContact O-N 3.37Å; S940-D944 PolarHBondContact O-N 3.28Å; S940-D944 VanDerWaalsContact O-OD2 3.08Å; S940-D944 PolarHBondContact OG-OD2 3.13Å
941	D	94.3	Very high	95.4	Very high	68 Å²	68	53.1 Å²	53.1	36%	0.364	29%	0.293	S	S	.	.	H	α-helix	trans	-56.2	-32.5	175.4	174.7	72.9	0	0	0	113.1	K791 F937 F939 L945	K791-D941 WeakPolarHBondContact CE-OD2 3.24Å; K791-D941 IonicContact NZ-OD2 3.43Å; K791-D941 PolarHBondContact NZ-OD2 3.04Å; F937-D941 PolarHBondContact O-N 2.85Å; F939-D941 VanDerWaalsContact C-N 3.3Å; F939-D941 PolarHBondContact O-N 3.06Å; D941-L945 WeakPolarHBondContact O-CB 3.2Å; D941-L945 WeakPolarHBondContact O-CD1 3.17Å; D941-L945 WeakPolarHBondContact O-CG 3.31Å; D941-L945 PolarHBondContact O-N 2.82Å
942	V	95.1	Very high	95.4	Very high	1 Å²	1	53.5 Å²	53.5	1%	0.006	30%	0.296	C	S	.	.	H	α-helix	trans	-74.2	-38.9	172.7	173.4	0	0	0	0	112.2	V787 V790 K791 I896 S938 F939 S940 L946	V787-V942 HydrophobicContact CG1-CG2 4.08Å; V790-V942 HydrophobicContact CG1-CG1 3.61Å; K791-V942 HydrophobicContact CD-CG2 4.15Å; K791-V942 HydrophobicContact CG-CG2 3.74Å; I896-V942 HydrophobicContact CD1-CG1 3.47Å; I896-V942 VanDerWaalsContact CD1-CG1 3.47Å; S938-V942 WeakPolarHBondContact O-CG2 3.35Å; F939-V942 HydrophobicContact CD2-CB 4.38Å; F939-V942 WeakPolarHBondContact O-CA 3.39Å; F939-V942 WeakPolarHBondContact O-CB 3.38Å; F939-V942 PolarHBondContact O-N 2.65Å; S940-V942 PolarHBondContact O-N 2.87Å; V942-L946 VanDerWaalsContact O-CB 3.27Å; V942-L946 WeakPolarHBondContact O-CB 3.4Å; V942-L946 PolarHBondContact O-N 3.35Å
943	E	95.2	Very high	95.5	Very high	60 Å²	60	53.2 Å²	53.2	28%	0.28	29%	0.294	S	S	.	.	H	α-helix	trans	-69.4	-39.4	177.9	-62.3	-159.1	97.8	0	0	112	R900 F939 S940 L946 A947	R900-E943 IonicContact CZ-OE1 2.81Å; R900-E943 IonicContact NE-OE1 3.9Å; R900-E943 PolarHBondContact NE-OE1 2.98Å; R900-E943 IonicContact NH2-OE1 3.74Å; R900-E943 PolarHBondContact NH2-OE1 2.96Å; F939-E943 HydrophobicContact CD1-CG 4.02Å; F939-E943 HydrophobicContact CE1-CG 3.55Å; F939-E943 WeakPolarHBondContact CE1-OE2 3.43Å; F939-E943 HydrophobicContact CE2-CG 4.16Å; F939-E943 HydrophobicContact CZ-CG 3.62Å; F939-E943 WeakPolarHBondContact O-CG 3.45Å; F939-E943 PolarHBondContact O-N 3.29Å; S940-E943 WeakPolarHBondContact O-CA 3.5Å; S940-E943 PolarHBondContact O-N 3.37Å; E943-L946 PolarHBondContact O-N 3.41Å; E943-A947 WeakPolarHBondContact O-CB 3.45Å; E943-A947 PolarHBondContact O-N 2.97Å
944	D	96.2	Very high	95.5	Very high	103 Å²	103	50.6 Å²	50.6	55%	0.551	28%	0.278	S	S	*	.	H	α-helix	trans	-64.9	-48.6	176.4	-68.7	-45.8	0	0	0	110.9	S940 L946 A947 E948	S940-D944 PolarHBondContact O-N 3.28Å; S940-D944 VanDerWaalsContact O-OD2 3.08Å; S940-D944 PolarHBondContact OG-OD2 3.13Å; D944-L946 VanDerWaalsContact C-N 3.33Å; D944-L946 PolarHBondContact O-N 3.49Å; D944-A947 PolarHBondContact O-N 3.06Å; D944-E948 PolarHBondContact O-N 3.3Å
945	L	95.4	Very high	95.6	Very high	46 Å²	46	50.9 Å²	50.9	24%	0.241	27%	0.271	C	S	.	.	H	α-helix	trans	-61.6	-37.9	174.5	-73.2	169.4	0	0	0	112.6	V794 D941 E948 A949	V794-L945 HydrophobicContact CG1-CB 3.83Å; V794-L945 WeakPolarHBondContact CG1-O 3.49Å; D941-L945 WeakPolarHBondContact O-CB 3.2Å; D941-L945 WeakPolarHBondContact O-CD1 3.17Å; D941-L945 WeakPolarHBondContact O-CG 3.31Å; D941-L945 PolarHBondContact O-N 2.82Å; L945-E948 PolarHBondContact O-N 3.14Å; L945-A949 VanDerWaalsContact O-CB 3.27Å; L945-A949 WeakPolarHBondContact O-CB 3.4Å; L945-A949 PolarHBondContact O-N 3.08Å
946	L	96.3	Very high	95.6	Very high	10 Å²	10	50.9 Å²	50.9	5%	0.052	27%	0.271	C	S	.	.	H	α-helix	trans	-65.9	-38.8	175.7	179.7	73	0	0	0	111.7	V794 L892 I896 V942 E943 D944 K950	V794-L946 HydrophobicContact CG1-CB 4.42Å; V794-L946 HydrophobicContact CG2-CB 4.33Å; V794-L946 HydrophobicContact CG2-CD1 3.95Å; L892-L946 HydrophobicContact CD2-CD1 4Å; L892-L946 HydrophobicContact CG-CD1 4.35Å; I896-L946 HydrophobicContact CB-CD2 4.32Å; I896-L946 HydrophobicContact CD1-CD2 3.93Å; I896-L946 HydrophobicContact CG1-CD2 3.8Å; I896-L946 HydrophobicContact CG2-CD2 3.88Å; V942-L946 VanDerWaalsContact O-CB 3.27Å; V942-L946 WeakPolarHBondContact O-CB 3.4Å; V942-L946 PolarHBondContact O-N 3.35Å; E943-L946 PolarHBondContact O-N 3.41Å; D944-L946 VanDerWaalsContact C-N 3.33Å; D944-L946 PolarHBondContact O-N 3.49Å; L946-K950 HydrophobicContact CD1-CD 4.36Å; L946-K950 HydrophobicContact CG-CD 4.2Å; L946-K950 WeakPolarHBondContact O-CB 3.46Å; L946-K950 WeakPolarHBondContact O-CG 3.2Å; L946-K950 PolarHBondContact O-N 3.3Å
947	A	96.7	Very high	95.7	Very high	62 Å²	62	49.4 Å²	49.4	51%	0.512	26%	0.261	S	S	.	.	H	α-helix	trans	-65.3	-44.4	176.6	0	0	0	0	0	111.4	E943 D944 K950 D951	E943-A947 WeakPolarHBondContact O-CB 3.45Å; E943-A947 PolarHBondContact O-N 2.97Å; D944-A947 PolarHBondContact O-N 3.06Å; A947-K950 PolarHBondContact O-N 3.47Å; A947-D951 PolarHBondContact O-N 3.15Å; A947-D951 VanDerWaalsContact O-N 3.11Å
948	E	96.9	Very high	95.7	Very high	85 Å²	85	47.7 Å²	47.7	40%	0.397	25%	0.253	S	S	.	.	H	α-helix	trans	-60.5	-51.1	173.6	-170.2	-169	145.2	0	0	111.3	R798 D944 L945 K950 D951 L952	R798-E948 IonicContact NH1-OE1 2.7Å; D944-E948 PolarHBondContact O-N 3.3Å; L945-E948 PolarHBondContact O-N 3.14Å; E948-K950 VanDerWaalsContact C-N 3.28Å; E948-K950 PolarHBondContact O-N 3.45Å; E948-D951 PolarHBondContact O-N 2.98Å; E948-D951 VanDerWaalsContact O-N 3.16Å; E948-L952 HydrophobicContact CG-CD1 3.92Å; E948-L952 HydrophobicContact CG-CG 4.27Å; E948-L952 WeakPolarHBondContact O-CB 3.17Å; E948-L952 WeakPolarHBondContact O-CG 3.5Å; E948-L952 PolarHBondContact O-N 3.49Å
949	A	97.2	Very high	95.7	Very high	1 Å²	1	50.5 Å²	50.5	1%	0.008	26%	0.262	C	S	.	.	H	α-helix	trans	-57.5	-39.7	-179.7	0	0	0	0	0	112.3	V794 I797 R798 L945 F953	V794-A949 HydrophobicContact CG1-CB 4.02Å; I797-A949 HydrophobicContact CB-CB 4.32Å; I797-A949 HydrophobicContact CG2-CB 4.1Å; R798-A949 HydrophobicContact CB-CB 3.91Å; R798-A949 HydrophobicContact CG-CB 4.36Å; L945-A949 VanDerWaalsContact O-CB 3.27Å; L945-A949 WeakPolarHBondContact O-CB 3.4Å; L945-A949 PolarHBondContact O-N 3.08Å; A949-F953 WeakPolarHBondContact O-CB 3.43Å; A949-F953 PolarHBondContact O-N 3.36Å
950	K	96	Very high	95.6	Very high	61 Å²	61	51.2 Å²	51.2	27%	0.265	27%	0.266	S	S	.	.	H	α-helix	trans	-69.9	-37.4	177.4	-79.3	179.2	164.9	-173.3	0	113.6	M889 D893 L946 A947 E948 T954	M889-K950 HydrophobicContact CE-CG 3.91Å; M889-K950 HydrophobicContact SD-CD 4.43Å; M889-K950 WeakPolarHBondContact SD-CE 3.32Å; M889-K950 HydrophobicContact SD-CG 4.37Å; D893-K950 IonicContact OD1-NZ 2.72Å; D893-K950 PolarHBondContact OD1-NZ 2.85Å; D893-K950 IonicContact OD2-NZ 3.65Å; D893-K950 PolarHBondContact OD2-NZ 2.83Å; L946-K950 HydrophobicContact CD1-CD 4.36Å; L946-K950 HydrophobicContact CG-CD 4.2Å; L946-K950 WeakPolarHBondContact O-CB 3.46Å; L946-K950 WeakPolarHBondContact O-CG 3.2Å; L946-K950 PolarHBondContact O-N 3.3Å; A947-K950 PolarHBondContact O-N 3.47Å; E948-K950 VanDerWaalsContact C-N 3.28Å; E948-K950 PolarHBondContact O-N 3.45Å; K950-T954 VanDerWaalsContact O-CB 3.31Å; K950-T954 WeakPolarHBondContact O-CB 3.43Å; K950-T954 PolarHBondContact O-N 3.37Å; K950-T954 PolarHBondContact O-OG1 2.99Å
951	D	96.2	Very high	95.3	Very high	75 Å²	75	51.2 Å²	51.2	40%	0.401	28%	0.275	S	S	.	.	H	α-helix	trans	-71.1	-44.4	175.1	172.7	57.3	0	0	0	111.5	A947 E948 F953 T954 K955	A947-D951 PolarHBondContact O-N 3.15Å; A947-D951 VanDerWaalsContact O-N 3.11Å; E948-D951 PolarHBondContact O-N 2.98Å; E948-D951 VanDerWaalsContact O-N 3.16Å; D951-F953 PolarHBondContact O-N 3.01Å; D951-T954 PolarHBondContact O-N 2.88Å; D951-K955 WeakPolarHBondContact O-CG 3.18Å; D951-K955 PolarHBondContact O-N 3.45Å; D951-K955 VanDerWaalsContact OD1-CE 3.3Å; D951-K955 WeakPolarHBondContact OD1-CE 3.22Å; D951-K955 IonicContact OD1-NZ 2.71Å; D951-K955 WeakPolarHBondContact OD2-CE 3.35Å; D951-K955 IonicContact OD2-NZ 3.19Å; D951-K955 PolarHBondContact OD2-NZ 3.47Å
952	L	96.6	Very high	95.3	Very high	35 Å²	35	49.1 Å²	49.1	18%	0.183	26%	0.263	C	S	.	.	H	α-helix	trans	-59.4	-45.2	172.9	-71	176.7	0	0	0	111.8	R798 E948 T954 K955 A956	R798-L952 HydrophobicContact CG-CD1 3.76Å; E948-L952 HydrophobicContact CG-CD1 3.92Å; E948-L952 HydrophobicContact CG-CG 4.27Å; E948-L952 WeakPolarHBondContact O-CB 3.17Å; E948-L952 WeakPolarHBondContact O-CG 3.5Å; E948-L952 PolarHBondContact O-N 3.49Å; L952-T954 PolarHBondContact O-N 3.43Å; L952-K955 WeakPolarHBondContact O-CB 3.31Å; L952-K955 PolarHBondContact O-N 2.98Å; L952-A956 WeakPolarHBondContact O-CB 3.25Å; L952-A956 PolarHBondContact O-N 3.26Å
953	F	97.6	Very high	94.9	Very high	16 Å²	16	54.4 Å²	54.4	7%	0.07	29%	0.288	C	S	.	.	H	α-helix	trans	-60	-45.1	174.4	179.8	-109.7	0	0	0	111.8	I797 S801 A949 D951 K955 A956 V957 P969 F972 F973	I797-F953 HydrophobicContact CG2-CB 3.97Å; I797-F953 HydrophobicContact CG2-CG 4.39Å; S801-F953 VanDerWaalsContact OG-CA 3.23Å; S801-F953 WeakPolarHBondContact OG-CA 3.46Å; S801-F953 PolarHBondContact OG-N 3.39Å; A949-F953 WeakPolarHBondContact O-CB 3.43Å; A949-F953 PolarHBondContact O-N 3.36Å; D951-F953 PolarHBondContact O-N 3.01Å; F953-K955 VanDerWaalsContact C-N 3.26Å; F953-K955 PolarHBondContact O-N 3.47Å; F953-A956 PolarHBondContact O-N 3.32Å; F953-V957 HydrophobicContact CD1-CG2 4.24Å; F953-V957 HydrophobicContact CD2-CG2 4.21Å; F953-V957 HydrophobicContact CE1-CG2 3.78Å; F953-V957 HydrophobicContact CE2-CG2 3.75Å; F953-V957 HydrophobicContact CG-CG2 4.43Å; F953-V957 HydrophobicContact CZ-CG2 3.5Å; F953-V957 VanDerWaalsContact CZ-CG2 3.5Å; F953-V957 WeakPolarHBondContact O-CG2 3.43Å; F953-V957 PolarHBondContact O-N 3.03Å; F953-P969 HydrophobicContact CD1-CG 4.43Å; F953-P969 HydrophobicContact CD2-CB 4.47Å; F953-P969 HydrophobicContact CD2-CG 4.41Å; F953-P969 HydrophobicContact CE1-CG 4.09Å; F953-P969 HydrophobicContact CE2-CB 4Å; F953-P969 HydrophobicContact CE2-CG 4.07Å; F953-P969 HydrophobicContact CZ-CB 4.21Å; F953-P969 HydrophobicContact CZ-CG 3.91Å; F953-F972 HydrophobicContact CD2-CD1 4.36Å; F953-F972 HydrophobicContact CE2-CB 3.91Å; F953-F972 AromaticContact CE2-CD1 3.63Å; F953-F972 HydrophobicContact CE2-CD1 3.63Å; F953-F972 HydrophobicContact CE2-CE1 4.38Å; F953-F972 AromaticContact CE2-CG 3.94Å; F953-F972 HydrophobicContact CE2-CG 3.94Å; F953-F972 HydrophobicContact CZ-CB 4.03Å; F953-F972 HydrophobicContact CZ-CD1 4.48Å; F953-F972 HydrophobicContact CZ-CG 4.36Å; F953-F973 AromaticContact CD2-CE2 3.73Å; F953-F973 HydrophobicContact CD2-CE2 3.73Å; F953-F973 AromaticContact CD2-CZ 3.87Å; F953-F973 HydrophobicContact CD2-CZ 3.87Å; F953-F973 HydrophobicContact CE2-CD2 4.43Å; F953-F973 AromaticContact CE2-CE2 3.85Å; F953-F973 HydrophobicContact CE2-CE2 3.85Å; F953-F973 HydrophobicContact CE2-CZ 4.2Å
954	T	95.8	Very high	94.3	Very high	51 Å²	51	53.9 Å²	53.9	31%	0.313	29%	0.294	S	S	.	.	H	α-helix	trans	-62.4	-33.3	176.8	-61	0	0	0	0	112.3	K950 D951 L952 K958 A964	K950-T954 VanDerWaalsContact O-CB 3.31Å; K950-T954 WeakPolarHBondContact O-CB 3.43Å; K950-T954 PolarHBondContact O-N 3.37Å; K950-T954 PolarHBondContact O-OG1 2.99Å; D951-T954 PolarHBondContact O-N 2.88Å; L952-T954 PolarHBondContact O-N 3.43Å; T954-K958 HydrophobicContact CG2-CD 4.37Å; T954-K958 WeakPolarHBondContact O-CD 3.39Å; T954-K958 VanDerWaalsContact O-CG 3.24Å; T954-K958 WeakPolarHBondContact O-CG 3.32Å; T954-K958 PolarHBondContact O-N 3.25Å; T954-A964 HydrophobicContact CG2-CB 4.33Å
955	K	95.3	Very high	93.7	Very high	101 Å²	101	52.5 Å²	52.5	44%	0.439	30%	0.303	S	S	.	.	H	α-helix	trans	-71.3	-43.7	172.9	-72.8	162.4	174.7	170.6	0	111.7	D951 L952 F953 K958 H959	D951-K955 WeakPolarHBondContact O-CG 3.18Å; D951-K955 PolarHBondContact O-N 3.45Å; D951-K955 VanDerWaalsContact OD1-CE 3.3Å; D951-K955 WeakPolarHBondContact OD1-CE 3.22Å; D951-K955 IonicContact OD1-NZ 2.71Å; D951-K955 WeakPolarHBondContact OD2-CE 3.35Å; D951-K955 IonicContact OD2-NZ 3.19Å; D951-K955 PolarHBondContact OD2-NZ 3.47Å; L952-K955 WeakPolarHBondContact O-CB 3.31Å; L952-K955 PolarHBondContact O-N 2.98Å; F953-K955 VanDerWaalsContact C-N 3.26Å; F953-K955 PolarHBondContact O-N 3.47Å; K955-K958 PolarHBondContact O-N 2.86Å; K955-H959 WeakPolarHBondContact O-CB 3.42Å; K955-H959 PolarHBondContact O-N 2.89Å
956	A	95.6	Very high	93.4	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-61.8	-49.7	177.3	0	0	0	0	0	112	V804 L952 F953 K958 H959 F960 F972	V804-A956 HydrophobicContact CG2-CB 3.81Å; L952-A956 WeakPolarHBondContact O-CB 3.25Å; L952-A956 PolarHBondContact O-N 3.26Å; F953-A956 PolarHBondContact O-N 3.32Å; A956-K958 VanDerWaalsContact C-N 3.29Å; A956-K958 PolarHBondContact O-N 3.36Å; A956-H959 WeakPolarHBondContact O-CB 3.3Å; A956-H959 PolarHBondContact O-N 3.12Å; A956-F960 WeakPolarHBondContact O-CD2 3.34Å; A956-F960 PolarHBondContact O-N 3.46Å; A956-F972 HydrophobicContact CB-CE1 4.17Å; A956-F972 HydrophobicContact CB-CZ 4.22Å
957	V	95.1	Very high	93.2	Very high	2 Å²	2	57.3 Å²	57.3	1%	0.012	32%	0.322	C	S	.	.	H	α-helix	trans	-54	-45.7	176.2	169.1	0	0	0	0	111.5	F953 G961 E962 A964 I967 F972	F953-V957 HydrophobicContact CD1-CG2 4.24Å; F953-V957 HydrophobicContact CD2-CG2 4.21Å; F953-V957 HydrophobicContact CE1-CG2 3.78Å; F953-V957 HydrophobicContact CE2-CG2 3.75Å; F953-V957 HydrophobicContact CG-CG2 4.43Å; F953-V957 HydrophobicContact CZ-CG2 3.5Å; F953-V957 VanDerWaalsContact CZ-CG2 3.5Å; F953-V957 WeakPolarHBondContact O-CG2 3.43Å; F953-V957 PolarHBondContact O-N 3.03Å; V957-G961 PolarHBondContact O-N 3.39Å; V957-E962 HydrophobicContact CG1-CB 4Å; V957-E962 PolarHBondContact O-N 2.79Å; V957-E962 VanDerWaalsContact O-N 3.09Å; V957-A964 HydrophobicContact CG1-CB 4.48Å; V957-I967 HydrophobicContact CB-CG2 4.44Å; V957-I967 HydrophobicContact CG1-CG2 3.64Å; V957-I967 HydrophobicContact CG2-CG2 3.86Å; V957-F972 HydrophobicContact CB-CE2 4.4Å; V957-F972 HydrophobicContact CG2-CD1 4.41Å; V957-F972 HydrophobicContact CG2-CD2 3.87Å; V957-F972 HydrophobicContact CG2-CE1 4.5Å; V957-F972 HydrophobicContact CG2-CE2 3.99Å; V957-F972 HydrophobicContact CG2-CG 4.08Å; V957-F972 HydrophobicContact CG2-CZ 4.3Å
958	K	93.9	Very high	93.1	Very high	129 Å²	129	57.4 Å²	57.4	56%	0.561	31%	0.312	S	S	*	.	H	α-helix	trans	-67.7	-35.8	176.2	-70.4	171.7	-174.5	172.8	0	113.1	T954 K955 A956 F960 G961 A964	T954-K958 HydrophobicContact CG2-CD 4.37Å; T954-K958 WeakPolarHBondContact O-CD 3.39Å; T954-K958 VanDerWaalsContact O-CG 3.24Å; T954-K958 WeakPolarHBondContact O-CG 3.32Å; T954-K958 PolarHBondContact O-N 3.25Å; K955-K958 PolarHBondContact O-N 2.86Å; A956-K958 VanDerWaalsContact C-N 3.29Å; A956-K958 PolarHBondContact O-N 3.36Å; K958-F960 VanDerWaalsContact C-N 3.27Å; K958-F960 PolarHBondContact O-N 3.1Å; K958-G961 PolarHBondContact O-N 3.1Å; K958-G961 VanDerWaalsContact O-N 3.17Å; K958-A964 HydrophobicContact CD-CB 4.42Å; K958-A964 HydrophobicContact CG-CB 4.05Å
959	H	93.3	Very high	93.1	Very high	89 Å²	89	53.4 Å²	53.4	41%	0.412	29%	0.293	S	S	.	.	H	α-helix	trans	-61.6	-36	179.7	-169.4	58	0	0	0	112.2	F805 K955 A956	F805-H959 HydrophobicContact CD2-CB 3.78Å; F805-H959 AromaticContact CD2-CD2 3.83Å; F805-H959 AromaticContact CD2-CG 3.66Å; F805-H959 HydrophobicContact CE2-CB 3.91Å; F805-H959 AromaticContact CE2-CG 3.67Å; F805-H959 AromaticContact CE2-ND1 3.71Å; K955-H959 WeakPolarHBondContact O-CB 3.42Å; K955-H959 PolarHBondContact O-N 2.89Å; A956-H959 WeakPolarHBondContact O-CB 3.3Å; A956-H959 PolarHBondContact O-N 3.12Å
960	F	93.8	Very high	93	Very high	21 Å²	21	55.6 Å²	55.6	9%	0.092	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.7	9.9	177.9	-69.7	-75.1	0	0	0	114.5	V804 L810 L814 I837 A956 K958 E962 F972 F976	V804-F960 HydrophobicContact CB-CE2 3.78Å; V804-F960 HydrophobicContact CB-CZ 4.27Å; V804-F960 HydrophobicContact CG2-CE2 3.87Å; V804-F960 WeakPolarHBondContact O-CE2 3.42Å; V804-F960 VanDerWaalsContact O-CZ 3.28Å; V804-F960 WeakPolarHBondContact O-CZ 3.24Å; L810-F960 HydrophobicContact CD2-CE1 4.04Å; L810-F960 HydrophobicContact CD2-CZ 3.64Å; L810-F960 HydrophobicContact CG-CE1 4.47Å; L810-F960 HydrophobicContact CG-CZ 4.44Å; L814-F960 HydrophobicContact CD1-CD1 4.29Å; L814-F960 HydrophobicContact CD1-CE1 3.71Å; I837-F960 HydrophobicContact CD1-CB 4.31Å; I837-F960 HydrophobicContact CG2-CB 3.77Å; I837-F960 HydrophobicContact CG2-CD1 3.56Å; I837-F960 HydrophobicContact CG2-CE1 4.49Å; I837-F960 HydrophobicContact CG2-CG 3.91Å; A956-F960 WeakPolarHBondContact O-CD2 3.34Å; A956-F960 PolarHBondContact O-N 3.46Å; K958-F960 VanDerWaalsContact C-N 3.27Å; K958-F960 PolarHBondContact O-N 3.1Å; F960-E962 VanDerWaalsContact C-N 3.33Å; F960-E962 PolarHBondContact O-N 2.96Å; F960-F972 HydrophobicContact CB-CE2 4.37Å; F960-F972 AromaticContact CD2-CZ 3.97Å; F960-F972 HydrophobicContact CD2-CZ 3.97Å; F960-F976 HydrophobicContact CD1-CZ 4.17Å; F960-F976 HydrophobicContact CD2-CZ 4.12Å; F960-F976 HydrophobicContact CE1-CZ 4.24Å; F960-F976 HydrophobicContact CE2-CZ 4.19Å; F960-F976 HydrophobicContact CG-CZ 4.11Å; F960-F976 HydrophobicContact CZ-CZ 4.24Å
961	G	90.1	Very high	93.1	Very high	59 Å²	59	58.3 Å²	58.3	61%	0.608	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.9	17.7	173.6	0	0	0	0	0	115.2	V957 K958	V957-G961 PolarHBondContact O-N 3.39Å; K958-G961 PolarHBondContact O-N 3.1Å; K958-G961 VanDerWaalsContact O-N 3.17Å
962	E	92.3	Very high	93.1	Very high	25 Å²	25	54.8 Å²	54.8	12%	0.117	30%	0.3	C	S	.	.			trans	-89.9	154.9	173.7	-68.7	-59.7	157.4	0	0	111.6	K836 I837 V957 F960 A964 I967	K836-E962 WeakPolarHBondContact CB-OE1 3.18Å; K836-E962 WeakPolarHBondContact CG-OE1 3.28Å; K836-E962 IonicContact NZ-OE1 2.75Å; K836-E962 PolarHBondContact NZ-OE1 3.44Å; K836-E962 IonicContact NZ-OE2 2.76Å; K836-E962 PolarHBondContact NZ-OE2 3.17Å; I837-E962 HydrophobicContact CD1-CG 4.32Å; I837-E962 HydrophobicContact CG1-CG 4.12Å; V957-E962 HydrophobicContact CG1-CB 4Å; V957-E962 PolarHBondContact O-N 2.79Å; V957-E962 VanDerWaalsContact O-N 3.09Å; F960-E962 VanDerWaalsContact C-N 3.33Å; F960-E962 PolarHBondContact O-N 2.96Å; E962-A964 PolarHBondContact O-N 2.86Å; E962-I967 HydrophobicContact CB-CG2 4.41Å
963	E	87.3	Confident	93.2	Very high	112 Å²	112	53.1 Å²	53.1	52%	0.523	29%	0.291	S	S	.	.			trans	-78.4	109.4	-173.4	-73	-168.8	-108.5	0	0	111.9	G965 K966	E963-G965 PolarHBondContact O-N 3.22Å; E963-K966 HydrophobicContact CB-CB 4.18Å; E963-K966 HydrophobicContact CB-CD 3.88Å; E963-K966 HydrophobicContact CB-CG 4.18Å; E963-K966 HydrophobicContact CG-CD 4.46Å; E963-K966 PolarHBondContact O-N 3.39Å; E963-K966 IonicContact OE1-NZ 3.61Å; E963-K966 PolarHBondContact OE1-NZ 3.48Å; E963-K966 WeakPolarHBondContact OE2-CE 3.5Å; E963-K966 IonicContact OE2-NZ 2.65Å; E963-K966 PolarHBondContact OE2-NZ 3.3Å
964	A	84	Confident	93.2	Very high	49 Å²	49	52.8 Å²	52.8	41%	0.405	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.5	126.1	178.3	0	0	0	0	0	112.3	T954 V957 K958 E962	T954-A964 HydrophobicContact CG2-CB 4.33Å; V957-A964 HydrophobicContact CG1-CB 4.48Å; K958-A964 HydrophobicContact CD-CB 4.42Å; K958-A964 HydrophobicContact CG-CB 4.05Å; E962-A964 PolarHBondContact O-N 2.86Å
965	G	81.9	Confident	93.3	Very high	73 Å²	73	51.2 Å²	51.2	75%	0.753	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.6	-4.4	-178	0	0	0	0	0	115.4	E963	E963-G965 PolarHBondContact O-N 3.22Å
966	K	89.4	Confident	93.5	Very high	144 Å²	144	46.5 Å²	46.5	63%	0.626	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.1	-34.3	169.1	-70.9	-171.6	-178.9	167.4	0	113.5	E963	E963-K966 HydrophobicContact CB-CB 4.18Å; E963-K966 HydrophobicContact CB-CD 3.88Å; E963-K966 HydrophobicContact CB-CG 4.18Å; E963-K966 HydrophobicContact CG-CD 4.46Å; E963-K966 PolarHBondContact O-N 3.39Å; E963-K966 IonicContact OE1-NZ 3.61Å; E963-K966 PolarHBondContact OE1-NZ 3.48Å; E963-K966 WeakPolarHBondContact OE2-CE 3.5Å; E963-K966 IonicContact OE2-NZ 2.65Å; E963-K966 PolarHBondContact OE2-NZ 3.3Å
967	I	92.7	Very high	93.6	Very high	13 Å²	13	48 Å²	48	7%	0.067	27%	0.269	C	S	.	.	S	Bend	trans	-100.7	143.6	179.6	-162.8	165.4	0	0	0	111.1	V957 E962 E971 F972 I975	V957-I967 HydrophobicContact CB-CG2 4.44Å; V957-I967 HydrophobicContact CG1-CG2 3.64Å; V957-I967 HydrophobicContact CG2-CG2 3.86Å; E962-I967 HydrophobicContact CB-CG2 4.41Å; I967-E971 HydrophobicContact CD1-CB 4.39Å; I967-E971 HydrophobicContact CD1-CG 4.01Å; I967-E971 HydrophobicContact CG1-CB 3.88Å; I967-E971 HydrophobicContact CG1-CG 3.9Å; I967-F972 HydrophobicContact CD1-CB 3.91Å; I967-F972 HydrophobicContact CD1-CD2 4.22Å; I967-F972 HydrophobicContact CG1-CB 3.98Å; I967-F972 HydrophobicContact CG2-CB 4.43Å; I967-F972 HydrophobicContact CG2-CD2 4.41Å; I967-I975 HydrophobicContact CD1-CD1 4.18Å
968	Q	95.3	Very high	93.7	Very high	65 Å²	65	53.1 Å²	53.1	30%	0.304	29%	0.293	S	S	.	.			trans	-103.9	164.6	179.5	-64	-61	-21.5	0	0	111.3	D970 E971 F972	Q968-D970 WeakPolarHBondContact CB-OD1 3.29Å; Q968-D970 PolarHBondContact O-N 3.3Å; Q968-E971 PolarHBondContact O-N 2.88Å; Q968-F972 VanDerWaalsContact O-CB 3.27Å; Q968-F972 WeakPolarHBondContact O-CB 3.36Å; Q968-F972 PolarHBondContact O-N 2.97Å
969	P	95.8	Very high	93.9	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-62.2	-40	-176.5	-21.5	32	0	0	0	113.7	I797 M889 F953 F972 F973	I797-P969 HydrophobicContact CD1-CB 4.44Å; I797-P969 HydrophobicContact CD1-CG 4.13Å; I797-P969 HydrophobicContact CG1-CB 4.19Å; I797-P969 HydrophobicContact CG1-CG 4.34Å; M889-P969 HydrophobicContact CB-CG 4.17Å; M889-P969 HydrophobicContact CE-CG 3.83Å; F953-P969 HydrophobicContact CD1-CG 4.43Å; F953-P969 HydrophobicContact CD2-CB 4.47Å; F953-P969 HydrophobicContact CD2-CG 4.41Å; F953-P969 HydrophobicContact CE1-CG 4.09Å; F953-P969 HydrophobicContact CE2-CB 4Å; F953-P969 HydrophobicContact CE2-CG 4.07Å; F953-P969 HydrophobicContact CZ-CB 4.21Å; F953-P969 HydrophobicContact CZ-CG 3.91Å; P969-F972 PolarHBondContact O-N 2.89Å; P969-F973 HydrophobicContact CB-CD2 3.89Å; P969-F973 HydrophobicContact CB-CE2 4.01Å; P969-F973 VanDerWaalsContact O-CB 3.3Å; P969-F973 WeakPolarHBondContact O-CB 3.32Å; P969-F973 WeakPolarHBondContact O-CD2 3.38Å; P969-F973 PolarHBondContact O-N 2.85Å
970	D	96.1	Very high	94	Very high	47 Å²	47	43.6 Å²	43.6	25%	0.251	25%	0.251	S	S	.	.	H	α-helix	trans	-58.9	-46	175.3	45.3	14.3	0	0	0	112.2	A885 N888 Q968 G974	A885-D970 WeakPolarHBondContact O-CA 3.5Å; N888-D970 PolarHBondContact ND2-OD2 3.36Å; Q968-D970 WeakPolarHBondContact CB-OD1 3.29Å; Q968-D970 PolarHBondContact O-N 3.3Å; D970-G974 VanDerWaalsContact O-CA 3.29Å; D970-G974 WeakPolarHBondContact O-CA 3.07Å; D970-G974 PolarHBondContact O-N 3.03Å
971	E	96.4	Very high	94.1	Very high	119 Å²	119	47.2 Å²	47.2	56%	0.556	27%	0.268	S	S	*	.	H	α-helix	trans	-69.1	-46.8	173.9	-170.3	-178.4	-178.2	0	0	112.7	I967 Q968 G974 I975	I967-E971 HydrophobicContact CD1-CB 4.39Å; I967-E971 HydrophobicContact CD1-CG 4.01Å; I967-E971 HydrophobicContact CG1-CB 3.88Å; I967-E971 HydrophobicContact CG1-CG 3.9Å; Q968-E971 PolarHBondContact O-N 2.88Å; E971-G974 PolarHBondContact O-N 3.43Å; E971-I975 WeakPolarHBondContact O-CG1 3.43Å; E971-I975 PolarHBondContact O-N 3.44Å
972	F	97.8	Very high	94.4	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-67.5	-49.9	-174.7	177.2	-99.1	0	0	0	112.7	V804 I837 F953 A956 V957 F960 I967 Q968 P969 I975 F976	V804-F972 HydrophobicContact CG2-CE1 4.18Å; I837-F972 HydrophobicContact CD1-CD2 3.81Å; I837-F972 HydrophobicContact CD1-CE2 3.59Å; I837-F972 HydrophobicContact CD1-CZ 4.39Å; F953-F972 HydrophobicContact CD2-CD1 4.36Å; F953-F972 HydrophobicContact CE2-CB 3.91Å; F953-F972 AromaticContact CE2-CD1 3.63Å; F953-F972 HydrophobicContact CE2-CD1 3.63Å; F953-F972 HydrophobicContact CE2-CE1 4.38Å; F953-F972 AromaticContact CE2-CG 3.94Å; F953-F972 HydrophobicContact CE2-CG 3.94Å; F953-F972 HydrophobicContact CZ-CB 4.03Å; F953-F972 HydrophobicContact CZ-CD1 4.48Å; F953-F972 HydrophobicContact CZ-CG 4.36Å; A956-F972 HydrophobicContact CB-CE1 4.17Å; A956-F972 HydrophobicContact CB-CZ 4.22Å; V957-F972 HydrophobicContact CB-CE2 4.4Å; V957-F972 HydrophobicContact CG2-CD1 4.41Å; V957-F972 HydrophobicContact CG2-CD2 3.87Å; V957-F972 HydrophobicContact CG2-CE1 4.5Å; V957-F972 HydrophobicContact CG2-CE2 3.99Å; V957-F972 HydrophobicContact CG2-CG 4.08Å; V957-F972 HydrophobicContact CG2-CZ 4.3Å; F960-F972 HydrophobicContact CB-CE2 4.37Å; F960-F972 AromaticContact CD2-CZ 3.97Å; F960-F972 HydrophobicContact CD2-CZ 3.97Å; I967-F972 HydrophobicContact CD1-CB 3.91Å; I967-F972 HydrophobicContact CD1-CD2 4.22Å; I967-F972 HydrophobicContact CG1-CB 3.98Å; I967-F972 HydrophobicContact CG2-CB 4.43Å; I967-F972 HydrophobicContact CG2-CD2 4.41Å; Q968-F972 VanDerWaalsContact O-CB 3.27Å; Q968-F972 WeakPolarHBondContact O-CB 3.36Å; Q968-F972 PolarHBondContact O-N 2.97Å; P969-F972 PolarHBondContact O-N 2.89Å; F972-I975 PolarHBondContact O-N 2.89Å; F972-F976 HydrophobicContact CD1-CE2 4.46Å; F972-F976 AromaticContact CE1-CE2 3.97Å; F972-F976 HydrophobicContact CE1-CE2 3.97Å; F972-F976 HydrophobicContact CE2-CE2 4.22Å; F972-F976 AromaticContact CZ-CE2 3.84Å; F972-F976 HydrophobicContact CZ-CE2 3.84Å; F972-F976 WeakPolarHBondContact O-CD2 3.47Å
973	F	98.3	Very high	94.5	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-74.4	-28.8	175.7	-63.1	-59.3	0	0	0	111.5	G800 V804 I881 A884 A885 F953 P969 I975 F976 D977	G800-F973 VanDerWaalsContact C-CE1 3.49Å; G800-F973 WeakPolarHBondContact O-CE1 3.39Å; V804-F973 HydrophobicContact CG1-CD1 4.4Å; V804-F973 HydrophobicContact CG1-CE1 4.23Å; V804-F973 HydrophobicContact CG2-CE1 4.24Å; I881-F973 HydrophobicContact CD1-CD1 3.85Å; I881-F973 HydrophobicContact CD1-CE1 4.09Å; I881-F973 HydrophobicContact CG2-CB 4.16Å; I881-F973 HydrophobicContact CG2-CD1 4.45Å; A884-F973 HydrophobicContact CB-CB 4.1Å; A884-F973 HydrophobicContact CB-CD1 4.32Å; A884-F973 HydrophobicContact CB-CD2 3.44Å; A884-F973 VanDerWaalsContact CB-CD2 3.44Å; A884-F973 HydrophobicContact CB-CE2 3.87Å; A884-F973 HydrophobicContact CB-CG 3.7Å; A884-F973 HydrophobicContact CB-CZ 4.47Å; A885-F973 HydrophobicContact CB-CB 3.91Å; F953-F973 AromaticContact CD2-CE2 3.73Å; F953-F973 HydrophobicContact CD2-CE2 3.73Å; F953-F973 AromaticContact CD2-CZ 3.87Å; F953-F973 HydrophobicContact CD2-CZ 3.87Å; F953-F973 HydrophobicContact CE2-CD2 4.43Å; F953-F973 AromaticContact CE2-CE2 3.85Å; F953-F973 HydrophobicContact CE2-CE2 3.85Å; F953-F973 HydrophobicContact CE2-CZ 4.2Å; P969-F973 HydrophobicContact CB-CD2 3.89Å; P969-F973 HydrophobicContact CB-CE2 4.01Å; P969-F973 VanDerWaalsContact O-CB 3.3Å; P969-F973 WeakPolarHBondContact O-CB 3.32Å; P969-F973 WeakPolarHBondContact O-CD2 3.38Å; P969-F973 PolarHBondContact O-N 2.85Å; F973-I975 PolarHBondContact O-N 2.97Å; F973-F976 PolarHBondContact O-N 2.79Å; F973-D977 PolarHBondContact O-N 3.26Å
974	G	97.9	Very high	94.8	Very high	10 Å²	10	42.9 Å²	42.9	10%	0.103	25%	0.245	C	C	.	.	H	α-helix	trans	-58.6	-31.8	172.2	0	0	0	0	0	113.9	D970 E971 Q978	D970-G974 VanDerWaalsContact O-CA 3.29Å; D970-G974 WeakPolarHBondContact O-CA 3.07Å; D970-G974 PolarHBondContact O-N 3.03Å; E971-G974 PolarHBondContact O-N 3.43Å; G974-Q978 WeakPolarHBondContact O-CB 3.43Å; G974-Q978 WeakPolarHBondContact O-CG 3.22Å; G974-Q978 PolarHBondContact O-N 2.68Å; G974-Q978 VanDerWaalsContact O-N 3.08Å
975	I	97.8	Very high	95.3	Very high	18 Å²	18	46.8 Å²	46.8	9%	0.092	26%	0.255	C	S	.	.	H	α-helix	trans	-60.3	-45.9	171.1	-69.6	162.5	0	0	0	110.9	I837 N841 I967 E971 F972 F973 F979	I837-I975 HydrophobicContact CB-CG2 4.15Å; I837-I975 HydrophobicContact CD1-CD1 4.07Å; I837-I975 HydrophobicContact CD1-CG2 4.24Å; I837-I975 HydrophobicContact CG1-CD1 4.18Å; I837-I975 HydrophobicContact CG1-CG2 4.17Å; N841-I975 PolarHBondContact ND2-O 2.92Å; N841-I975 PolarHBondContact OD1-O 2.78Å; I967-I975 HydrophobicContact CD1-CD1 4.18Å; E971-I975 WeakPolarHBondContact O-CG1 3.43Å; E971-I975 PolarHBondContact O-N 3.44Å; F972-I975 PolarHBondContact O-N 2.89Å; F973-I975 PolarHBondContact O-N 2.97Å; I975-F979 PolarHBondContact O-N 3.14Å
976	F	97.8	Very high	95.8	Very high	2 Å²	2	43.6 Å²	43.6	1%	0.009	22%	0.221	C	C	.	.	H	α-helix	trans	-75.3	-39.4	-178.9	-66.2	-74.8	0	0	0	112.5	V804 L810 I837 L840 I881 F960 F972 F973 F979 L980	V804-F976 HydrophobicContact CG1-CD2 4.09Å; V804-F976 HydrophobicContact CG1-CE2 4.09Å; V804-F976 HydrophobicContact CG1-CG 4.41Å; V804-F976 HydrophobicContact CG1-CZ 4.41Å; L810-F976 HydrophobicContact CD1-CD1 4.38Å; L810-F976 HydrophobicContact CD1-CE1 4.09Å; L810-F976 HydrophobicContact CD2-CD1 4.29Å; L810-F976 HydrophobicContact CD2-CE1 3.77Å; L810-F976 HydrophobicContact CD2-CZ 4.4Å; I837-F976 HydrophobicContact CB-CZ 4.25Å; I837-F976 HydrophobicContact CD1-CD2 4.43Å; I837-F976 HydrophobicContact CD1-CE2 3.56Å; I837-F976 HydrophobicContact CD1-CZ 3.69Å; I837-F976 HydrophobicContact CG2-CE1 4.22Å; I837-F976 HydrophobicContact CG2-CZ 3.9Å; L840-F976 HydrophobicContact CD1-CD1 4.32Å; L840-F976 HydrophobicContact CD1-CE1 4.26Å; I881-F976 HydrophobicContact CG2-CB 3.74Å; F960-F976 HydrophobicContact CD1-CZ 4.17Å; F960-F976 HydrophobicContact CD2-CZ 4.12Å; F960-F976 HydrophobicContact CE1-CZ 4.24Å; F960-F976 HydrophobicContact CE2-CZ 4.19Å; F960-F976 HydrophobicContact CG-CZ 4.11Å; F960-F976 HydrophobicContact CZ-CZ 4.24Å; F972-F976 HydrophobicContact CD1-CE2 4.46Å; F972-F976 AromaticContact CE1-CE2 3.97Å; F972-F976 HydrophobicContact CE1-CE2 3.97Å; F972-F976 HydrophobicContact CE2-CE2 4.22Å; F972-F976 AromaticContact CZ-CE2 3.84Å; F972-F976 HydrophobicContact CZ-CE2 3.84Å; F972-F976 WeakPolarHBondContact O-CD2 3.47Å; F973-F976 PolarHBondContact O-N 2.79Å; F976-F979 WeakPolarHBondContact O-CB 3.48Å; F976-F979 PolarHBondContact O-N 2.89Å; F976-F979 VanDerWaalsContact O-N 3.12Å; F976-L980 VanDerWaalsContact O-CG 3.29Å; F976-L980 WeakPolarHBondContact O-CG 3.21Å; F976-L980 PolarHBondContact O-N 3.45Å
977	D	98.1	Very high	95.9	Very high	30 Å²	30	40.4 Å²	40.4	16%	0.16	21%	0.207	C	C	.	.	H	α-helix	trans	-60.3	-49.1	176.1	177.9	41.9	0	0	0	111.7	I881 P882 A885 F973 F979 L980 Q981	I881-D977 HydrophobicContact CG2-CB 4.38Å; P882-D977 WeakPolarHBondContact CB-OD1 3.42Å; A885-D977 HydrophobicContact CB-CB 3.98Å; F973-D977 PolarHBondContact O-N 3.26Å; D977-F979 PolarHBondContact O-N 2.9Å; D977-L980 PolarHBondContact O-N 3.1Å; D977-Q981 VanDerWaalsContact O-CG 3.3Å; D977-Q981 WeakPolarHBondContact O-CG 3.28Å; D977-Q981 PolarHBondContact O-N 3.38Å; D977-Q981 PolarHBondContact OD1-NE2 3.5Å; D977-Q981 PolarHBondContact OD2-NE2 2.91Å
978	Q	97.5	Very high	95.9	Very high	110 Å²	110	44.7 Å²	44.7	51%	0.514	23%	0.227	S	C	.	.	H	α-helix	trans	-56.7	-37.8	171.9	-72.9	167.9	25.3	0	0	112.3	N841 G974 A982	N841-Q978 VanDerWaalsContact ND2-CB 3.35Å; N841-Q978 WeakPolarHBondContact ND2-CB 3.23Å; N841-Q978 PolarHBondContact ND2-OE1 2.87Å; N841-Q978 VanDerWaalsContact ND2-OE1 3.07Å; G974-Q978 WeakPolarHBondContact O-CB 3.43Å; G974-Q978 WeakPolarHBondContact O-CG 3.22Å; G974-Q978 PolarHBondContact O-N 2.68Å; G974-Q978 VanDerWaalsContact O-N 3.08Å; Q978-A982 WeakPolarHBondContact O-CB 3.29Å; Q978-A982 PolarHBondContact O-N 3.17Å
979	F	97.3	Very high	95.8	Very high	3 Å²	3	46.5 Å²	46.5	1%	0.013	24%	0.236	C	C	.	.	H	α-helix	trans	-70.1	-42.9	178.5	-175.2	-113.3	0	0	0	112.4	L813 L840 N841 I843 L857 L874 I975 F976 D977 Q981 A982 V983	L813-F979 HydrophobicContact CD2-CE1 3.48Å; L813-F979 VanDerWaalsContact CD2-CE1 3.48Å; L813-F979 HydrophobicContact CD2-CZ 3.8Å; L840-F979 HydrophobicContact CB-CB 4.32Å; L840-F979 HydrophobicContact CB-CD1 4.46Å; L840-F979 HydrophobicContact CB-CD2 3.59Å; L840-F979 HydrophobicContact CB-CE2 3.98Å; L840-F979 HydrophobicContact CB-CG 3.85Å; L840-F979 HydrophobicContact CD1-CD1 4.14Å; L840-F979 HydrophobicContact CD1-CG 4.21Å; L840-F979 HydrophobicContact CD2-CD2 4.49Å; L840-F979 HydrophobicContact CD2-CE1 4.21Å; L840-F979 HydrophobicContact CD2-CE2 4.15Å; L840-F979 HydrophobicContact CD2-CZ 4Å; L840-F979 HydrophobicContact CG-CD2 4.47Å; L840-F979 HydrophobicContact CG-CG 4.47Å; N841-F979 VanDerWaalsContact OD1-CA 3.24Å; N841-F979 WeakPolarHBondContact OD1-CA 3.43Å; N841-F979 WeakPolarHBondContact OD1-CB 3.43Å; N841-F979 PolarHBondContact OD1-N 2.95Å; I843-F979 HydrophobicContact CD1-CE2 4.13Å; L857-F979 HydrophobicContact CD1-CE2 3.8Å; L857-F979 HydrophobicContact CD1-CZ 4.1Å; L874-F979 HydrophobicContact CD2-CE1 4.33Å; I975-F979 PolarHBondContact O-N 3.14Å; F976-F979 WeakPolarHBondContact O-CB 3.48Å; F976-F979 PolarHBondContact O-N 2.89Å; F976-F979 VanDerWaalsContact O-N 3.12Å; D977-F979 PolarHBondContact O-N 2.9Å; F979-Q981 VanDerWaalsContact C-N 3.31Å; F979-Q981 PolarHBondContact O-N 2.83Å; F979-A982 PolarHBondContact O-N 3.13Å; F979-V983 HydrophobicContact CD1-CG2 4.08Å; F979-V983 HydrophobicContact CD2-CG2 4.29Å; F979-V983 HydrophobicContact CE1-CG2 3.57Å; F979-V983 HydrophobicContact CE2-CG2 3.83Å; F979-V983 HydrophobicContact CG-CG2 4.42Å; F979-V983 HydrophobicContact CZ-CG2 3.43Å; F979-V983 VanDerWaalsContact CZ-CG2 3.43Å; F979-V983 WeakPolarHBondContact O-CB 3.21Å; F979-V983 VanDerWaalsContact O-CG2 3.3Å; F979-V983 WeakPolarHBondContact O-CG2 3.4Å; F979-V983 PolarHBondContact O-N 3.12Å
980	L	96.4	Very high	95.6	Very high	16 Å²	16	47.7 Å²	47.7	8%	0.084	24%	0.242	C	C	.	.	H	α-helix	trans	-62.1	-39.6	176.5	-71	167	0	0	0	111.2	L874 N875 L878 I881 F976 D977 V983 S984	L874-L980 HydrophobicContact CD2-CD2 3.99Å; L874-L980 HydrophobicContact CG-CD2 3.94Å; N875-L980 WeakPolarHBondContact OD1-CD2 3.45Å; L878-L980 HydrophobicContact CB-CD1 4.1Å; L878-L980 HydrophobicContact CD1-CD1 4.47Å; L878-L980 HydrophobicContact CD1-CD2 4.24Å; I881-L980 HydrophobicContact CB-CD1 4.27Å; I881-L980 HydrophobicContact CG2-CD1 4.34Å; F976-L980 VanDerWaalsContact O-CG 3.29Å; F976-L980 WeakPolarHBondContact O-CG 3.21Å; F976-L980 PolarHBondContact O-N 3.45Å; D977-L980 PolarHBondContact O-N 3.1Å; L980-V983 PolarHBondContact O-N 3.24Å; L980-S984 WeakPolarHBondContact O-CB 3.34Å; L980-S984 PolarHBondContact O-N 3.44Å
981	Q	96.1	Very high	95.3	Very high	96 Å²	96	47.7 Å²	47.7	45%	0.449	24%	0.24	S	C	.	.	H	α-helix	trans	-61.4	-53.1	172.6	-68.6	167.7	33.5	0	0	111	D977 F979 V983 S984 E985	D977-Q981 VanDerWaalsContact O-CG 3.3Å; D977-Q981 WeakPolarHBondContact O-CG 3.28Å; D977-Q981 PolarHBondContact O-N 3.38Å; D977-Q981 PolarHBondContact OD1-NE2 3.5Å; D977-Q981 PolarHBondContact OD2-NE2 2.91Å; F979-Q981 VanDerWaalsContact C-N 3.31Å; F979-Q981 PolarHBondContact O-N 2.83Å; Q981-V983 VanDerWaalsContact C-N 3.29Å; Q981-V983 PolarHBondContact O-N 2.84Å; Q981-S984 WeakPolarHBondContact O-CB 3.41Å; Q981-S984 PolarHBondContact O-N 3.37Å; Q981-E985 WeakPolarHBondContact O-CG 3.42Å; Q981-E985 PolarHBondContact O-N 3.31Å
982	A	95.7	Very high	95	Very high	26 Å²	26	45.9 Å²	45.9	22%	0.215	24%	0.235	C	C	.	.	H	α-helix	trans	-61.5	-33.7	178.2	0	0	0	0	0	113.5	L857 Q978 F979 A986	L857-A982 HydrophobicContact CD2-CB 3.89Å; Q978-A982 WeakPolarHBondContact O-CB 3.29Å; Q978-A982 PolarHBondContact O-N 3.17Å; F979-A982 PolarHBondContact O-N 3.13Å; A982-A986 VanDerWaalsContact O-CB 3.23Å; A982-A986 WeakPolarHBondContact O-CB 3.48Å; A982-A986 PolarHBondContact O-N 2.84Å
983	V	94.3	Very high	94.5	Very high	17 Å²	17	49.6 Å²	49.6	10%	0.103	25%	0.253	C	S	.	.	H	α-helix	trans	-67.7	-43.2	172.6	165.3	0	0	0	0	111.1	L857 I861 F979 L980 Q981 K987	L857-V983 HydrophobicContact CD1-CG2 4.04Å; I861-V983 HydrophobicContact CD1-CG1 4.23Å; I861-V983 WeakPolarHBondContact CD1-O 3.31Å; I861-V983 HydrophobicContact CG1-CG1 4.49Å; F979-V983 HydrophobicContact CD1-CG2 4.08Å; F979-V983 HydrophobicContact CD2-CG2 4.29Å; F979-V983 HydrophobicContact CE1-CG2 3.57Å; F979-V983 HydrophobicContact CE2-CG2 3.83Å; F979-V983 HydrophobicContact CG-CG2 4.42Å; F979-V983 HydrophobicContact CZ-CG2 3.43Å; F979-V983 VanDerWaalsContact CZ-CG2 3.43Å; F979-V983 WeakPolarHBondContact O-CB 3.21Å; F979-V983 VanDerWaalsContact O-CG2 3.3Å; F979-V983 WeakPolarHBondContact O-CG2 3.4Å; F979-V983 PolarHBondContact O-N 3.12Å; L980-V983 PolarHBondContact O-N 3.24Å; Q981-V983 VanDerWaalsContact C-N 3.29Å; Q981-V983 PolarHBondContact O-N 2.84Å; V983-K987 WeakPolarHBondContact O-CB 3.34Å; V983-K987 PolarHBondContact O-N 3.23Å
984	S	93.4	Very high	94	Very high	63 Å²	63	55.4 Å²	55.4	44%	0.441	28%	0.275	S	S	.	.	H	α-helix	trans	-61.8	-47.6	177.9	-165.7	0	0	0	0	111.6	L980 Q981 K987 Q988	L980-S984 WeakPolarHBondContact O-CB 3.34Å; L980-S984 PolarHBondContact O-N 3.44Å; Q981-S984 WeakPolarHBondContact O-CB 3.41Å; Q981-S984 PolarHBondContact O-N 3.37Å; S984-K987 PolarHBondContact O-N 3.45Å; S984-Q988 PolarHBondContact O-N 3.42Å
985	E	94.3	Very high	93.6	Very high	130 Å²	130	60 Å²	60	61%	0.607	29%	0.292	S	S	*	.	H	α-helix	trans	-61.1	-53.1	176.5	-69.3	177	167.6	0	0	111.5	Q981 K987 Q988 E989	Q981-E985 WeakPolarHBondContact O-CG 3.42Å; Q981-E985 PolarHBondContact O-N 3.31Å; E985-K987 VanDerWaalsContact C-N 3.26Å; E985-K987 PolarHBondContact O-N 3.19Å; E985-Q988 PolarHBondContact O-N 2.8Å; E985-E989 PolarHBondContact O-N 3.22Å
986	A	93.6	Very high	92.9	Very high	6 Å²	6	64.8 Å²	64.8	5%	0.05	31%	0.312	C	S	.	.	H	α-helix	trans	-65.3	-27.3	-179.8	0	0	0	0	0	113.3	L857 H858 I861 A982 N990	L857-A986 HydrophobicContact CD2-CB 4.17Å; L857-A986 HydrophobicContact CG-CB 4.11Å; H858-A986 PolarHBondContact CD2-O 2.6Å; H858-A986 WeakPolarHBondContact NE2-CA 3.3Å; I861-A986 HydrophobicContact CD1-CB 3.63Å; A982-A986 VanDerWaalsContact O-CB 3.23Å; A982-A986 WeakPolarHBondContact O-CB 3.48Å; A982-A986 PolarHBondContact O-N 2.84Å; A986-N990 VanDerWaalsContact O-CB 3.3Å; A986-N990 WeakPolarHBondContact O-CB 3.48Å; A986-N990 VanDerWaalsContact O-CG 3.29Å; A986-N990 PolarHBondContact O-N 2.85Å; A986-N990 PolarHBondContact O-ND2 2.88Å
987	K	91.9	Very high	92.3	Very high	78 Å²	78	70.6 Å²	70.6	34%	0.339	34%	0.337	S	S	.	.	H	α-helix	trans	-70.1	-41.1	171.3	-172.8	176.5	-176.8	179.7	0	111.3	I861 E865 V983 S984 E985 N990 E991	I861-K987 HydrophobicContact CD1-CB 4.42Å; I861-K987 HydrophobicContact CG2-CB 4.22Å; I861-K987 HydrophobicContact CG2-CG 4.23Å; E865-K987 VanDerWaalsContact OE1-CE 3.23Å; E865-K987 WeakPolarHBondContact OE1-CE 3.32Å; V983-K987 WeakPolarHBondContact O-CB 3.34Å; V983-K987 PolarHBondContact O-N 3.23Å; S984-K987 PolarHBondContact O-N 3.45Å; E985-K987 VanDerWaalsContact C-N 3.26Å; E985-K987 PolarHBondContact O-N 3.19Å; K987-N990 PolarHBondContact O-N 3.05Å; K987-E991 WeakPolarHBondContact O-CB 3.33Å; K987-E991 PolarHBondContact O-N 3.45Å
988	Q	92.8	Very high	91.7	Very high	103 Å²	103	73.5 Å²	73.5	48%	0.481	35%	0.35	S	S	.	.	H	α-helix	trans	-68.9	-37.7	175.9	-174.3	54.6	77.8	0	0	112.3	S984 E985 E991 N992	S984-Q988 PolarHBondContact O-N 3.42Å; E985-Q988 PolarHBondContact O-N 2.8Å; Q988-E991 PolarHBondContact O-N 3.15Å; Q988-N992 PolarHBondContact NE2-OD1 2.98Å; Q988-N992 WeakPolarHBondContact O-CB 3.19Å; Q988-N992 PolarHBondContact O-N 3.23Å; Q988-N992 PolarHBondContact O-ND2 2.72Å; Q988-N992 PolarHBondContact O-OD1 3.49Å
989	E	92.2	Very high	90.8	Very high	103 Å²	103	72 Å²	72	48%	0.481	34%	0.343	S	S	.	.	H	α-helix	trans	-66.5	-42.6	172.5	-75.4	-169.3	-173.2	0	0	112.2	H858 E985 E991 N992 M993	H858-E989 IonicContact CE1-OE2 2.85Å; H858-E989 PolarHBondContact CE1-OE2 2.99Å; H858-E989 WeakPolarHBondContact NE2-CB 3.43Å; H858-E989 IonicContact NE2-OE2 3.45Å; H858-E989 PolarHBondContact NE2-OE2 2.88Å; E985-E989 PolarHBondContact O-N 3.22Å; E989-E991 VanDerWaalsContact C-N 3.35Å; E989-E991 PolarHBondContact O-N 3.38Å; E989-N992 PolarHBondContact O-N 2.96Å; E989-M993 WeakPolarHBondContact O-CB 3.36Å; E989-M993 WeakPolarHBondContact O-CG 3.49Å; E989-M993 PolarHBondContact O-N 3.46Å
990	N	91.3	Very high	90	Very high	24 Å²	24	76.8 Å²	76.8	13%	0.128	37%	0.365	C	S	.	.	H	α-helix	trans	-55.8	-46.7	170.6	-87.5	-24.6	0	0	0	112.1	H858 T862 A986 K987 N992 M993 R994	H858-N990 WeakPolarHBondContact CB-OD1 3.14Å; H858-N990 PolarHBondContact CD2-OD1 3.09Å; H858-N990 PolarHBondContact O-ND2 3.16Å; T862-N990 PolarHBondContact OG1-ND2 3.27Å; A986-N990 VanDerWaalsContact O-CB 3.3Å; A986-N990 WeakPolarHBondContact O-CB 3.48Å; A986-N990 VanDerWaalsContact O-CG 3.29Å; A986-N990 PolarHBondContact O-N 2.85Å; A986-N990 PolarHBondContact O-ND2 2.88Å; K987-N990 PolarHBondContact O-N 3.05Å; N990-N992 VanDerWaalsContact C-N 3.33Å; N990-N992 PolarHBondContact O-N 2.74Å; N990-M993 PolarHBondContact O-N 3.29Å; N990-R994 WeakPolarHBondContact O-CB 3.5Å; N990-R994 PolarHBondContact O-N 2.93Å
991	E	90.7	Very high	89.3	Confident	48 Å²	48	79.7 Å²	79.7	22%	0.224	38%	0.378	C	S	.	.	H	α-helix	trans	-62.9	-39.9	178.4	-179.7	62.4	-150	0	0	111.7	K987 Q988 E989 R994 K995	K987-E991 WeakPolarHBondContact O-CB 3.33Å; K987-E991 PolarHBondContact O-N 3.45Å; Q988-E991 PolarHBondContact O-N 3.15Å; E989-E991 VanDerWaalsContact C-N 3.35Å; E989-E991 PolarHBondContact O-N 3.38Å; E991-R994 PolarHBondContact O-N 2.77Å; E991-R994 IonicContact OE1-CZ 3.57Å; E991-R994 IonicContact OE1-NH2 3.68Å; E991-R994 PolarHBondContact OE1-NH2 2.97Å; E991-R994 IonicContact OE2-CZ 3.95Å; E991-R994 IonicContact OE2-NE 2.81Å; E991-R994 IonicContact OE2-NH1 2.67Å; E991-R994 PolarHBondContact OE2-NH1 3.4Å; E991-R994 IonicContact OE2-NH2 2.67Å; E991-R994 PolarHBondContact OE2-NH2 3.28Å; E991-K995 HydrophobicContact CG-CD 4.22Å; E991-K995 VanDerWaalsContact CG-NZ 3.32Å; E991-K995 WeakPolarHBondContact O-CB 3.44Å; E991-K995 WeakPolarHBondContact O-CG 3.37Å; E991-K995 PolarHBondContact O-N 3.47Å; E991-K995 WeakPolarHBondContact OE1-CE 3.45Å; E991-K995 IonicContact OE1-NZ 3.32Å; E991-K995 PolarHBondContact OE1-NZ 2.91Å
992	N	90.4	Very high	88.6	Confident	81 Å²	81	80.8 Å²	80.8	43%	0.433	38%	0.379	S	S	.	.	H	α-helix	trans	-65.8	-43.1	175.9	-68.6	-18.5	0	0	0	111.6	Q988 E989 N990 K995 K996	Q988-N992 PolarHBondContact NE2-OD1 2.98Å; Q988-N992 WeakPolarHBondContact O-CB 3.19Å; Q988-N992 PolarHBondContact O-N 3.23Å; Q988-N992 PolarHBondContact O-ND2 2.72Å; Q988-N992 PolarHBondContact O-OD1 3.49Å; E989-N992 PolarHBondContact O-N 2.96Å; N990-N992 VanDerWaalsContact C-N 3.33Å; N990-N992 PolarHBondContact O-N 2.74Å; N992-K995 PolarHBondContact O-N 2.87Å; N992-K996 WeakPolarHBondContact O-CB 3.44Å; N992-K996 PolarHBondContact O-N 3.4Å
993	M	87.6	Confident	87.8	Confident	78 Å²	78	87 Å²	87	38%	0.384	40%	0.396	S	S	.	.	H	α-helix	trans	-65.7	-37.2	174.6	-72.4	-68.4	-83.6	0	0	112.1	I854 E989 N990 K997	I854-M993 HydrophobicContact CD1-CE 4.47Å; E989-M993 WeakPolarHBondContact O-CB 3.36Å; E989-M993 WeakPolarHBondContact O-CG 3.49Å; E989-M993 PolarHBondContact O-N 3.46Å; N990-M993 PolarHBondContact O-N 3.29Å; M993-K997 WeakPolarHBondContact O-CB 3.49Å; M993-K997 PolarHBondContact O-N 3.12Å
994	R	87.7	Confident	87.1	Confident	122 Å²	122	88.9 Å²	88.9	46%	0.46	41%	0.413	S	S	.	.	H	α-helix	trans	-63.6	-50.3	173.5	-166.5	178.2	82.1	-133.9	-7.8	111.1	N990 E991 K996 K997 E998	N990-R994 WeakPolarHBondContact O-CB 3.5Å; N990-R994 PolarHBondContact O-N 2.93Å; E991-R994 PolarHBondContact O-N 2.77Å; E991-R994 IonicContact OE1-CZ 3.57Å; E991-R994 IonicContact OE1-NH2 3.68Å; E991-R994 PolarHBondContact OE1-NH2 2.97Å; E991-R994 IonicContact OE2-CZ 3.95Å; E991-R994 IonicContact OE2-NE 2.81Å; E991-R994 IonicContact OE2-NH1 2.67Å; E991-R994 PolarHBondContact OE2-NH1 3.4Å; E991-R994 IonicContact OE2-NH2 2.67Å; E991-R994 PolarHBondContact OE2-NH2 3.28Å; R994-K996 VanDerWaalsContact C-N 3.34Å; R994-K996 PolarHBondContact O-N 2.74Å; R994-K997 PolarHBondContact O-N 2.64Å; R994-E998 IonicContact NE-OE1 3.14Å; R994-E998 WeakPolarHBondContact O-CB 3.39Å; R994-E998 WeakPolarHBondContact O-CG 3.4Å; R994-E998 PolarHBondContact O-N 3.06Å
995	K	88.1	Confident	86.3	Confident	107 Å²	107	93.3 Å²	93.3	47%	0.465	42%	0.42	S	S	.	.	H	α-helix	trans	-56.7	-45.2	176.2	-77.2	164.5	173.4	152	0	112.2	E991 N992 E998 E999	E991-K995 HydrophobicContact CG-CD 4.22Å; E991-K995 VanDerWaalsContact CG-NZ 3.32Å; E991-K995 WeakPolarHBondContact O-CB 3.44Å; E991-K995 WeakPolarHBondContact O-CG 3.37Å; E991-K995 PolarHBondContact O-N 3.47Å; E991-K995 WeakPolarHBondContact OE1-CE 3.45Å; E991-K995 IonicContact OE1-NZ 3.32Å; E991-K995 PolarHBondContact OE1-NZ 2.91Å; N992-K995 PolarHBondContact O-N 2.87Å; K995-E998 PolarHBondContact O-N 3.31Å; K995-E999 PolarHBondContact O-N 2.89Å
996	K	84.8	Confident	85.4	Confident	117 Å²	117	92.6 Å²	92.6	51%	0.509	42%	0.419	S	S	.	.	H	α-helix	trans	-62.1	-49.1	176.4	-178.7	178.8	170.8	-175.9	0	111.6	N992 R994 E998 E999 E1000	N992-K996 WeakPolarHBondContact O-CB 3.44Å; N992-K996 PolarHBondContact O-N 3.4Å; R994-K996 VanDerWaalsContact C-N 3.34Å; R994-K996 PolarHBondContact O-N 2.74Å; K996-E998 PolarHBondContact O-N 3.48Å; K996-E999 CarbonylContact O-C 3.57Å; K996-E999 PolarHBondContact O-N 3.05Å; K996-E999 VanDerWaalsContact O-N 3.09Å; K996-E1000 WeakPolarHBondContact CE-OE1 3.31Å; K996-E1000 IonicContact NZ-OE1 3.94Å; K996-E1000 WeakPolarHBondContact O-CG 3.2Å; K996-E1000 PolarHBondContact O-N 2.91Å
997	K	84.6	Confident	84.5	Confident	125 Å²	125	98.9 Å²	98.9	54%	0.543	45%	0.447	S	S	.	.	H	α-helix	trans	-62.4	-41.2	177.4	-175.8	-178.7	174.1	-171.5	0	112.2	M993 R994 E999 E1000 E1001	M993-K997 WeakPolarHBondContact O-CB 3.49Å; M993-K997 PolarHBondContact O-N 3.12Å; R994-K997 PolarHBondContact O-N 2.64Å; K997-E999 VanDerWaalsContact C-N 3.28Å; K997-E999 PolarHBondContact O-N 2.89Å; K997-E1000 PolarHBondContact O-N 3.28Å; K997-E1001 VanDerWaalsContact CE-OE1 3.23Å; K997-E1001 WeakPolarHBondContact CE-OE1 3.2Å; K997-E1001 IonicContact NZ-OE1 3.35Å; K997-E1001 WeakPolarHBondContact O-CB 3.28Å; K997-E1001 PolarHBondContact O-N 3.2Å
998	E	84.4	Confident	83.7	Confident	90 Å²	90	97.9 Å²	97.9	42%	0.421	45%	0.454	S	S	.	.	H	α-helix	trans	-61.9	-35.9	173.1	-78.7	-176.6	-141.7	0	0	112.1	R994 K995 K996 R1002	R994-E998 IonicContact NE-OE1 3.14Å; R994-E998 WeakPolarHBondContact O-CB 3.39Å; R994-E998 WeakPolarHBondContact O-CG 3.4Å; R994-E998 PolarHBondContact O-N 3.06Å; K995-E998 PolarHBondContact O-N 3.31Å; K996-E998 PolarHBondContact O-N 3.48Å; E998-R1002 WeakPolarHBondContact O-CB 3.35Å; E998-R1002 PolarHBondContact O-N 3.37Å; E998-R1002 IonicContact OE2-NH2 3.32Å
999	E	79.8	Confident	82.8	Confident	79 Å²	79	98.4 Å²	98.4	37%	0.369	46%	0.456	S	S	.	.	H	α-helix	trans	-71.6	-41.8	174.5	-161.2	-170.3	152.6	0	0	112.2	K995 K996 K997 R1002 R1003	K995-E999 PolarHBondContact O-N 2.89Å; K996-E999 CarbonylContact O-C 3.57Å; K996-E999 PolarHBondContact O-N 3.05Å; K996-E999 VanDerWaalsContact O-N 3.09Å; K997-E999 VanDerWaalsContact C-N 3.28Å; K997-E999 PolarHBondContact O-N 2.89Å; E999-R1002 CarbonylContact O-C 3.59Å; E999-R1002 WeakPolarHBondContact O-CB 3.45Å; E999-R1002 PolarHBondContact O-N 3.49Å; E999-R1003 HydrophobicContact CG-CG 4.44Å; E999-R1003 WeakPolarHBondContact O-CB 3.37Å; E999-R1003 VanDerWaalsContact O-CG 3.25Å; E999-R1003 WeakPolarHBondContact O-CG 3.42Å; E999-R1003 PolarHBondContact O-N 2.95Å; E999-R1003 IonicContact OE1-CZ 2.85Å; E999-R1003 IonicContact OE1-NE 3.43Å; E999-R1003 PolarHBondContact OE1-NE 3.43Å; E999-R1003 IonicContact OE1-NH2 2.7Å; E999-R1003 PolarHBondContact OE1-NH2 3.13Å
1000	E	79.9	Confident	82.1	Confident	104 Å²	104	97.1 Å²	97.1	49%	0.486	45%	0.452	S	S	.	.	H	α-helix	trans	-62.3	-43.9	174.3	-72.7	171.8	179.1	0	0	111.3	K996 K997 R1002 R1003 A1004	K996-E1000 WeakPolarHBondContact CE-OE1 3.31Å; K996-E1000 IonicContact NZ-OE1 3.94Å; K996-E1000 WeakPolarHBondContact O-CG 3.2Å; K996-E1000 PolarHBondContact O-N 2.91Å; K997-E1000 PolarHBondContact O-N 3.28Å; E1000-R1002 PolarHBondContact O-N 3.33Å; E1000-R1003 PolarHBondContact O-N 2.96Å; E1000-A1004 VanDerWaalsContact O-CB 3.28Å; E1000-A1004 WeakPolarHBondContact O-CB 3.33Å; E1000-A1004 PolarHBondContact O-N 3.37Å
1001	E	81.9	Confident	81.3	Confident	76 Å²	76	103 Å²	103	36%	0.355	48%	0.476	S	S	.	.	H	α-helix	trans	-64	-37.6	171.4	-77.2	-166.5	-143.5	0	0	112.2	K997 R1005	K997-E1001 VanDerWaalsContact CE-OE1 3.23Å; K997-E1001 WeakPolarHBondContact CE-OE1 3.2Å; K997-E1001 IonicContact NZ-OE1 3.35Å; K997-E1001 WeakPolarHBondContact O-CB 3.28Å; K997-E1001 PolarHBondContact O-N 3.2Å; E1001-R1005 WeakPolarHBondContact O-CB 3.46Å; E1001-R1005 WeakPolarHBondContact O-CD 3.29Å; E1001-R1005 WeakPolarHBondContact O-CG 3.48Å; E1001-R1005 PolarHBondContact O-N 3.13Å; E1001-R1005 IonicContact OE2-CZ 3.16Å; E1001-R1005 IonicContact OE2-NE 3.77Å; E1001-R1005 IonicContact OE2-NH2 2.72Å; E1001-R1005 PolarHBondContact OE2-NH2 2.78Å
1002	R	80.9	Confident	80.5	Confident	120 Å²	120	105.1 Å²	105.1	45%	0.453	49%	0.486	S	S	.	.	H	α-helix	trans	-68.2	-41.2	176.7	-172	-174.7	-51.5	119.2	6.9	111.5	E998 E999 E1000 M1006	E998-R1002 WeakPolarHBondContact O-CB 3.35Å; E998-R1002 PolarHBondContact O-N 3.37Å; E998-R1002 IonicContact OE2-NH2 3.32Å; E999-R1002 CarbonylContact O-C 3.59Å; E999-R1002 WeakPolarHBondContact O-CB 3.45Å; E999-R1002 PolarHBondContact O-N 3.49Å; E1000-R1002 PolarHBondContact O-N 3.33Å; R1002-M1006 WeakPolarHBondContact O-CB 3.49Å; R1002-M1006 WeakPolarHBondContact O-CG 3.39Å; R1002-M1006 PolarHBondContact O-N 2.89Å
1003	R	78.8	Confident	79.4	Confident	156 Å²	156	105.5 Å²	105.5	59%	0.589	49%	0.486	S	S	*	.	H	α-helix	trans	-61.7	-51.5	172.4	-73.8	170.7	-180	-142.2	6.1	109.9	E999 E1000 R1005 M1006 E1007	E999-R1003 HydrophobicContact CG-CG 4.44Å; E999-R1003 WeakPolarHBondContact O-CB 3.37Å; E999-R1003 VanDerWaalsContact O-CG 3.25Å; E999-R1003 WeakPolarHBondContact O-CG 3.42Å; E999-R1003 PolarHBondContact O-N 2.95Å; E999-R1003 IonicContact OE1-CZ 2.85Å; E999-R1003 IonicContact OE1-NE 3.43Å; E999-R1003 PolarHBondContact OE1-NE 3.43Å; E999-R1003 IonicContact OE1-NH2 2.7Å; E999-R1003 PolarHBondContact OE1-NH2 3.13Å; E1000-R1003 PolarHBondContact O-N 2.96Å; R1003-R1005 PolarHBondContact O-N 2.89Å; R1003-M1006 CarbonylContact O-C 3.53Å; R1003-M1006 PolarHBondContact O-N 2.79Å; R1003-E1007 WeakPolarHBondContact O-CB 3.35Å; R1003-E1007 PolarHBondContact O-N 2.87Å
1004	A	79.1	Confident	78.5	Confident	56 Å²	56	109.6 Å²	109.6	46%	0.463	50%	0.497	S	S	.	.	H	α-helix	trans	-62.6	-39.8	178.2	0	0	0	0	0	113.1	E1000 E1007 A1008	E1000-A1004 VanDerWaalsContact O-CB 3.28Å; E1000-A1004 WeakPolarHBondContact O-CB 3.33Å; E1000-A1004 PolarHBondContact O-N 3.37Å; A1004-E1007 PolarHBondContact O-N 3.27Å; A1004-A1008 VanDerWaalsContact O-CB 3.24Å; A1004-A1008 WeakPolarHBondContact O-CB 3.48Å; A1004-A1008 PolarHBondContact O-N 2.78Å
1005	R	78.3	Confident	77.5	Confident	156 Å²	156	108.6 Å²	108.6	59%	0.589	50%	0.497	S	S	*	.	H	α-helix	trans	-66.3	-41.1	173.8	-71.3	166.4	-164.4	-148.1	11.6	111.6	E1001 R1003 Q1009	E1001-R1005 WeakPolarHBondContact O-CB 3.46Å; E1001-R1005 WeakPolarHBondContact O-CD 3.29Å; E1001-R1005 WeakPolarHBondContact O-CG 3.48Å; E1001-R1005 PolarHBondContact O-N 3.13Å; E1001-R1005 IonicContact OE2-CZ 3.16Å; E1001-R1005 IonicContact OE2-NE 3.77Å; E1001-R1005 IonicContact OE2-NH2 2.72Å; E1001-R1005 PolarHBondContact OE2-NH2 2.78Å; R1003-R1005 PolarHBondContact O-N 2.89Å; R1005-Q1009 WeakPolarHBondContact O-CB 3.37Å; R1005-Q1009 VanDerWaalsContact O-CG 3.28Å; R1005-Q1009 WeakPolarHBondContact O-CG 3.42Å; R1005-Q1009 PolarHBondContact O-N 2.86Å
1006	M	73.7	Confident	76.4	Confident	116 Å²	116	109.8 Å²	109.8	57%	0.571	50%	0.499	S	S	*	.	H	α-helix	trans	-70.5	-34.8	174.8	-73.4	-151.1	-55.2	0	0	112.6	R1002 R1003 Q1009 L1010	R1002-M1006 WeakPolarHBondContact O-CB 3.49Å; R1002-M1006 WeakPolarHBondContact O-CG 3.39Å; R1002-M1006 PolarHBondContact O-N 2.89Å; R1003-M1006 CarbonylContact O-C 3.53Å; R1003-M1006 PolarHBondContact O-N 2.79Å; M1006-Q1009 PolarHBondContact O-N 2.91Å; M1006-L1010 WeakPolarHBondContact O-CB 3.4Å; M1006-L1010 PolarHBondContact O-N 3.4Å
1007	E	75	Confident	75.1	Confident	137 Å²	137	107.6 Å²	107.6	64%	0.64	49%	0.49	S	S	*	.	H	α-helix	trans	-68.7	-43	174.4	-170.9	-176.9	168.3	0	0	110.9	R1003 A1004 L1010 K1011	R1003-E1007 WeakPolarHBondContact O-CB 3.35Å; R1003-E1007 PolarHBondContact O-N 2.87Å; A1004-E1007 PolarHBondContact O-N 3.27Å; E1007-L1010 PolarHBondContact O-N 2.81Å; E1007-K1011 WeakPolarHBondContact O-CB 3.47Å; E1007-K1011 PolarHBondContact O-N 3.1Å
1008	A	76.6	Confident	73.8	Confident	58 Å²	58	110.4 Å²	110.4	48%	0.479	50%	0.498	S	S	.	.	H	α-helix	trans	-60.4	-46.2	172.6	0	0	0	0	0	111.4	A1004 K1011 E1012	A1004-A1008 VanDerWaalsContact O-CB 3.24Å; A1004-A1008 WeakPolarHBondContact O-CB 3.48Å; A1004-A1008 PolarHBondContact O-N 2.78Å; A1008-K1011 PolarHBondContact O-N 3.1Å; A1008-E1012 VanDerWaalsContact O-CB 3.3Å; A1008-E1012 WeakPolarHBondContact O-CB 3.48Å; A1008-E1012 PolarHBondContact O-N 3.13Å
1009	Q	73.8	Confident	72.5	Confident	114 Å²	114	112.3 Å²	112.3	53%	0.533	50%	0.504	S	S	.	.	H	α-helix	trans	-63.4	-39.5	174.2	-76.4	178.8	5.2	0	0	112.4	R1005 M1006 Q1013	R1005-Q1009 WeakPolarHBondContact O-CB 3.37Å; R1005-Q1009 VanDerWaalsContact O-CG 3.28Å; R1005-Q1009 WeakPolarHBondContact O-CG 3.42Å; R1005-Q1009 PolarHBondContact O-N 2.86Å; M1006-Q1009 PolarHBondContact O-N 2.91Å; Q1009-Q1013 WeakPolarHBondContact O-CA 3.27Å; Q1009-Q1013 WeakPolarHBondContact O-CB 3.49Å; Q1009-Q1013 PolarHBondContact O-N 3.2Å
1010	L	75.8	Confident	71.1	Confident	75 Å²	75	114.2 Å²	114.2	39%	0.393	52%	0.515	S	S	.	.	H	α-helix	trans	-72	-32.4	178.2	-174.7	64.5	0	0	0	111.7	M1006 E1007 R1014	M1006-L1010 WeakPolarHBondContact O-CB 3.4Å; M1006-L1010 PolarHBondContact O-N 3.4Å; E1007-L1010 PolarHBondContact O-N 2.81Å; L1010-R1014 WeakPolarHBondContact O-CB 3.49Å; L1010-R1014 WeakPolarHBondContact O-CD 3.05Å; L1010-R1014 WeakPolarHBondContact O-CG 3.33Å; L1010-R1014 PolarHBondContact O-N 3.41Å
1011	K	74.5	Confident	69.6	Low	148 Å²	148	117.5 Å²	117.5	64%	0.643	52%	0.523	S	S	*	.	H	α-helix	trans	-69.7	-46.6	173.7	-173.7	174.4	-177.4	175.5	0	110.6	E1007 A1008 R1014 E1015	E1007-K1011 WeakPolarHBondContact O-CB 3.47Å; E1007-K1011 PolarHBondContact O-N 3.1Å; A1008-K1011 PolarHBondContact O-N 3.1Å; K1011-R1014 PolarHBondContact O-N 3.42Å; K1011-E1015 WeakPolarHBondContact O-CB 3.33Å; K1011-E1015 PolarHBondContact O-N 3.07Å
1012	E	75.3	Confident	67.9	Low	92 Å²	92	121.6 Å²	121.6	43%	0.43	54%	0.539	S	S	.	.	H	α-helix	trans	-65.7	-38.6	174.5	-162.3	-163.9	-159.8	0	0	111.6	A1008 E1015 R1016	A1008-E1012 VanDerWaalsContact O-CB 3.3Å; A1008-E1012 WeakPolarHBondContact O-CB 3.48Å; A1008-E1012 PolarHBondContact O-N 3.13Å; E1012-E1015 PolarHBondContact O-N 3.39Å; E1012-R1016 WeakPolarHBondContact O-CG 3.25Å; E1012-R1016 PolarHBondContact O-N 3.37Å; E1012-R1016 IonicContact OE1-CZ 2.93Å; E1012-R1016 IonicContact OE1-NH1 3.17Å; E1012-R1016 PolarHBondContact OE1-NH1 2.64Å; E1012-R1016 IonicContact OE1-NH2 2.7Å; E1012-R1016 PolarHBondContact OE1-NH2 3.36Å; E1012-R1016 IonicContact OE2-CZ 2.61Å; E1012-R1016 IonicContact OE2-NH1 2.59Å; E1012-R1016 PolarHBondContact OE2-NH1 3Å; E1012-R1016 IonicContact OE2-NH2 3.43Å; E1012-R1016 PolarHBondContact OE2-NH2 2.98Å
1013	Q	67	Low	66.3	Low	90 Å²	90	120.1 Å²	120.1	42%	0.421	55%	0.553	S	S	.	*	H	α-helix	trans	-65	-47.9	172.7	177.6	173.9	-14.7	0	0	111.1	Q1009 E1015 R1016 E1017	Q1009-Q1013 WeakPolarHBondContact O-CA 3.27Å; Q1009-Q1013 WeakPolarHBondContact O-CB 3.49Å; Q1009-Q1013 PolarHBondContact O-N 3.2Å; Q1013-E1015 PolarHBondContact O-N 3.46Å; Q1013-R1016 CarbonylContact O-C 3.57Å; Q1013-R1016 PolarHBondContact O-N 2.89Å; Q1013-E1017 HydrophobicContact CG-CG 4.28Å; Q1013-E1017 VanDerWaalsContact CG-OE1 3.25Å; Q1013-E1017 WeakPolarHBondContact CG-OE1 3.32Å; Q1013-E1017 PolarHBondContact NE2-OE1 3.09Å; Q1013-E1017 VanDerWaalsContact O-CB 3.32Å; Q1013-E1017 WeakPolarHBondContact O-CB 3.34Å; Q1013-E1017 WeakPolarHBondContact O-CG 3.26Å; Q1013-E1017 PolarHBondContact O-N 3.3Å
1014	R	68.6	Low	64.6	Low	164 Å²	164	121.2 Å²	121.2	62%	0.619	56%	0.562	S	S	*	*	H	α-helix	trans	-59.5	-32.3	173.2	-78	169.3	177.8	-175.8	0.2	111.9	L1010 K1011 R1018	L1010-R1014 WeakPolarHBondContact O-CB 3.49Å; L1010-R1014 WeakPolarHBondContact O-CD 3.05Å; L1010-R1014 WeakPolarHBondContact O-CG 3.33Å; L1010-R1014 PolarHBondContact O-N 3.41Å; K1011-R1014 PolarHBondContact O-N 3.42Å; R1014-R1018 WeakPolarHBondContact O-CB 3.17Å; R1014-R1018 PolarHBondContact O-N 2.79Å
1015	E	66.3	Low	62.4	Low	100 Å²	100	125.6 Å²	125.6	47%	0.467	57%	0.573	S	S	.	*	H	α-helix	trans	-75	-40.1	175.5	-155.6	-172.2	133.2	0	0	112.3	K1011 E1012 Q1013 R1018 K1019	K1011-E1015 WeakPolarHBondContact O-CB 3.33Å; K1011-E1015 PolarHBondContact O-N 3.07Å; E1012-E1015 PolarHBondContact O-N 3.39Å; Q1013-E1015 PolarHBondContact O-N 3.46Å; E1015-R1018 PolarHBondContact O-N 2.88Å; E1015-K1019 WeakPolarHBondContact O-CB 3.2Å; E1015-K1019 VanDerWaalsContact O-CG 3.26Å; E1015-K1019 WeakPolarHBondContact O-CG 3.21Å; E1015-K1019 PolarHBondContact O-N 3.36Å; E1015-K1019 VanDerWaalsContact OE1-CE 3.25Å; E1015-K1019 WeakPolarHBondContact OE1-CE 3.36Å; E1015-K1019 IonicContact OE1-NZ 3.6Å; E1015-K1019 PolarHBondContact OE1-NZ 3.03Å
1016	R	66.1	Low	60.2	Low	132 Å²	132	125.9 Å²	125.9	50%	0.498	59%	0.586	S	S	.	*	H	α-helix	trans	-62.5	-43.9	169.8	-74.2	-174.8	-178.2	102.8	9.7	111.5	E1012 Q1013 K1019 M1020	E1012-R1016 WeakPolarHBondContact O-CG 3.25Å; E1012-R1016 PolarHBondContact O-N 3.37Å; E1012-R1016 IonicContact OE1-CZ 2.93Å; E1012-R1016 IonicContact OE1-NH1 3.17Å; E1012-R1016 PolarHBondContact OE1-NH1 2.64Å; E1012-R1016 IonicContact OE1-NH2 2.7Å; E1012-R1016 PolarHBondContact OE1-NH2 3.36Å; E1012-R1016 IonicContact OE2-CZ 2.61Å; E1012-R1016 IonicContact OE2-NH1 2.59Å; E1012-R1016 PolarHBondContact OE2-NH1 3Å; E1012-R1016 IonicContact OE2-NH2 3.43Å; E1012-R1016 PolarHBondContact OE2-NH2 2.98Å; Q1013-R1016 CarbonylContact O-C 3.57Å; Q1013-R1016 PolarHBondContact O-N 2.89Å; R1016-K1019 CarbonylContact O-C 3.59Å; R1016-K1019 PolarHBondContact O-N 3.21Å; R1016-M1020 HydrophobicContact CB-CE 4.26Å; R1016-M1020 WeakPolarHBondContact O-CB 3.43Å; R1016-M1020 WeakPolarHBondContact O-CG 3.48Å; R1016-M1020 PolarHBondContact O-N 3.45Å
1017	E	56.9	Low	58	Low	71 Å²	71	124.9 Å²	124.9	33%	0.332	59%	0.591	S	S	.	*	H	α-helix	trans	-66.5	-36.9	175.7	-74.9	173.3	-170.8	0	0	111.7	Q1013 K1019 M1020 R1021	Q1013-E1017 HydrophobicContact CG-CG 4.28Å; Q1013-E1017 VanDerWaalsContact CG-OE1 3.25Å; Q1013-E1017 WeakPolarHBondContact CG-OE1 3.32Å; Q1013-E1017 PolarHBondContact NE2-OE1 3.09Å; Q1013-E1017 VanDerWaalsContact O-CB 3.32Å; Q1013-E1017 WeakPolarHBondContact O-CB 3.34Å; Q1013-E1017 WeakPolarHBondContact O-CG 3.26Å; Q1013-E1017 PolarHBondContact O-N 3.3Å; E1017-K1019 VanDerWaalsContact C-N 3.35Å; E1017-M1020 HydrophobicContact CG-CE 4.43Å; E1017-M1020 PolarHBondContact O-N 3.43Å; E1017-R1021 VanDerWaalsContact O-CB 3.25Å; E1017-R1021 WeakPolarHBondContact O-CB 3.32Å; E1017-R1021 VanDerWaalsContact O-CG 3.26Å; E1017-R1021 WeakPolarHBondContact O-CG 3.21Å; E1017-R1021 PolarHBondContact O-N 3.21Å
1018	R	56.3	Low	56	Low	185 Å²	185	127.3 Å²	127.3	70%	0.698	60%	0.602	S	S	*	*	H	α-helix	trans	-66.5	-36.1	172.3	-173.3	177.3	-176.9	-168.5	0.7	111.9	R1014 E1015 K1022	R1014-R1018 WeakPolarHBondContact O-CB 3.17Å; R1014-R1018 PolarHBondContact O-N 2.79Å; E1015-R1018 PolarHBondContact O-N 2.88Å; R1018-K1022 WeakPolarHBondContact O-CB 3.45Å; R1018-K1022 PolarHBondContact O-N 2.96Å; R1018-K1022 VanDerWaalsContact O-N 3.15Å
1019	K	57.4	Low	54.2	Low	130 Å²	130	133.4 Å²	133.4	57%	0.565	62%	0.621	S	S	*	*	H	α-helix	trans	-70.9	-36.8	173.6	-71.7	167.2	-173.8	171.6	0	112.2	E1015 R1016 E1017 A1023	E1015-K1019 WeakPolarHBondContact O-CB 3.2Å; E1015-K1019 VanDerWaalsContact O-CG 3.26Å; E1015-K1019 WeakPolarHBondContact O-CG 3.21Å; E1015-K1019 PolarHBondContact O-N 3.36Å; E1015-K1019 VanDerWaalsContact OE1-CE 3.25Å; E1015-K1019 WeakPolarHBondContact OE1-CE 3.36Å; E1015-K1019 IonicContact OE1-NZ 3.6Å; E1015-K1019 PolarHBondContact OE1-NZ 3.03Å; R1016-K1019 CarbonylContact O-C 3.59Å; R1016-K1019 PolarHBondContact O-N 3.21Å; E1017-K1019 VanDerWaalsContact C-N 3.35Å; K1019-A1023 PolarHBondContact O-N 2.85Å
1020	M	49.8	Very low	52.3	Low	118 Å²	118	131.8 Å²	131.8	58%	0.581	62%	0.621	S	S	*	*	H	α-helix	trans	-76.3	-37.3	175.2	-73.5	-174.6	-70.9	0	0	113.2	R1016 E1017 A1023 K1024	R1016-M1020 HydrophobicContact CB-CE 4.26Å; R1016-M1020 WeakPolarHBondContact O-CB 3.43Å; R1016-M1020 WeakPolarHBondContact O-CG 3.48Å; R1016-M1020 PolarHBondContact O-N 3.45Å; E1017-M1020 HydrophobicContact CG-CE 4.43Å; E1017-M1020 PolarHBondContact O-N 3.43Å; M1020-A1023 CarbonylContact O-C 3.19Å; M1020-A1023 WeakPolarHBondContact O-CA 3.43Å; M1020-A1023 PolarHBondContact O-N 3.31Å; M1020-K1024 WeakPolarHBondContact O-CB 3.48Å; M1020-K1024 PolarHBondContact O-N 3.49Å; M1020-K1024 VanDerWaalsContact O-N 3.13Å
1021	R	49.7	Very low	51.1	Low	174 Å²	174	129.3 Å²	129.3	66%	0.657	61%	0.614	S	S	*	*	H	α-helix	trans	-61.6	-46.5	173	-78.1	178.9	179.1	-137.2	-2.5	110.4	E1017 A1023 K1024 E1025	E1017-R1021 VanDerWaalsContact O-CB 3.25Å; E1017-R1021 WeakPolarHBondContact O-CB 3.32Å; E1017-R1021 VanDerWaalsContact O-CG 3.26Å; E1017-R1021 WeakPolarHBondContact O-CG 3.21Å; E1017-R1021 PolarHBondContact O-N 3.21Å; R1021-A1023 PolarHBondContact O-N 3.18Å; R1021-K1024 CarbonylContact O-C 3.44Å; R1021-K1024 PolarHBondContact O-N 3.07Å; R1021-E1025 WeakPolarHBondContact O-CB 3.45Å; R1021-E1025 PolarHBondContact O-N 2.72Å
1022	K	46.8	Very low	50.8	Low	161 Å²	161	126.9 Å²	126.9	70%	0.7	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.9	-15.3	169.9	-85.4	-161.5	164.2	-153	0	115.5	R1018	R1018-K1022 WeakPolarHBondContact O-CB 3.45Å; R1018-K1022 PolarHBondContact O-N 2.96Å; R1018-K1022 VanDerWaalsContact O-N 3.15Å
1023	A	46.3	Very low	51.1	Low	90 Å²	90	122.5 Å²	122.5	74%	0.744	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.5	3.4	174.7	0	0	0	0	0	113.3	K1019 M1020 R1021	K1019-A1023 PolarHBondContact O-N 2.85Å; M1020-A1023 CarbonylContact O-C 3.19Å; M1020-A1023 WeakPolarHBondContact O-CA 3.43Å; M1020-A1023 PolarHBondContact O-N 3.31Å; R1021-A1023 PolarHBondContact O-N 3.18Å
1024	K	42.5	Very low	51.9	Low	179 Å²	179	120.1 Å²	120.1	78%	0.778	58%	0.575	S	S	*	*	T	Hydrogen-bonded Turn	trans	-135.6	2.5	-177.7	-146	-172.8	-180	-164.3	0	113.7	M1020 R1021 N1026	M1020-K1024 WeakPolarHBondContact O-CB 3.48Å; M1020-K1024 PolarHBondContact O-N 3.49Å; M1020-K1024 VanDerWaalsContact O-N 3.13Å; R1021-K1024 CarbonylContact O-C 3.44Å; R1021-K1024 PolarHBondContact O-N 3.07Å; K1024-N1026 PolarHBondContact O-N 3.16Å
1025	E	34.1	Very low	52.6	Low	147 Å²	147	115.9 Å²	115.9	69%	0.687	57%	0.565	S	S	*	*			trans	-74.2	42.8	179.6	-128	149.3	-140	0	0	112	R1021	R1021-E1025 WeakPolarHBondContact O-CB 3.45Å; R1021-E1025 PolarHBondContact O-N 2.72Å
1026	N	32.7	Very low	53.5	Low	162 Å²	162	113.9 Å²	113.9	87%	0.866	56%	0.556	S	S	*	*			trans	-154.7	47.1	-171.6	-147.7	28	0	0	0	112.6	K1024	K1024-N1026 PolarHBondContact O-N 3.16Å
1027	S	27.1	Very low	54.5	Low	96 Å²	96	107.7 Å²	107.7	67%	0.671	53%	0.533	S	S	*	.	S	Bend	trans	-161.7	116.9	167	-164.9	0	0	0	0	111.6
1028	E	32.9	Very low	56	Low	187 Å²	187	107.4 Å²	107.4	87%	0.874	54%	0.54	S	S	*	.			trans	59.6	123	155.5	-61.7	176.1	150.1	0	0	119.6
1029	E	37.8	Very low	57.5	Low	187 Å²	187	100 Å²	100	87%	0.874	52%	0.518	S	S	*	.			trans	-91.5	139.5	173.2	-66	172.5	120.5	0	0	111.4
1030	S	33.5	Very low	59	Low	79 Å²	79	94 Å²	94	55%	0.552	49%	0.492	S	S	*	.			trans	-135.4	155.6	169.3	173.3	0	0	0	0	108.5	D1035	S1030-D1035 WeakPolarHBondContact CB-OD1 3.42Å; S1030-D1035 PolarHBondContact OG-OD1 3.01Å
1031	G	50.7	Low	60.8	Low	23 Å²	23	94.5 Å²	94.5	24%	0.237	49%	0.487	C	S	.	.			trans	-80.2	145.5	-169.2	0	0	0	0	0	113.7	N190 F1033 D1034 D1035	N190-G1031 WeakPolarHBondContact OD1-CA 3.39Å; N190-G1031 PolarHBondContact OD1-O 3.12Å; G1031-F1033 PolarHBondContact O-N 3.14Å; G1031-D1034 PolarHBondContact O-N 2.79Å; G1031-D1035 WeakPolarHBondContact O-CB 3.4Å; G1031-D1035 PolarHBondContact O-N 3.46Å
1032	E	69.6	Low	62.5	Low	98 Å²	98	87.5 Å²	87.5	46%	0.458	47%	0.465	S	S	.	.	H	α-helix	trans	-53	-30.4	-169.8	-59.6	-175.3	131.3	0	0	115.4	R195 L1036	R195-E1032 IonicContact CZ-OE2 3.6Å; R195-E1032 IonicContact NH1-OE2 3.85Å; R195-E1032 PolarHBondContact NH1-OE2 3.33Å; R195-E1032 VanDerWaalsContact NH1-OE2 3.11Å; R195-E1032 IonicContact NH2-OE2 2.65Å; R195-E1032 PolarHBondContact NH2-OE2 3.01Å; E1032-L1036 WeakPolarHBondContact O-CG 3.13Å; E1032-L1036 PolarHBondContact O-N 3.1Å
1033	F	81.9	Confident	64.2	Low	0 Å²	0	79.9 Å²	79.9	0%	0	43%	0.433	C	S	.	.	H	α-helix	trans	-93.9	-38.6	-176.3	-167.5	-105.5	0	0	0	112.9	M189 N190 A229 V230 V233 G1031 D1035 L1036 V1037	M189-F1033 HydrophobicContact CB-CD1 3.72Å; M189-F1033 HydrophobicContact CB-CE1 3.76Å; M189-F1033 HydrophobicContact CB-CG 4.22Å; M189-F1033 HydrophobicContact CB-CZ 4.28Å; M189-F1033 HydrophobicContact CE-CE1 4.08Å; M189-F1033 HydrophobicContact CE-CE2 3.9Å; M189-F1033 HydrophobicContact CE-CZ 3.51Å; M189-F1033 WeakPolarHBondContact O-CB 3.43Å; M189-F1033 WeakPolarHBondContact O-CG 3.32Å; M189-F1033 HydrophobicContact SD-CE1 4.16Å; M189-F1033 HydrophobicContact SD-CZ 4.15Å; N190-F1033 HydrophobicContact CB-CB 4.48Å; N190-F1033 PolarHBondContact OD1-N 2.83Å; N190-F1033 VanDerWaalsContact OD1-N 3.11Å; A229-F1033 HydrophobicContact CB-CD2 4.38Å; A229-F1033 HydrophobicContact CB-CE1 4.29Å; A229-F1033 HydrophobicContact CB-CE2 3.61Å; A229-F1033 HydrophobicContact CB-CZ 3.54Å; V230-F1033 HydrophobicContact CG2-CZ 4.38Å; V233-F1033 HydrophobicContact CG2-CE2 4.43Å; G1031-F1033 PolarHBondContact O-N 3.14Å; F1033-D1035 PolarHBondContact O-N 3.22Å; F1033-L1036 HydrophobicContact CD2-CD1 4.29Å; F1033-L1036 PolarHBondContact O-N 3.42Å; F1033-V1037 HydrophobicContact CD1-CG2 4.35Å; F1033-V1037 HydrophobicContact CE1-CG2 4.17Å; F1033-V1037 WeakPolarHBondContact O-CG2 3.29Å; F1033-V1037 PolarHBondContact O-N 3.14Å
1034	D	82.9	Confident	65.9	Low	39 Å²	39	81.5 Å²	81.5	21%	0.209	43%	0.425	C	S	.	.	H	α-helix	trans	-63.6	-31.4	169.7	-98.1	-31.8	0	0	0	110.4	K186 N190 G1031 V1037 S1038	K186-D1034 WeakPolarHBondContact CE-OD1 3.42Å; K186-D1034 IonicContact NZ-OD1 2.74Å; K186-D1034 PolarHBondContact NZ-OD1 3.34Å; K186-D1034 VanDerWaalsContact NZ-OD1 3.12Å; N190-D1034 PolarHBondContact OD1-N 2.89Å; G1031-D1034 PolarHBondContact O-N 2.79Å; D1034-V1037 PolarHBondContact O-N 2.92Å; D1034-S1038 VanDerWaalsContact O-CB 3.23Å; D1034-S1038 WeakPolarHBondContact O-CB 3.25Å; D1034-S1038 PolarHBondContact O-N 2.65Å
1035	D	84.1	Confident	67.8	Low	76 Å²	76	74.9 Å²	74.9	41%	0.406	40%	0.399	S	S	.	.	H	α-helix	trans	-65.8	-44.9	170.7	-83	21.4	0	0	0	112.7	S1030 G1031 F1033 V1037 S1038 A1039	S1030-D1035 WeakPolarHBondContact CB-OD1 3.42Å; S1030-D1035 PolarHBondContact OG-OD1 3.01Å; G1031-D1035 WeakPolarHBondContact O-CB 3.4Å; G1031-D1035 PolarHBondContact O-N 3.46Å; F1033-D1035 PolarHBondContact O-N 3.22Å; D1035-V1037 VanDerWaalsContact C-N 3.33Å; D1035-V1037 PolarHBondContact O-N 3.1Å; D1035-S1038 PolarHBondContact O-N 2.62Å; D1035-A1039 WeakPolarHBondContact O-CB 3.37Å; D1035-A1039 PolarHBondContact O-N 3.11Å
1036	L	85.5	Confident	70.1	Confident	57 Å²	57	68.1 Å²	68.1	30%	0.298	37%	0.367	S	S	.	.	H	α-helix	trans	-58.4	-44.6	172.2	-79	169.7	0	0	0	111.4	L232 E1032 F1033 L1040	L232-L1036 HydrophobicContact CB-CD2 4.35Å; L232-L1036 HydrophobicContact CD2-CD2 4.22Å; E1032-L1036 WeakPolarHBondContact O-CG 3.13Å; E1032-L1036 PolarHBondContact O-N 3.1Å; F1033-L1036 HydrophobicContact CD2-CD1 4.29Å; F1033-L1036 PolarHBondContact O-N 3.42Å; L1036-L1040 WeakPolarHBondContact O-CB 3.34Å; L1036-L1040 PolarHBondContact O-N 3.43Å
1037	V	86.6	Confident	71.9	Confident	2 Å²	2	62.9 Å²	62.9	1%	0.012	34%	0.339	C	S	.	.	H	α-helix	trans	-65.4	-39.2	176.4	174.6	0	0	0	0	111.4	E225 A229 F1033 D1034 D1035 L1040 R1041	E225-V1037 HydrophobicContact CB-CG1 3.72Å; E225-V1037 HydrophobicContact CG-CG1 3.67Å; E225-V1037 VanDerWaalsContact OE2-CG1 3.3Å; E225-V1037 WeakPolarHBondContact OE2-CG1 3.43Å; A229-V1037 HydrophobicContact CB-CG2 3.52Å; F1033-V1037 HydrophobicContact CD1-CG2 4.35Å; F1033-V1037 HydrophobicContact CE1-CG2 4.17Å; F1033-V1037 WeakPolarHBondContact O-CG2 3.29Å; F1033-V1037 PolarHBondContact O-N 3.14Å; D1034-V1037 PolarHBondContact O-N 2.92Å; D1035-V1037 VanDerWaalsContact C-N 3.33Å; D1035-V1037 PolarHBondContact O-N 3.1Å; V1037-L1040 PolarHBondContact O-N 2.85Å; V1037-R1041 VanDerWaalsContact O-CB 3.31Å; V1037-R1041 WeakPolarHBondContact O-CB 3.27Å; V1037-R1041 PolarHBondContact O-N 3.45Å
1038	S	88.8	Confident	73.7	Confident	66 Å²	66	66.3 Å²	66.3	46%	0.462	34%	0.342	S	S	.	.	H	α-helix	trans	-64.2	-51.5	179.1	-169	0	0	0	0	111.4	D1034 D1035 L1040 R1041 S1042	D1034-S1038 VanDerWaalsContact O-CB 3.23Å; D1034-S1038 WeakPolarHBondContact O-CB 3.25Å; D1034-S1038 PolarHBondContact O-N 2.65Å; D1035-S1038 PolarHBondContact O-N 2.62Å; S1038-L1040 VanDerWaalsContact C-N 3.28Å; S1038-L1040 PolarHBondContact O-N 3.4Å; S1038-R1041 PolarHBondContact O-N 3.22Å; S1038-R1041 VanDerWaalsContact O-N 3.15Å; S1038-S1042 PolarHBondContact O-N 2.93Å; S1038-S1042 PolarHBondContact O-OG 3.03Å
1039	A	86.9	Confident	75	Confident	30 Å²	30	59.7 Å²	59.7	25%	0.248	31%	0.313	C	S	.	.	H	α-helix	trans	-65.7	-30	177.6	0	0	0	0	0	112.8	D1035 S1042 G1043 E1044 V1045	D1035-A1039 WeakPolarHBondContact O-CB 3.37Å; D1035-A1039 PolarHBondContact O-N 3.11Å; A1039-S1042 PolarHBondContact O-OG 3.46Å; A1039-G1043 CarbonylContact O-C 3.39Å; A1039-G1043 PolarHBondContact O-N 2.94Å; A1039-E1044 HydrophobicContact CB-CB 4.4Å; A1039-E1044 PolarHBondContact O-N 3.36Å; A1039-V1045 HydrophobicContact CB-CG2 3.98Å; A1039-V1045 PolarHBondContact O-N 3.32Å
1040	L	88.5	Confident	76	Confident	4 Å²	4	50.9 Å²	50.9	2%	0.021	27%	0.272	C	S	.	.	H	α-helix	trans	-72.2	-39.2	172.5	180	60.4	0	0	0	111.6	L232 S283 A287 H331 L1036 V1037 S1038 G1043 V1045 F1046	L232-L1040 HydrophobicContact CD1-CD1 4.48Å; L232-L1040 HydrophobicContact CD1-CD2 4.03Å; S283-L1040 WeakPolarHBondContact OG-CD1 3.18Å; S283-L1040 VanDerWaalsContact OG-CG 3.29Å; S283-L1040 WeakPolarHBondContact OG-CG 3.48Å; S283-L1040 PolarHBondContact OG-O 3.01Å; A287-L1040 HydrophobicContact CB-CD1 4.18Å; H331-L1040 PolarHBondContact CE1-O 3.32Å; H331-L1040 VanDerWaalsContact CE1-O 3.22Å; H331-L1040 PolarHBondContact NE2-O 3.48Å; L1036-L1040 WeakPolarHBondContact O-CB 3.34Å; L1036-L1040 PolarHBondContact O-N 3.43Å; V1037-L1040 PolarHBondContact O-N 2.85Å; S1038-L1040 VanDerWaalsContact C-N 3.28Å; S1038-L1040 PolarHBondContact O-N 3.4Å; L1040-G1043 PolarHBondContact O-N 2.6Å; L1040-V1045 HydrophobicContact CB-CG2 4.37Å; L1040-F1046 HydrophobicContact CD1-CE2 3.84Å; L1040-F1046 HydrophobicContact CD1-CZ 3.71Å
1041	R	88	Confident	77	Confident	127 Å²	127	49.7 Å²	49.7	48%	0.479	26%	0.264	S	S	.	.	H	α-helix	trans	-71.9	-29.7	176.8	-162.8	-158	-73.9	147.5	-6.6	112.8	E225 T327 V1037 S1038	E225-R1041 IonicContact OE1-CZ 2.61Å; E225-R1041 IonicContact OE1-NE 3.34Å; E225-R1041 PolarHBondContact OE1-NE 3.29Å; E225-R1041 IonicContact OE1-NH2 3.11Å; E225-R1041 PolarHBondContact OE1-NH2 3.38Å; E225-R1041 IonicContact OE2-NH2 2.67Å; E225-R1041 PolarHBondContact OE2-NH2 3.49Å; T327-R1041 WeakPolarHBondContact CG2-O 3.38Å; V1037-R1041 VanDerWaalsContact O-CB 3.31Å; V1037-R1041 WeakPolarHBondContact O-CB 3.27Å; V1037-R1041 PolarHBondContact O-N 3.45Å; S1038-R1041 PolarHBondContact O-N 3.22Å; S1038-R1041 VanDerWaalsContact O-N 3.15Å
1042	S	86.4	Confident	77.3	Confident	28 Å²	28	53.9 Å²	53.9	20%	0.196	28%	0.275	C	S	.	.	H	α-helix	trans	-84.2	-17.3	175.2	69	0	0	0	0	113.7	R330 S1038 A1039 E1044	R330-S1042 WeakPolarHBondContact CD-O 3.26Å; S1038-S1042 PolarHBondContact O-N 2.93Å; S1038-S1042 PolarHBondContact O-OG 3.03Å; A1039-S1042 PolarHBondContact O-OG 3.46Å; S1042-E1044 VanDerWaalsContact C-N 3.32Å; S1042-E1044 VanDerWaalsContact CB-OE1 3.27Å; S1042-E1044 WeakPolarHBondContact CB-OE1 3.39Å; S1042-E1044 WeakPolarHBondContact OG-CB 3.43Å; S1042-E1044 VanDerWaalsContact OG-CD 3.26Å; S1042-E1044 VanDerWaalsContact OG-CG 3.29Å; S1042-E1044 WeakPolarHBondContact OG-CG 3.39Å; S1042-E1044 PolarHBondContact OG-N 3.23Å; S1042-E1044 PolarHBondContact OG-OE1 3.24Å
1043	G	82.5	Confident	76.1	Confident	1 Å²	1	51.1 Å²	51.1	1%	0.01	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	81.4	5.1	-173.8	0	0	0	0	0	114.3	A1039 L1040 V1045 F1046 D1047	A1039-G1043 CarbonylContact O-C 3.39Å; A1039-G1043 PolarHBondContact O-N 2.94Å; L1040-G1043 PolarHBondContact O-N 2.6Å; G1043-V1045 PolarHBondContact O-N 3.23Å; G1043-F1046 WeakPolarHBondContact O-CB 3.35Å; G1043-F1046 PolarHBondContact O-N 3.46Å; G1043-D1047 PolarHBondContact O-N 3.09Å
1044	E	82	Confident	74.5	Confident	124 Å²	124	56.5 Å²	56.5	58%	0.579	29%	0.287	S	S	*	.	G	3₁₀ helix	trans	-61.3	-28.1	179.1	-79.1	166.8	-109.4	0	0	113.3	A1039 S1042 F1046 D1047	A1039-E1044 HydrophobicContact CB-CB 4.4Å; A1039-E1044 PolarHBondContact O-N 3.36Å; S1042-E1044 VanDerWaalsContact C-N 3.32Å; S1042-E1044 VanDerWaalsContact CB-OE1 3.27Å; S1042-E1044 WeakPolarHBondContact CB-OE1 3.39Å; S1042-E1044 WeakPolarHBondContact OG-CB 3.43Å; S1042-E1044 VanDerWaalsContact OG-CD 3.26Å; S1042-E1044 VanDerWaalsContact OG-CG 3.29Å; S1042-E1044 WeakPolarHBondContact OG-CG 3.39Å; S1042-E1044 PolarHBondContact OG-N 3.23Å; S1042-E1044 PolarHBondContact OG-OE1 3.24Å; E1044-F1046 PolarHBondContact O-N 3.36Å; E1044-F1046 VanDerWaalsContact O-N 3.15Å; E1044-D1047 PolarHBondContact O-N 3.08Å
1045	V	81.8	Confident	73	Confident	40 Å²	40	62.9 Å²	62.9	24%	0.242	31%	0.308	C	S	.	.	G	3₁₀ helix	trans	-49.3	-36.9	168.4	170	0	0	0	0	111.6	L232 A1039 L1040 G1043	L232-V1045 HydrophobicContact CD2-CG1 3.84Å; L232-V1045 HydrophobicContact CD2-CG2 4.05Å; A1039-V1045 HydrophobicContact CB-CG2 3.98Å; A1039-V1045 PolarHBondContact O-N 3.32Å; L1040-V1045 HydrophobicContact CB-CG2 4.37Å; G1043-V1045 PolarHBondContact O-N 3.23Å
1046	F	81.3	Confident	70.8	Confident	4 Å²	4	63 Å²	63	2%	0.018	31%	0.309	C	S	.	.	G	3₁₀ helix	trans	-101	-4.9	-171.9	-49.6	-57.9	0	0	0	113.8	N286 S290 H331 F334 L1040 G1043 E1044 K1048 D1049 L1050	N286-F1046 HydrophobicContact CB-CE2 4.14Å; N286-F1046 HydrophobicContact CB-CZ 3.96Å; S290-F1046 WeakPolarHBondContact OG-CE1 3.18Å; H331-F1046 AromaticContact CE1-CE2 3.79Å; H331-F1046 AromaticContact ND1-CD2 3.95Å; H331-F1046 AromaticContact ND1-CE2 3.8Å; F334-F1046 HydrophobicContact CD1-CB 4.26Å; F334-F1046 AromaticContact CD1-CD1 3.98Å; F334-F1046 HydrophobicContact CD1-CD1 3.98Å; F334-F1046 HydrophobicContact CD1-CD2 4.29Å; F334-F1046 HydrophobicContact CD1-CE1 4.43Å; F334-F1046 AromaticContact CD1-CG 3.91Å; F334-F1046 HydrophobicContact CD1-CG 3.91Å; F334-F1046 HydrophobicContact CD2-CB 3.66Å; F334-F1046 HydrophobicContact CD2-CD1 4.43Å; F334-F1046 HydrophobicContact CD2-CG 4.18Å; F334-F1046 HydrophobicContact CE1-CB 4.42Å; F334-F1046 AromaticContact CE1-CD1 3.48Å; F334-F1046 HydrophobicContact CE1-CD1 3.48Å; F334-F1046 VanDerWaalsContact CE1-CD1 3.48Å; F334-F1046 AromaticContact CE1-CE1 3.81Å; F334-F1046 HydrophobicContact CE1-CE1 3.81Å; F334-F1046 AromaticContact CE1-CG 3.91Å; F334-F1046 HydrophobicContact CE1-CG 3.91Å; F334-F1046 HydrophobicContact CE1-CZ 4.48Å; F334-F1046 HydrophobicContact CE2-CB 3.83Å; F334-F1046 AromaticContact CE2-CD1 3.99Å; F334-F1046 HydrophobicContact CE2-CD1 3.99Å; F334-F1046 HydrophobicContact CE2-CG 4.17Å; F334-F1046 HydrophobicContact CG-CB 3.89Å; F334-F1046 HydrophobicContact CG-CD1 4.43Å; F334-F1046 HydrophobicContact CG-CG 4.05Å; F334-F1046 HydrophobicContact CZ-CB 4.22Å; F334-F1046 AromaticContact CZ-CD1 3.48Å; F334-F1046 HydrophobicContact CZ-CD1 3.48Å; F334-F1046 VanDerWaalsContact CZ-CD1 3.48Å; F334-F1046 HydrophobicContact CZ-CE1 4.13Å; F334-F1046 HydrophobicContact CZ-CG 4.04Å; L1040-F1046 HydrophobicContact CD1-CE2 3.84Å; L1040-F1046 HydrophobicContact CD1-CZ 3.71Å; G1043-F1046 WeakPolarHBondContact O-CB 3.35Å; G1043-F1046 PolarHBondContact O-N 3.46Å; E1044-F1046 PolarHBondContact O-N 3.36Å; E1044-F1046 VanDerWaalsContact O-N 3.15Å; F1046-K1048 PolarHBondContact O-N 3.26Å; F1046-D1049 PolarHBondContact O-N 2.77Å; F1046-L1050 HydrophobicContact CB-CD1 4.3Å; F1046-L1050 PolarHBondContact O-N 2.85Å; F1046-L1050 VanDerWaalsContact O-N 3.12Å
1047	D	70.8	Confident	68.8	Low	52 Å²	52	67.4 Å²	67.4	28%	0.278	32%	0.321	S	S	.	.	H	α-helix	trans	-69.4	-19.8	-171.7	-113.3	-24	0	0	0	113.4	R330 G1043 E1044 D1049 S1051	R330-D1047 IonicContact NE-OD2 2.82Å; G1043-D1047 PolarHBondContact O-N 3.09Å; E1044-D1047 PolarHBondContact O-N 3.08Å; D1047-D1049 PolarHBondContact O-N 3.01Å; D1047-S1051 VanDerWaalsContact O-CB 3.24Å; D1047-S1051 WeakPolarHBondContact O-CB 3.49Å; D1047-S1051 PolarHBondContact O-N 3.11Å; D1047-S1051 PolarHBondContact O-OG 2.93Å
1048	K	64.9	Low	66.6	Low	168 Å²	168	75.3 Å²	75.3	73%	0.73	36%	0.355	S	S	*	.	H	α-helix	trans	-63.9	-22.7	171.4	-73.4	174.1	-175	157.1	0	113.4	F1046 S1051	F1046-K1048 PolarHBondContact O-N 3.26Å; K1048-S1051 PolarHBondContact O-OG 3.08Å
1049	D	60.2	Low	64.3	Low	48 Å²	48	81.1 Å²	81.1	26%	0.257	37%	0.367	S	S	.	.	H	α-helix	trans	-104.1	-39	-179.7	-58.2	-61.4	0	0	0	110.5	F334 M337 F1046 D1047 S1051 K1052 L1053	F334-D1049 HydrophobicContact CE2-CB 4.14Å; M337-D1049 HydrophobicContact CE-CB 4.24Å; M337-D1049 HydrophobicContact SD-CB 4.04Å; F1046-D1049 PolarHBondContact O-N 2.77Å; D1047-D1049 PolarHBondContact O-N 3.01Å; D1049-S1051 PolarHBondContact O-N 3.08Å; D1049-K1052 WeakPolarHBondContact O-CA 3.19Å; D1049-K1052 VanDerWaalsContact O-CB 3.28Å; D1049-K1052 WeakPolarHBondContact O-CB 3.26Å; D1049-K1052 PolarHBondContact O-N 3.1Å; D1049-K1052 WeakPolarHBondContact OD1-CE 3.47Å; D1049-K1052 IonicContact OD1-NZ 2.69Å; D1049-K1052 PolarHBondContact OD1-NZ 3.04Å; D1049-L1053 PolarHBondContact O-N 2.87Å; D1049-L1053 VanDerWaalsContact O-N 3.1Å
1050	L	59.7	Low	62	Low	2 Å²	2	84 Å²	84	1%	0.01	38%	0.377	C	S	.	.	H	α-helix	trans	-58	-32	171	-70.4	160.8	0	0	0	112.3	D333 F334 M337 F1046 L1053 K1054	D333-L1050 HydrophobicContact CB-CD2 3.89Å; F334-L1050 HydrophobicContact CB-CD2 4.14Å; F334-L1050 HydrophobicContact CB-CG 4.43Å; F334-L1050 HydrophobicContact CD2-CG 4.43Å; M337-L1050 VanDerWaalsContact CE-CA 3.47Å; M337-L1050 HydrophobicContact CE-CB 4.18Å; M337-L1050 HydrophobicContact CE-CD2 3.55Å; M337-L1050 HydrophobicContact CE-CG 3.73Å; F1046-L1050 HydrophobicContact CB-CD1 4.3Å; F1046-L1050 PolarHBondContact O-N 2.85Å; F1046-L1050 VanDerWaalsContact O-N 3.12Å; L1050-L1053 PolarHBondContact O-N 3.27Å; L1050-K1054 WeakPolarHBondContact O-CG 3.19Å; L1050-K1054 PolarHBondContact O-N 2.65Å
1051	S	54.4	Low	59.4	Low	55 Å²	55	88.1 Å²	88.1	39%	0.385	40%	0.403	S	S	.	.	H	α-helix	trans	-73.5	-23	173.5	56.3	0	0	0	0	114.3	D1047 K1048 D1049 R1055	D1047-S1051 VanDerWaalsContact O-CB 3.24Å; D1047-S1051 WeakPolarHBondContact O-CB 3.49Å; D1047-S1051 PolarHBondContact O-N 3.11Å; D1047-S1051 PolarHBondContact O-OG 2.93Å; K1048-S1051 PolarHBondContact O-OG 3.08Å; D1049-S1051 PolarHBondContact O-N 3.08Å; S1051-R1055 WeakPolarHBondContact O-CG 3.37Å; S1051-R1055 PolarHBondContact O-N 2.59Å
1052	K	56.4	Low	56.9	Low	110 Å²	110	88.2 Å²	88.2	48%	0.478	41%	0.413	S	S	.	.	H	α-helix	trans	-70.4	-49.9	167.4	-57.3	169.8	-174	168.7	0	109.9	D1049 K1054 R1055 N1056	D1049-K1052 WeakPolarHBondContact O-CA 3.19Å; D1049-K1052 VanDerWaalsContact O-CB 3.28Å; D1049-K1052 WeakPolarHBondContact O-CB 3.26Å; D1049-K1052 PolarHBondContact O-N 3.1Å; D1049-K1052 WeakPolarHBondContact OD1-CE 3.47Å; D1049-K1052 IonicContact OD1-NZ 2.69Å; D1049-K1052 PolarHBondContact OD1-NZ 3.04Å; K1052-K1054 PolarHBondContact O-N 2.66Å; K1052-R1055 WeakPolarHBondContact O-CB 3.49Å; K1052-R1055 PolarHBondContact O-N 3.32Å; K1052-R1055 VanDerWaalsContact O-N 3.07Å; K1052-N1056 PolarHBondContact O-N 3.4Å
1053	L	44	Very low	54.5	Low	40 Å²	40	94 Å²	94	21%	0.209	44%	0.437	C	S	.	.	H	α-helix	trans	-55.9	-47.7	178.1	-179.5	69	0	0	0	111.8	M337 D1049 L1050 R1055 N1056 R1057	M337-L1053 HydrophobicContact CB-CD2 4.06Å; M337-L1053 HydrophobicContact CE-CB 4.16Å; M337-L1053 HydrophobicContact CE-CD2 4.36Å; M337-L1053 HydrophobicContact CG-CB 4.12Å; M337-L1053 HydrophobicContact CG-CD1 4.21Å; M337-L1053 HydrophobicContact CG-CD2 4.1Å; M337-L1053 HydrophobicContact CG-CG 4.36Å; M337-L1053 HydrophobicContact SD-CB 4.3Å; D1049-L1053 PolarHBondContact O-N 2.87Å; D1049-L1053 VanDerWaalsContact O-N 3.1Å; L1050-L1053 PolarHBondContact O-N 3.27Å; L1053-R1055 PolarHBondContact O-N 3.4Å; L1053-N1056 PolarHBondContact O-N 3.24Å; L1053-R1057 PolarHBondContact O-N 3.43Å
1054	K	49.4	Very low	52.1	Low	113 Å²	113	100.9 Å²	100.9	49%	0.491	47%	0.471	S	S	.	.	H	α-helix	trans	-63.1	-24.7	179.8	-75.3	169.8	-179.1	167	0	113.4	L1050 K1052	L1050-K1054 WeakPolarHBondContact O-CG 3.19Å; L1050-K1054 PolarHBondContact O-N 2.65Å; K1052-K1054 PolarHBondContact O-N 2.66Å
1055	R	50.3	Low	49.8	Very low	173 Å²	173	100.2 Å²	100.2	65%	0.653	48%	0.475	S	S	*	.	H	α-helix	trans	-77.3	-40.2	170.1	-71.5	173.1	175.7	176.6	0.2	112.1	S1051 K1052 L1053 R1059	S1051-R1055 WeakPolarHBondContact O-CG 3.37Å; S1051-R1055 PolarHBondContact O-N 2.59Å; K1052-R1055 WeakPolarHBondContact O-CB 3.49Å; K1052-R1055 PolarHBondContact O-N 3.32Å; K1052-R1055 VanDerWaalsContact O-N 3.07Å; L1053-R1055 PolarHBondContact O-N 3.4Å; R1055-R1059 PolarHBondContact O-N 3.18Å
1056	N	39.2	Very low	47.5	Very low	79 Å²	79	105.4 Å²	105.4	42%	0.422	50%	0.501	S	S	.	.	H	α-helix	trans	-69.9	-42.9	177.7	-75.3	-14.2	0	0	0	112.8	K1052 L1053 K1058 R1059 I1060	K1052-N1056 PolarHBondContact O-N 3.4Å; L1053-N1056 PolarHBondContact O-N 3.24Å; N1056-K1058 PolarHBondContact O-N 3.02Å; N1056-R1059 WeakPolarHBondContact O-CB 3.47Å; N1056-R1059 PolarHBondContact O-N 3.31Å; N1056-I1060 PolarHBondContact O-N 2.69Å
1057	R	42.8	Very low	45	Very low	149 Å²	149	110.4 Å²	110.4	56%	0.562	54%	0.537	S	S	*	.	H	α-helix	trans	-57.7	-39.1	177.9	-144.6	172.2	-169.1	168.5	4.4	111.1	L1053 R1059 I1060 T1061	L1053-R1057 PolarHBondContact O-N 3.43Å; R1057-R1059 VanDerWaalsContact C-N 3.32Å; R1057-R1059 PolarHBondContact O-N 3.19Å; R1057-I1060 PolarHBondContact O-N 2.99Å; R1057-T1061 PolarHBondContact O-N 2.79Å; R1057-T1061 PolarHBondContact O-OG1 2.64Å; R1057-T1061 VanDerWaalsContact O-OG1 3.08Å
1058	K	40.8	Very low	43.1	Very low	168 Å²	168	112.8 Å²	112.8	73%	0.73	56%	0.558	S	S	*	*	H	α-helix	trans	-66.3	-21.4	173.1	-100.2	-171.8	173.5	-175.1	0	115.4	N1056	N1056-K1058 PolarHBondContact O-N 3.02Å
1059	R	39.2	Very low	41.6	Very low	188 Å²	188	116.4 Å²	116.4	71%	0.709	57%	0.567	S	S	*	*	H	α-helix	trans	-78.3	-42.4	170.2	-87.3	179.9	160	-176.6	-8.7	111.5	R1055 N1056 R1057 T1061 N1062 Q1063	R1055-R1059 PolarHBondContact O-N 3.18Å; N1056-R1059 WeakPolarHBondContact O-CB 3.47Å; N1056-R1059 PolarHBondContact O-N 3.31Å; R1057-R1059 VanDerWaalsContact C-N 3.32Å; R1057-R1059 PolarHBondContact O-N 3.19Å; R1059-T1061 PolarHBondContact O-N 2.86Å; R1059-N1062 PolarHBondContact O-N 2.64Å; R1059-N1062 VanDerWaalsContact O-N 3.15Å; R1059-Q1063 PolarHBondContact O-N 2.67Å
1060	I	39.2	Very low	40	Very low	90 Å²	90	123.7 Å²	123.7	46%	0.462	60%	0.599	S	S	.	*	H	α-helix	trans	-63.5	-40.5	-177.9	-63	167.2	0	0	0	111.2	N1056 R1057 N1062 Q1063 M1064	N1056-I1060 PolarHBondContact O-N 2.69Å; R1057-I1060 PolarHBondContact O-N 2.99Å; I1060-N1062 PolarHBondContact O-N 2.74Å; I1060-Q1063 PolarHBondContact O-N 2.87Å; I1060-M1064 HydrophobicContact CG2-CG 4.36Å; I1060-M1064 HydrophobicContact CG2-SD 4.22Å; I1060-M1064 PolarHBondContact O-N 3.1Å; I1060-M1064 VanDerWaalsContact O-N 3.13Å
1061	T	33.6	Very low	38.5	Very low	91 Å²	91	134.4 Å²	134.4	56%	0.558	64%	0.64	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.9	-30.3	176.3	-45	0	0	0	0	113.1	R1057 R1059	R1057-T1061 PolarHBondContact O-N 2.79Å; R1057-T1061 PolarHBondContact O-OG1 2.64Å; R1057-T1061 VanDerWaalsContact O-OG1 3.08Å; R1059-T1061 PolarHBondContact O-N 2.86Å
1062	N	35.6	Very low	37.3	Very low	129 Å²	129	137.7 Å²	137.7	69%	0.69	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.1	-3.7	176.7	-79.5	29.1	0	0	0	114	R1059 I1060	R1059-N1062 PolarHBondContact O-N 2.64Å; R1059-N1062 VanDerWaalsContact O-N 3.15Å; I1060-N1062 PolarHBondContact O-N 2.74Å
1063	Q	36.4	Very low	35.9	Very low	149 Å²	149	140.5 Å²	140.5	70%	0.696	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.7	-24.4	172	-71.2	-176	-58	0	0	112.4	R1059 I1060 T1065	R1059-Q1063 PolarHBondContact O-N 2.67Å; I1060-Q1063 PolarHBondContact O-N 2.87Å; Q1063-T1065 VanDerWaalsContact C-N 3.27Å; Q1063-T1065 PolarHBondContact O-N 2.73Å
1064	M	31.6	Very low	35.2	Very low	147 Å²	147	144.1 Å²	144.1	72%	0.724	70%	0.702	S	S	*	*	G	3₁₀ helix	trans	-78.3	-2.7	179.7	-71.6	-169	133.7	0	0	115	I1060 D1066	I1060-M1064 HydrophobicContact CG2-CG 4.36Å; I1060-M1064 HydrophobicContact CG2-SD 4.22Å; I1060-M1064 PolarHBondContact O-N 3.1Å; I1060-M1064 VanDerWaalsContact O-N 3.13Å; M1064-D1066 VanDerWaalsContact C-N 3.3Å; M1064-D1066 PolarHBondContact O-N 3.41Å
1065	T	33.9	Very low	34.4	Very low	109 Å²	109	147.9 Å²	147.9	67%	0.669	72%	0.719	S	S	*	*	G	3₁₀ helix	trans	-75.5	-14.8	176.1	45.7	0	0	0	0	114.2	Q1063	Q1063-T1065 VanDerWaalsContact C-N 3.27Å; Q1063-T1065 PolarHBondContact O-N 2.73Å
1066	D	32.8	Very low	33.4	Very low	149 Å²	149	147.8 Å²	147.8	80%	0.797	73%	0.73	S	S	*	*	G	3₁₀ helix	trans	-120.3	23.5	-169.3	-130.5	-8.8	0	0	0	113.8	M1064	M1064-D1066 VanDerWaalsContact C-N 3.3Å; M1064-D1066 PolarHBondContact O-N 3.41Å
1067	S	30.5	Very low	32.7	Very low	109 Å²	109	150.3 Å²	150.3	76%	0.762	74%	0.743	S	S	*	*			trans	-146.8	56.5	176	-70.7	0	0	0	0	111.7	R1069	S1067-R1069 PolarHBondContact O-N 3.38Å
1068	S	29.5	Very low	32.1	Very low	103 Å²	103	156.7 Å²	156.7	72%	0.72	78%	0.776	S	S	*	*			trans	-94.8	64.9	-173.7	49.7	0	0	0	0	113.5
1069	R	34	Very low	31.7	Very low	243 Å²	243	156.1 Å²	156.1	92%	0.917	78%	0.778	S	S	*	*			trans	-170.4	86.1	161	-109	160.2	-167.7	177.7	4.9	113.9	S1067	S1067-R1069 PolarHBondContact O-N 3.38Å
1070	E	27.5	Very low	31.3	Very low	201 Å²	201	154.4 Å²	154.4	94%	0.939	78%	0.782	S	S	*	*			trans	-144.9	155.8	148.5	-131.5	166.4	-146.4	0	0	110.5
1071	R	27.3	Very low	30.9	Very low	227 Å²	227	158 Å²	158	86%	0.857	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-90.9	144.9	-168.2	-68.6	179.2	178.8	167.9	-0.1	111.2	I1073	R1071-I1073 PolarHBondContact O-N 3.17Å; R1071-I1073 VanDerWaalsContact O-N 3.15Å
1072	P	29	Very low	30.7	Very low	125 Å²	125	161.9 Å²	161.9	81%	0.812	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-65.1	116.5	173.2	27.9	-33.7	0	0	0	109.9
1073	I	27.9	Very low	30.4	Very low	168 Å²	168	164 Å²	164	86%	0.862	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-68.4	135.7	169.5	-69.4	171.9	0	0	0	108.3	R1071	R1071-I1073 PolarHBondContact O-N 3.17Å; R1071-I1073 VanDerWaalsContact O-N 3.15Å
1074	T	28.9	Very low	30	Very low	116 Å²	116	165 Å²	165	71%	0.712	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-69.3	146.9	-170	43.9	0	0	0	0	113.2	L1076	T1074-L1076 PolarHBondContact O-N 3.29Å
1075	K	32.7	Very low	29.9	Very low	193 Å²	193	166.3 Å²	166.3	84%	0.839	84%	0.837	S	S	*	*	P	Polyproline II helix	trans	-48.3	133	160.7	-61.8	-179.8	177.5	-174.7	0	110
1076	L	28.3	Very low	29.6	Very low	170 Å²	170	170.7 Å²	170.7	89%	0.89	85%	0.85	S	S	*	*			trans	-110.1	144.3	157.3	-81.6	166.8	0	0	0	108.1	T1074	T1074-L1076 PolarHBondContact O-N 3.29Å
1077	N	25.4	Very low	29.3	Very low	132 Å²	132	172.5 Å²	172.5	71%	0.706	86%	0.855	S	S	*	*			trans	-99.3	140	-171.3	-60.5	-49.8	0	0	0	111.1
1078	F	30.9	Very low	29.2	Very low	283 Å²	283	178.3 Å²	178.3	100%	1.241	86%	0.863	S	S	*	*			trans	64.1	0	168.1	-57.9	-68.1	0	0	0	116.9

Retrieved 1,078 of 1,078 residues in 191 ms (Link to these results)

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