A0A3Q0KDX8_SCHMA Loading...

Ubiquitin conjugation factor E4 A

Ubiquitin-protein ligase that probably functions as an E3 ligase in conjunction with specific E1 and E2 ligases. May also function as an E4 ligase mediating the assembly of polyubiquitin chains on substrates ubiquitinated by another E3 ubiquitin ligase. Mediates 'Lys-48'-linked polyubiquitination of substrates.

AlphaFold DB (A0A5K4EBN3), UniProt , Accession A0A3Q0KDX8, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,188 aa.

						>A0A3Q0KDX8_SCHMA|A0A3Q0KDX8
MDSADNPFASLVKNSSVGLGPAIFGACETEVTKILENILLITHDKDLVFGESGRPSHLLYIQPFSCGNVHISGSSLDELIFDRTQMRKFNDYDVVSINTGAATDINDVLASNPISYLVSSYHRACVIKQTNALSQIVEDCRKSIVRQIVLLLLVDAESDNPESSTNLFDIVYQALCTDDCDQIAYIQKMFDEVLSHLVSESLSDVSILESCPQSALNSLRPLVNRLLIQLRNIYYSSVQSPTVVNSFLNKQLVGARERVLFCPQRRPLLIMTIWLSKYAVTAQLLIELSFPQNFSSGSFRPDEFEGGLLGRLLVSSHLHSPQAAETIFLTNQAPIGEFFTEEVPLKSVVESEQRTIWQLTEQMDLELNTLFTNLLRVGKRRPYIKKLLFKWFGGCIHANKARGQLAHSIMNHDLLSRSNTPTLAGDGFLSNFTAVLVRLTGPLVTLPEKPPLDKIWPEYATDSCTDRTVLPDLRGETRLAPANNNFKKSENTSLAVTNDEDYPLLTELFFLAHAAIRIGWTSLIARHFETGQQLHRLEDQLQPHESDNSNDSQVIFLRRFMRERTARYLEQSTSLSCMSRLKDQLSFAVTTCRLLVKLANDILNKNSSDSSNITTSTSDSTPFSHGCLSDLPEYLVDNVVELVSYLRRGKDEFLESVEVSSIPLEPLLEFSIIFMSHTGLLTNPHLRARLAEVLESLVPQRDDEAWNTNTSGSGLLNSLNLSFHRREQLMNRDPEITNDPILSNAVRALLTAFVSIELSPGTGVVGSAGSAADAAIAASSSSTSQNSSSHQPGSHLNSSDSQTDIGNNSSSTSSSNNGGNSATDTQTAAVGFEEKFHYRRPMYACLRYWYGKPLYDVQFKRLENEALAHIDDVNPPLFLQFLSLLVNDAIFLLDEALSLLAQLKQTERERDKCGGRLSSSSDEALFAHTGRLARHHIMLGLDTIATLRRVITLCSQLITHPILVDRVACMLNYFLTRLVGPKQRDLNVRDKAAYGFKPDIMVLEISAIYQILARGSDSAVETDAETIATSSSSLPSSSESFRRAVVSDERSFTPDLLDQACRVLDRIAAPIDLCNKFAEAVRLIKAENVIKTNEELDVDDAPDEFIDPIMGCLMEDPVKLPTSGHIVDRKTIYRHLLNDSTDPFSRQPLTMSQVEPQENLRSAVRKWIDERRAQRLSKNTQGNEQKSS
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	30.6	Very low	35.4	Very low	230 Å²	230	131 Å²	131	100%	1.133	77%	0.767	S	S	*	*				0	111.1	0	-78.9	-153.3	-168.8	0	0	108.3
2	D	32.2	Very low	35.3	Very low	142 Å²	142	130.4 Å²	130.4	76%	0.759	77%	0.766	S	S	*	*				-135.5	140.6	-75.4	-88.5	-13	0	0	0	104.8	A4	D2-A4 HydrophobicContact CB-CB 4.38Å; D2-A4 PolarHBondContact O-N 3.23Å
3	S	33.4	Very low	34.7	Very low	135 Å²	135	135 Å²	135	94%	0.944	77%	0.77	S	S	*	*	S	Bend	trans	-73.6	44.7	-178.7	56.3	0	0	0	0	112.3
4	A	34.2	Very low	34.1	Very low	75 Å²	75	137.4 Å²	137.4	62%	0.62	78%	0.78	S	S	*	*			trans	-104.8	-5.7	-166.8	0	0	0	0	0	115.3	D2	D2-A4 HydrophobicContact CB-CB 4.38Å; D2-A4 PolarHBondContact O-N 3.23Å
5	D	36.2	Very low	33.7	Very low	163 Å²	163	136.4 Å²	136.4	87%	0.872	79%	0.785	S	S	*	*			trans	-111.7	47.6	-175.8	-70.6	-27.5	0	0	0	113.7
6	N	44.4	Very low	33.5	Very low	105 Å²	105	135.4 Å²	135.4	56%	0.561	79%	0.788	S	S	*	*			trans	-108.6	106.3	162.4	-170.1	-18.1	0	0	0	110.4	F8	N6-F8 PolarHBondContact O-N 3.08Å; N6-F8 VanDerWaalsContact O-N 3.15Å; N6-F8 PolarHBondContact OD1-N 2.71Å
7	P	33.8	Very low	33.4	Very low	107 Å²	107	135.7 Å²	135.7	70%	0.695	79%	0.792	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.1	-0.1	-176.9	28.1	-32.6	0	0	0	114.8
8	F	39.6	Very low	33.2	Very low	149 Å²	149	132.2 Å²	132.2	65%	0.654	79%	0.79	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.1	0.8	179.9	-62	-76	0	0	0	114.7	N6 S10	N6-F8 PolarHBondContact O-N 3.08Å; N6-F8 VanDerWaalsContact O-N 3.15Å; N6-F8 PolarHBondContact OD1-N 2.71Å; F8-S10 PolarHBondContact O-N 3.2Å
9	A	37.6	Very low	33	Very low	86 Å²	86	133.5 Å²	133.5	71%	0.711	79%	0.792	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.1	-11.1	-174.9	0	0	0	0	0	115.2
10	S	33.3	Very low	32.9	Very low	106 Å²	106	129.4 Å²	129.4	74%	0.741	78%	0.778	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.3	-2.1	-176.6	56.3	0	0	0	0	115.3	F8	F8-S10 PolarHBondContact O-N 3.2Å
11	L	34.7	Very low	33	Very low	143 Å²	143	129.3 Å²	129.3	75%	0.749	78%	0.78	S	S	*	*	S	Bend	trans	-97	1.6	-174.3	-78.1	163.1	0	0	0	115.3
12	V	33.5	Very low	33.2	Very low	124 Å²	124	123.2 Å²	123.2	75%	0.752	77%	0.767	S	S	*	*	S	Bend	trans	-120.5	34	-173	-165.9	0	0	0	0	113.6
13	K	27.7	Very low	33.5	Very low	190 Å²	190	123 Å²	123	83%	0.826	76%	0.764	S	S	*	*			trans	-131.5	92.3	170.4	-79	-175.4	178.7	174.7	0	111.5
14	N	26.9	Very low	33.8	Very low	169 Å²	169	121.8 Å²	121.8	90%	0.904	74%	0.742	S	S	*	*			trans	-178.6	89.7	140.2	-89.9	-20.1	0	0	0	111.7
15	S	27.9	Very low	34.5	Very low	122 Å²	122	120.5 Å²	120.5	85%	0.853	74%	0.736	S	S	*	*			trans	-177.6	87.5	145.8	53.8	0	0	0	0	110.6
16	S	30	Very low	35.3	Very low	120 Å²	120	116.2 Å²	116.2	84%	0.839	72%	0.723	S	S	*	*			trans	-120.9	92.9	162.5	62.8	0	0	0	0	109
17	V	31.9	Very low	36.5	Very low	141 Å²	141	114 Å²	114	86%	0.855	72%	0.716	S	S	*	*			trans	-88.5	119.6	159.5	175.7	0	0	0	0	106.5
18	G	29.9	Very low	38.5	Very low	73 Å²	73	112.8 Å²	112.8	75%	0.753	70%	0.701	S	S	*	*			trans	-73.4	132.7	-175.4	0	0	0	0	0	113.5
19	L	29.1	Very low	40.4	Very low	157 Å²	157	107.3 Å²	107.3	82%	0.822	68%	0.679	S	S	*	*			trans	-140.9	140.8	160	-89.2	155.8	0	0	0	108.2	F24	L19-F24 WeakPolarHBondContact O-CE2 3.3Å
20	G	31.1	Very low	42.5	Very low	50 Å²	50	107.6 Å²	107.6	52%	0.515	67%	0.666	S	S	.	*			trans	-74.9	177.6	-160.2	0	0	0	0	0	118.5	A22	G20-A22 PolarHBondContact O-N 2.88Å
21	P	34.2	Very low	44.9	Very low	128 Å²	128	103.4 Å²	103.4	83%	0.831	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.4	8.4	-151.1	4.3	13.3	0	0	0	116.8
22	A	35.5	Very low	47.4	Very low	102 Å²	102	96.6 Å²	96.6	84%	0.843	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.3	-0.1	-173.6	0	0	0	0	0	115.1	G20	G20-A22 PolarHBondContact O-N 2.88Å
23	I	38.8	Very low	49.9	Very low	139 Å²	139	91.5 Å²	91.5	71%	0.713	57%	0.568	S	S	*	*	S	Bend	trans	-108.5	-7.5	177.3	-61.4	175	0	0	0	111.7	G25	I23-G25 PolarHBondContact O-N 3.09Å
24	F	40.6	Very low	52.7	Low	108 Å²	108	83.6 Å²	83.6	47%	0.474	54%	0.535	S	S	.	.	H	α-helix	trans	-63.7	-40.9	-171.9	-92.6	-91.7	0	0	0	114.5	L19 A26 C27 E28	L19-F24 WeakPolarHBondContact O-CE2 3.3Å; F24-A26 PolarHBondContact O-N 2.94Å; F24-C27 PolarHBondContact O-N 2.97Å; F24-E28 WeakPolarHBondContact O-CG 3.38Å; F24-E28 PolarHBondContact O-N 3.4Å
25	G	48.9	Very low	55.7	Low	48 Å²	48	75.6 Å²	75.6	50%	0.495	49%	0.492	S	S	.	.	H	α-helix	trans	-64.3	-40.7	-173.1	0	0	0	0	0	115	I23 T29	I23-G25 PolarHBondContact O-N 3.09Å; G25-T29 WeakPolarHBondContact O-CG2 3.39Å; G25-T29 PolarHBondContact O-N 3.49Å; G25-T29 PolarHBondContact O-OG1 3.2Å
26	A	51.5	Low	58.6	Low	73 Å²	73	69.8 Å²	69.8	60%	0.603	45%	0.451	S	S	*	.	H	α-helix	trans	-77.1	-25.6	178.3	0	0	0	0	0	112.6	F24 T29 E30	F24-A26 PolarHBondContact O-N 2.94Å; A26-T29 PolarHBondContact O-OG1 2.94Å; A26-T29 VanDerWaalsContact O-OG1 3.05Å; A26-E30 VanDerWaalsContact O-CG 3.32Å; A26-E30 WeakPolarHBondContact O-CG 3.32Å; A26-E30 PolarHBondContact O-N 3.01Å
27	C	69.3	Low	61.4	Low	60 Å²	60	66 Å²	66	41%	0.405	42%	0.422	S	S	.	.	H	α-helix	trans	-76.9	-42.6	177.2	-165.7	0	0	0	0	111	F24 T29 E30 V31	F24-C27 PolarHBondContact O-N 2.97Å; C27-T29 PolarHBondContact O-N 2.87Å; C27-E30 PolarHBondContact O-N 3.32Å; C27-V31 WeakPolarHBondContact O-CB 3.46Å; C27-V31 WeakPolarHBondContact O-CG2 3.33Å; C27-V31 PolarHBondContact O-N 3.41Å
28	E	76.3	Confident	64.2	Low	81 Å²	81	59.3 Å²	59.3	38%	0.379	38%	0.381	S	S	.	.	H	α-helix	trans	-66.8	-34.6	179.4	-73.9	178.6	176	0	0	113.4	F24 T32	F24-E28 WeakPolarHBondContact O-CG 3.38Å; F24-E28 PolarHBondContact O-N 3.4Å; E28-T32 WeakPolarHBondContact O-CB 3.31Å; E28-T32 PolarHBondContact O-N 3.01Å; E28-T32 PolarHBondContact O-OG1 3.11Å
29	T	79.8	Confident	67.1	Low	33 Å²	33	55.9 Å²	55.9	20%	0.202	35%	0.345	C	S	.	.	H	α-helix	trans	-65.6	-43.8	173	49	0	0	0	0	112	G25 A26 C27 T32 K33 F49	G25-T29 WeakPolarHBondContact O-CG2 3.39Å; G25-T29 PolarHBondContact O-N 3.49Å; G25-T29 PolarHBondContact O-OG1 3.2Å; A26-T29 PolarHBondContact O-OG1 2.94Å; A26-T29 VanDerWaalsContact O-OG1 3.05Å; C27-T29 PolarHBondContact O-N 2.87Å; T29-T32 PolarHBondContact O-N 2.96Å; T29-K33 WeakPolarHBondContact O-CG 3.44Å; T29-K33 PolarHBondContact O-N 2.99Å; T29-F49 HydrophobicContact CG2-CD1 3.75Å; T29-F49 HydrophobicContact CG2-CE1 4.09Å; T29-F49 HydrophobicContact CG2-CG 4.42Å
30	E	81.4	Confident	70.1	Confident	93 Å²	93	48.6 Å²	48.6	44%	0.435	31%	0.307	S	S	.	.	H	α-helix	trans	-68.9	-37.9	178.5	-69.2	-60.5	131.3	0	0	111.5	A26 C27 K33 I34	A26-E30 VanDerWaalsContact O-CG 3.32Å; A26-E30 WeakPolarHBondContact O-CG 3.32Å; A26-E30 PolarHBondContact O-N 3.01Å; C27-E30 PolarHBondContact O-N 3.32Å; E30-K33 PolarHBondContact O-N 3.4Å; E30-I34 WeakPolarHBondContact O-CG1 3.37Å; E30-I34 PolarHBondContact O-N 3.39Å
31	V	84.2	Confident	72.9	Confident	17 Å²	17	46.2 Å²	46.2	10%	0.103	28%	0.282	C	S	.	.	H	α-helix	trans	-57.1	-50.4	170.2	168.2	0	0	0	0	110.6	C27 K33 I34 L35 L133 I136	C27-V31 WeakPolarHBondContact O-CB 3.46Å; C27-V31 WeakPolarHBondContact O-CG2 3.33Å; C27-V31 PolarHBondContact O-N 3.41Å; V31-K33 PolarHBondContact O-N 3.38Å; V31-I34 PolarHBondContact O-N 2.99Å; V31-L35 HydrophobicContact CG1-CD1 3.92Å; V31-L35 WeakPolarHBondContact O-CG 3.37Å; V31-L35 PolarHBondContact O-N 2.98Å; V31-L133 HydrophobicContact CG2-CD2 3.97Å; V31-I136 HydrophobicContact CG1-CG2 4.14Å; V31-I136 HydrophobicContact CG2-CD1 3.69Å; V31-I136 HydrophobicContact CG2-CG1 4.47Å
32	T	87.3	Confident	75.5	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-59.6	-47.6	-179.9	-57.9	0	0	0	0	110.6	E28 T29 I34 L35 E36 F49 I71	E28-T32 WeakPolarHBondContact O-CB 3.31Å; E28-T32 PolarHBondContact O-N 3.01Å; E28-T32 PolarHBondContact O-OG1 3.11Å; T29-T32 PolarHBondContact O-N 2.96Å; T32-I34 VanDerWaalsContact C-N 3.34Å; T32-I34 PolarHBondContact O-N 3.27Å; T32-L35 PolarHBondContact O-N 3.37Å; T32-E36 HydrophobicContact CG2-CG 4.35Å; T32-E36 WeakPolarHBondContact O-CB 3.49Å; T32-E36 VanDerWaalsContact O-CG 3.25Å; T32-E36 WeakPolarHBondContact O-CG 3.35Å; T32-E36 PolarHBondContact O-N 3.44Å; T32-F49 HydrophobicContact CG2-CD2 4.31Å; T32-F49 HydrophobicContact CG2-CE2 4.07Å; T32-I71 HydrophobicContact CG2-CB 4.2Å; T32-I71 HydrophobicContact CG2-CD1 4.22Å; T32-I71 HydrophobicContact CG2-CG1 4.02Å; T32-I71 PolarHBondContact OG1-N 2.93Å
33	K	86.3	Confident	77.9	Confident	17 Å²	17	36.4 Å²	36.4	7%	0.074	21%	0.208	C	C	.	.	H	α-helix	trans	-61.6	-37.9	177.7	-71.1	178.6	-179.2	-170.6	0	113.2	T29 E30 V31 N37 F49 S52 R54	T29-K33 WeakPolarHBondContact O-CG 3.44Å; T29-K33 PolarHBondContact O-N 2.99Å; E30-K33 PolarHBondContact O-N 3.4Å; V31-K33 PolarHBondContact O-N 3.38Å; K33-N37 PolarHBondContact O-N 2.91Å; K33-N37 PolarHBondContact O-ND2 3.02Å; K33-F49 VanDerWaalsContact CE-O 3.31Å; K33-F49 WeakPolarHBondContact CE-O 3.39Å; K33-F49 PolarHBondContact NZ-O 3.18Å; K33-S52 PolarHBondContact NZ-O 3.46Å; K33-R54 HydrophobicContact CD-CG 4.49Å; K33-R54 HydrophobicContact CG-CG 4.1Å
34	I	86.9	Confident	80.1	Confident	25 Å²	25	29.9 Å²	29.9	13%	0.128	18%	0.175	C	C	.	.	H	α-helix	trans	-65.4	-46	175.3	-73.8	173.9	0	0	0	110.6	E30 V31 T32 E36 N37 I38 I127 L133 V137	E30-I34 WeakPolarHBondContact O-CG1 3.37Å; E30-I34 PolarHBondContact O-N 3.39Å; V31-I34 PolarHBondContact O-N 2.99Å; T32-I34 VanDerWaalsContact C-N 3.34Å; T32-I34 PolarHBondContact O-N 3.27Å; I34-E36 VanDerWaalsContact C-N 3.32Å; I34-E36 PolarHBondContact O-N 2.95Å; I34-N37 WeakPolarHBondContact O-CB 3.49Å; I34-N37 PolarHBondContact O-N 3.17Å; I34-N37 VanDerWaalsContact O-N 3.16Å; I34-I38 HydrophobicContact CG2-CD1 4.06Å; I34-I38 WeakPolarHBondContact O-CG1 3.38Å; I34-I38 PolarHBondContact O-N 3.27Å; I34-I127 HydrophobicContact CG2-CD1 4.35Å; I34-L133 HydrophobicContact CD1-CB 3.93Å; I34-L133 HydrophobicContact CD1-CD1 3.45Å; I34-L133 VanDerWaalsContact CD1-CD1 3.45Å; I34-L133 HydrophobicContact CD1-CD2 4.3Å; I34-L133 HydrophobicContact CD1-CG 4.07Å; I34-V137 HydrophobicContact CG2-CG2 3.86Å
35	L	88.8	Confident	82.1	Confident	0 Å²	0	28.9 Å²	28.9	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-65.2	-36.8	178.6	-66	175.2	0	0	0	111.7	V31 T32 I38 L39 I71 L76 I136 C140	V31-L35 HydrophobicContact CG1-CD1 3.92Å; V31-L35 WeakPolarHBondContact O-CG 3.37Å; V31-L35 PolarHBondContact O-N 2.98Å; T32-L35 PolarHBondContact O-N 3.37Å; L35-I38 PolarHBondContact O-N 3.47Å; L35-L39 WeakPolarHBondContact O-CB 3.15Å; L35-L39 PolarHBondContact O-N 2.98Å; L35-I71 HydrophobicContact CB-CG2 4.28Å; L35-I71 HydrophobicContact CD1-CB 4.18Å; L35-I71 HydrophobicContact CD1-CG2 3.64Å; L35-L76 HydrophobicContact CD1-CD2 3.92Å; L35-L76 HydrophobicContact CD2-CD1 4.41Å; L35-L76 HydrophobicContact CD2-CD2 3.88Å; L35-L76 HydrophobicContact CG-CD2 4.41Å; L35-I136 HydrophobicContact CD1-CG2 4.46Å; L35-I136 HydrophobicContact CD2-CG2 3.98Å; L35-I136 HydrophobicContact CG-CG2 4.27Å; L35-C140 HydrophobicContact CD2-CB 3.75Å
36	E	89.6	Confident	83.7	Confident	0 Å²	0	33.3 Å²	33.3	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-60.3	-41.9	170.6	-76.3	177.6	167.7	0	0	112.2	T32 I34 I38 L40 I41 T42 R54 L58 I71	T32-E36 HydrophobicContact CG2-CG 4.35Å; T32-E36 WeakPolarHBondContact O-CB 3.49Å; T32-E36 VanDerWaalsContact O-CG 3.25Å; T32-E36 WeakPolarHBondContact O-CG 3.35Å; T32-E36 PolarHBondContact O-N 3.44Å; I34-E36 VanDerWaalsContact C-N 3.32Å; I34-E36 PolarHBondContact O-N 2.95Å; E36-I38 VanDerWaalsContact C-N 3.28Å; E36-I38 PolarHBondContact O-N 3.42Å; E36-L40 WeakPolarHBondContact O-CA 3.25Å; E36-L40 PolarHBondContact O-N 3.37Å; E36-I41 VanDerWaalsContact CG-O 3.32Å; E36-I41 WeakPolarHBondContact CG-O 3.45Å; E36-T42 PolarHBondContact OE1-OG1 3.43Å; E36-R54 VanDerWaalsContact CD-NH2 3.27Å; E36-R54 IonicContact OE1-CZ 3.7Å; E36-R54 IonicContact OE1-NE 3.92Å; E36-R54 IonicContact OE1-NH2 3.19Å; E36-R54 PolarHBondContact OE1-NH2 3.4Å; E36-R54 IonicContact OE2-CZ 2.6Å; E36-R54 VanDerWaalsContact OE2-CZ 3.28Å; E36-R54 IonicContact OE2-NE 2.71Å; E36-R54 PolarHBondContact OE2-NE 3.5Å; E36-R54 IonicContact OE2-NH2 3.97Å; E36-R54 PolarHBondContact OE2-NH2 3.31Å; E36-L58 HydrophobicContact CB-CD2 4.06Å; E36-L58 HydrophobicContact CG-CD2 4.43Å; E36-I71 HydrophobicContact CG-CD1 4.11Å
37	N	88.9	Confident	85.2	Confident	42 Å²	42	31.6 Å²	31.6	23%	0.225	16%	0.163	C	C	.	.	H	α-helix	trans	-66.7	-28.8	175.5	-78	-56.3	0	0	0	112.8	K33 I34 G53 P55 R123	K33-N37 PolarHBondContact O-N 2.91Å; K33-N37 PolarHBondContact O-ND2 3.02Å; I34-N37 WeakPolarHBondContact O-CB 3.49Å; I34-N37 PolarHBondContact O-N 3.17Å; I34-N37 VanDerWaalsContact O-N 3.16Å; N37-G53 PolarHBondContact ND2-O 3.34Å; N37-P55 WeakPolarHBondContact OD1-CD 3.37Å; N37-R123 WeakPolarHBondContact O-CD 3.48Å
38	I	90.3	Very high	85.7	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-81.2	-51.8	178	-64.9	170.9	0	0	0	111	I34 L35 E36 S120 R123 A124 I127 V137 C140 I144	I34-I38 HydrophobicContact CG2-CD1 4.06Å; I34-I38 WeakPolarHBondContact O-CG1 3.38Å; I34-I38 PolarHBondContact O-N 3.27Å; L35-I38 PolarHBondContact O-N 3.47Å; E36-I38 VanDerWaalsContact C-N 3.28Å; E36-I38 PolarHBondContact O-N 3.42Å; I38-S120 WeakPolarHBondContact CG2-O 3.49Å; I38-R123 VanDerWaalsContact O-CZ 3.27Å; I38-R123 PolarHBondContact O-NE 3.12Å; I38-R123 PolarHBondContact O-NH2 3.42Å; I38-A124 HydrophobicContact CD1-CB 4.13Å; I38-A124 HydrophobicContact CG1-CB 4.34Å; I38-A124 HydrophobicContact CG2-CB 3.92Å; I38-I127 HydrophobicContact CD1-CD1 3.81Å; I38-I127 HydrophobicContact CG1-CD1 3.31Å; I38-V137 HydrophobicContact CD1-CG1 4.27Å; I38-V137 HydrophobicContact CD1-CG2 4.36Å; I38-C140 HydrophobicContact CD1-CB 4.42Å; I38-I144 HydrophobicContact CG2-CD1 4.04Å
39	L	91.1	Very high	85.7	Confident	1 Å²	1	31.5 Å²	31.5	1%	0.005	16%	0.163	C	C	.	.	H	α-helix	trans	-92.8	-18.5	-169.9	-60.3	177.8	0	0	0	112.8	L35 I41 L76 L79 I80 Y116 I144	L35-L39 WeakPolarHBondContact O-CB 3.15Å; L35-L39 PolarHBondContact O-N 2.98Å; L39-I41 HydrophobicContact CB-CB 4.47Å; L39-I41 HydrophobicContact CB-CD1 4.06Å; L39-I41 HydrophobicContact CB-CG1 4.29Å; L39-I41 PolarHBondContact O-N 2.68Å; L39-L76 HydrophobicContact CD1-CD2 4.03Å; L39-L79 HydrophobicContact CD1-CD2 4.24Å; L39-I80 HydrophobicContact CD1-CD1 4.28Å; L39-I80 HydrophobicContact CD1-CG1 3.87Å; L39-I80 HydrophobicContact CD2-CD1 3.9Å; L39-I80 HydrophobicContact CD2-CG1 3.86Å; L39-Y116 VanDerWaalsContact O-CE2 3.29Å; L39-Y116 WeakPolarHBondContact O-CE2 2.95Å; L39-Y116 VanDerWaalsContact O-CZ 3.31Å; L39-Y116 PolarHBondContact O-OH 2.62Å; L39-I144 HydrophobicContact CD2-CD1 4.23Å; L39-I144 HydrophobicContact CD2-CG1 4.32Å
40	L	91.5	Very high	85.8	Confident	3 Å²	3	31.3 Å²	31.3	2%	0.016	17%	0.167	C	C	.	.			trans	57	32.9	-173.8	-50.1	178.5	0	0	0	113.4	E36 P55 L59 T103 D107 V108	E36-L40 WeakPolarHBondContact O-CA 3.25Å; E36-L40 PolarHBondContact O-N 3.37Å; L40-P55 HydrophobicContact CD2-CB 3.82Å; L40-P55 HydrophobicContact CD2-CG 3.84Å; L40-L59 PolarHBondContact O-N 2.78Å; L40-T103 HydrophobicContact CD2-CG2 4.04Å; L40-D107 HydrophobicContact CD1-CB 3.9Å; L40-V108 HydrophobicContact CB-CG2 4.1Å; L40-V108 HydrophobicContact CD1-CG2 3.82Å
41	I	90	Very high	85.7	Confident	0 Å²	0	30.3 Å²	30.3	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	143.7	177.9	-61.1	163.3	0	0	0	108.9	E36 L39 L59 I61 L79 R83 Y116	E36-I41 VanDerWaalsContact CG-O 3.32Å; E36-I41 WeakPolarHBondContact CG-O 3.45Å; L39-I41 HydrophobicContact CB-CB 4.47Å; L39-I41 HydrophobicContact CB-CD1 4.06Å; L39-I41 HydrophobicContact CB-CG1 4.29Å; L39-I41 PolarHBondContact O-N 2.68Å; I41-L59 CarbonylContact C-O 3.04Å; I41-L59 VanDerWaalsContact CA-O 3.29Å; I41-L59 WeakPolarHBondContact CA-O 3.39Å; I41-I61 HydrophobicContact CD1-CD1 4.05Å; I41-I61 HydrophobicContact CG1-CD1 4.16Å; I41-I61 HydrophobicContact CG2-CB 4.01Å; I41-I61 HydrophobicContact CG2-CD1 3.62Å; I41-I61 HydrophobicContact CG2-CG1 3.72Å; I41-L79 HydrophobicContact CD1-CG 4.19Å; I41-L79 HydrophobicContact CG2-CD1 3.94Å; I41-L79 HydrophobicContact CG2-CD2 4.39Å; I41-L79 HydrophobicContact CG2-CG 4.37Å; I41-R83 HydrophobicContact CD1-CB 3.49Å; I41-R83 VanDerWaalsContact CD1-CB 3.49Å; I41-R83 HydrophobicContact CD1-CG 3.69Å; I41-R83 HydrophobicContact CG1-CB 4.37Å; I41-R83 HydrophobicContact CG1-CG 4.17Å; I41-Y116 WeakPolarHBondContact CD1-OH 3.35Å
42	T	88.4	Confident	85.5	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	142.1	174.3	-178.9	0	0	0	0	112.5	E36 D44 R54 L58 L59 Y60 I61 V95	E36-T42 PolarHBondContact OE1-OG1 3.43Å; T42-D44 WeakPolarHBondContact OG1-CA 3.4Å; T42-D44 WeakPolarHBondContact OG1-CB 3.43Å; T42-D44 PolarHBondContact OG1-N 3.1Å; T42-D44 PolarHBondContact OG1-O 3.42Å; T42-D44 VanDerWaalsContact OG1-O 3.1Å; T42-R54 PolarHBondContact OG1-NH2 3.34Å; T42-L58 HydrophobicContact CG2-CB 3.69Å; T42-L58 HydrophobicContact CG2-CD1 4.24Å; T42-L59 PolarHBondContact N-O 3.44Å; T42-Y60 WeakPolarHBondContact O-CA 3.41Å; T42-Y60 WeakPolarHBondContact O-CD2 3.43Å; T42-I61 PolarHBondContact O-N 3.04Å; T42-V95 HydrophobicContact CG2-CB 4.38Å; T42-V95 HydrophobicContact CG2-CG2 3.94Å
43	H	86.9	Confident	85	Confident	24 Å²	24	36.2 Å²	36.2	11%	0.111	21%	0.214	C	C	.	.	S	Bend	trans	-90.1	-9.3	161.1	-69.8	-43.6	0	0	0	112.2	K45 Y60 I61 P63 V69	H43-K45 PolarHBondContact O-N 3.09Å; H43-Y60 WeakPolarHBondContact O-CE2 3.35Å; H43-I61 PolarHBondContact ND1-O 2.83Å; H43-P63 HydrophobicContact CB-CB 4.34Å; H43-P63 HydrophobicContact CB-CG 4.25Å; H43-V69 HydrophobicContact CB-CG1 4.48Å
44	D	85	Confident	84.9	Confident	3 Å²	3	35.4 Å²	35.4	2%	0.016	21%	0.21	C	C	.	.			trans	-94.9	85.5	-178.5	-170.4	12.6	0	0	0	110.6	T42 D46 L47 V48 F49 R54 V69	T42-D44 WeakPolarHBondContact OG1-CA 3.4Å; T42-D44 WeakPolarHBondContact OG1-CB 3.43Å; T42-D44 PolarHBondContact OG1-N 3.1Å; T42-D44 PolarHBondContact OG1-O 3.42Å; T42-D44 VanDerWaalsContact OG1-O 3.1Å; D44-D46 VanDerWaalsContact C-N 3.29Å; D44-L47 WeakPolarHBondContact OD1-CA 2.79Å; D44-L47 PolarHBondContact OD1-N 2.71Å; D44-L47 WeakPolarHBondContact OD2-CA 3.25Å; D44-V48 WeakPolarHBondContact OD1-CG2 3.14Å; D44-V48 PolarHBondContact OD1-N 3.41Å; D44-V48 PolarHBondContact OD2-N 3.49Å; D44-F49 HydrophobicContact CB-CD2 4.16Å; D44-F49 HydrophobicContact CB-CE2 4.3Å; D44-F49 PolarHBondContact OD2-N 2.99Å; D44-F49 VanDerWaalsContact OD2-N 3.11Å; D44-R54 IonicContact OD2-CZ 3.59Å; D44-R54 IonicContact OD2-NH1 2.85Å; D44-R54 PolarHBondContact OD2-NH1 3.04Å; D44-R54 IonicContact OD2-NH2 3.32Å; D44-V69 HydrophobicContact CB-CG1 3.25Å
45	K	82.8	Confident	84.8	Confident	86 Å²	86	34.2 Å²	34.2	37%	0.374	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-33.7	176.9	-162.4	163.6	-174.2	154	0	112.2	H43 Y60 Y92 D93 V95	H43-K45 PolarHBondContact O-N 3.09Å; K45-Y60 HydrophobicContact CB-CD2 3.61Å; K45-Y60 HydrophobicContact CB-CE2 3.6Å; K45-Y60 HydrophobicContact CB-CG 4.15Å; K45-Y60 HydrophobicContact CD-CD1 3.87Å; K45-Y60 HydrophobicContact CD-CD2 4.32Å; K45-Y60 HydrophobicContact CD-CE1 3.97Å; K45-Y60 HydrophobicContact CD-CE2 4.42Å; K45-Y60 HydrophobicContact CD-CG 4.03Å; K45-Y60 HydrophobicContact CG-CD1 4.5Å; K45-Y60 HydrophobicContact CG-CD2 4.13Å; K45-Y60 HydrophobicContact CG-CE2 4.41Å; K45-Y60 HydrophobicContact CG-CG 4.16Å; K45-Y92 PolarHBondContact NZ-O 3.06Å; K45-D93 IonicContact NZ-OD1 3.84Å; K45-V95 HydrophobicContact CG-CG2 4.49Å
46	D	82	Confident	84.6	Confident	142 Å²	142	35 Å²	35	76%	0.759	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	-97.4	6.9	-171.2	-59.9	-40.8	0	0	0	113.4	D44 V48	D44-D46 VanDerWaalsContact C-N 3.29Å; D46-V48 VanDerWaalsContact C-N 3.33Å; D46-V48 HydrophobicContact CB-CG2 4.4Å; D46-V48 PolarHBondContact O-N 3.45Å
47	L	81.8	Confident	84.5	Confident	36 Å²	36	37.2 Å²	37.2	19%	0.188	22%	0.22	C	C	.	.			trans	57.4	38	178.2	-56.3	172.9	0	0	0	114.1	D44 F49 G50 E51 V95 I97	D44-L47 WeakPolarHBondContact OD1-CA 2.79Å; D44-L47 PolarHBondContact OD1-N 2.71Å; D44-L47 WeakPolarHBondContact OD2-CA 3.25Å; L47-F49 PolarHBondContact O-N 3.07Å; L47-F49 VanDerWaalsContact O-N 3.13Å; L47-G50 PolarHBondContact O-N 3.42Å; L47-E51 HydrophobicContact CD1-CG 4.24Å; L47-V95 HydrophobicContact CD1-CG1 4.4Å; L47-V95 HydrophobicContact CD2-CG1 3.73Å; L47-V95 HydrophobicContact CG-CG1 4.17Å; L47-I97 HydrophobicContact CD1-CG1 4.03Å; L47-I97 HydrophobicContact CD2-CD1 3.6Å; L47-I97 HydrophobicContact CD2-CG1 3.93Å
48	V	80.1	Confident	84.5	Confident	104 Å²	104	35.2 Å²	35.2	63%	0.63	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.7	-31	177.9	-177.5	0	0	0	0	112.6	D44 D46 G50	D44-V48 WeakPolarHBondContact OD1-CG2 3.14Å; D44-V48 PolarHBondContact OD1-N 3.41Å; D44-V48 PolarHBondContact OD2-N 3.49Å; D46-V48 VanDerWaalsContact C-N 3.33Å; D46-V48 HydrophobicContact CB-CG2 4.4Å; D46-V48 PolarHBondContact O-N 3.45Å; V48-G50 VanDerWaalsContact C-N 3.28Å; V48-G50 PolarHBondContact O-N 3.34Å
49	F	76.7	Confident	84.4	Confident	35 Å²	35	35.4 Å²	35.4	15%	0.154	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.8	5.5	178.4	-54.4	-48	0	0	0	115	T29 T32 K33 D44 L47 V69 H70	T29-F49 HydrophobicContact CG2-CD1 3.75Å; T29-F49 HydrophobicContact CG2-CE1 4.09Å; T29-F49 HydrophobicContact CG2-CG 4.42Å; T32-F49 HydrophobicContact CG2-CD2 4.31Å; T32-F49 HydrophobicContact CG2-CE2 4.07Å; K33-F49 VanDerWaalsContact CE-O 3.31Å; K33-F49 WeakPolarHBondContact CE-O 3.39Å; K33-F49 PolarHBondContact NZ-O 3.18Å; D44-F49 HydrophobicContact CB-CD2 4.16Å; D44-F49 HydrophobicContact CB-CE2 4.3Å; D44-F49 PolarHBondContact OD2-N 2.99Å; D44-F49 VanDerWaalsContact OD2-N 3.11Å; L47-F49 PolarHBondContact O-N 3.07Å; L47-F49 VanDerWaalsContact O-N 3.13Å; F49-V69 HydrophobicContact CD2-CG1 4.47Å; F49-V69 HydrophobicContact CE2-CB 3.97Å; F49-V69 HydrophobicContact CE2-CG1 3.62Å; F49-V69 WeakPolarHBondContact CE2-O 3.08Å; F49-V69 HydrophobicContact CZ-CB 3.76Å; F49-V69 HydrophobicContact CZ-CG1 3.92Å; F49-H70 AromaticContact CE1-CE1 3.28Å; F49-H70 WeakPolarHBondContact CE1-CE1 3.47Å; F49-H70 AromaticContact CE1-ND1 3.84Å; F49-H70 AromaticContact CE1-NE2 3.67Å; F49-H70 AromaticContact CZ-CE1 3.36Å; F49-H70 WeakPolarHBondContact CZ-CE1 3.1Å; F49-H70 AromaticContact CZ-CG 3.9Å; F49-H70 AromaticContact CZ-ND1 3.44Å; F49-H70 WeakPolarHBondContact CZ-ND1 3.26Å; F49-H70 AromaticContact CZ-NE2 3.75Å
50	G	80.9	Confident	84.3	Confident	29 Å²	29	37.5 Å²	37.5	30%	0.299	22%	0.218	S	C	.	.			trans	77	165.1	-176.2	0	0	0	0	0	113.5	L47 V48 R54	L47-G50 PolarHBondContact O-N 3.42Å; V48-G50 VanDerWaalsContact C-N 3.28Å; V48-G50 PolarHBondContact O-N 3.34Å; G50-R54 WeakPolarHBondContact O-CD 3.18Å
51	E	81	Confident	84	Confident	73 Å²	73	37.8 Å²	37.8	34%	0.341	22%	0.22	S	C	.	.	S	Bend	trans	-82.4	-21.5	-176.7	-61.8	-173.6	-175.7	0	0	113.6	L47 G53 R54 I97 T99	L47-E51 HydrophobicContact CD1-CG 4.24Å; E51-G53 PolarHBondContact O-N 3.5Å; E51-R54 PolarHBondContact O-N 3.4Å; E51-I97 HydrophobicContact CB-CG2 3.64Å; E51-I97 HydrophobicContact CG-CG2 3.8Å; E51-T99 VanDerWaalsContact CB-OG1 3.26Å; E51-T99 WeakPolarHBondContact CB-OG1 3.48Å; E51-T99 PolarHBondContact OE2-OG1 3.45Å
52	S	78.5	Confident	83.7	Confident	85 Å²	85	45 Å²	45	59%	0.594	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.4	125.6	-171.7	60.2	0	0	0	0	112.5	K33	K33-S52 PolarHBondContact NZ-O 3.46Å
53	G	77.1	Confident	83	Confident	56 Å²	56	46.1 Å²	46.1	58%	0.577	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.1	8.1	177.5	0	0	0	0	0	115.1	N37 E51	N37-G53 PolarHBondContact ND2-O 3.34Å; E51-G53 PolarHBondContact O-N 3.5Å
54	R	84.7	Confident	82.1	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	29%	0.29	C	S	.	.			trans	-97.6	157.1	177.9	-64.2	-179.9	79.5	171.9	3	111.4	K33 E36 T42 D44 G50 E51 I97 G100 A101	K33-R54 HydrophobicContact CD-CG 4.49Å; K33-R54 HydrophobicContact CG-CG 4.1Å; E36-R54 VanDerWaalsContact CD-NH2 3.27Å; E36-R54 IonicContact OE1-CZ 3.7Å; E36-R54 IonicContact OE1-NE 3.92Å; E36-R54 IonicContact OE1-NH2 3.19Å; E36-R54 PolarHBondContact OE1-NH2 3.4Å; E36-R54 IonicContact OE2-CZ 2.6Å; E36-R54 VanDerWaalsContact OE2-CZ 3.28Å; E36-R54 IonicContact OE2-NE 2.71Å; E36-R54 PolarHBondContact OE2-NE 3.5Å; E36-R54 IonicContact OE2-NH2 3.97Å; E36-R54 PolarHBondContact OE2-NH2 3.31Å; T42-R54 PolarHBondContact OG1-NH2 3.34Å; D44-R54 IonicContact OD2-CZ 3.59Å; D44-R54 IonicContact OD2-NH1 2.85Å; D44-R54 PolarHBondContact OD2-NH1 3.04Å; D44-R54 IonicContact OD2-NH2 3.32Å; G50-R54 WeakPolarHBondContact O-CD 3.18Å; E51-R54 PolarHBondContact O-N 3.4Å; R54-I97 HydrophobicContact CB-CD1 3.68Å; R54-G100 CarbonylContact O-C 3.58Å; R54-G100 WeakPolarHBondContact O-CA 3.37Å; R54-A101 PolarHBondContact O-N 3.41Å
55	P	84.3	Confident	81.2	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	31%	0.312	C	S	.	.	B	Isolated β-bridge	trans	-72.3	156.5	176.4	28.9	-32.1	0	0	0	111.6	N37 L40 H57 L58 T103	N37-P55 WeakPolarHBondContact OD1-CD 3.37Å; L40-P55 HydrophobicContact CD2-CB 3.82Å; L40-P55 HydrophobicContact CD2-CG 3.84Å; P55-H57 PolarHBondContact O-N 3.02Å; P55-L58 HydrophobicContact CG-CD1 4.25Å; P55-L58 HydrophobicContact CG-CD2 3.32Å; P55-L58 HydrophobicContact CG-CG 3.71Å; P55-T103 HydrophobicContact CB-CG2 3.39Å
56	S	84.4	Confident	79.9	Confident	17 Å²	17	58.6 Å²	58.6	12%	0.119	34%	0.34	C	S	.	.	S	Bend	trans	-64.2	-26.4	-177.5	62.3	0	0	0	0	113.8	S96 I97 A101 T103	S56-S96 WeakPolarHBondContact O-CA 3.49Å; S56-I97 PolarHBondContact O-N 2.87Å; S56-A101 WeakPolarHBondContact CB-O 3.33Å; S56-A101 PolarHBondContact N-O 3.03Å; S56-A101 PolarHBondContact OG-O 2.98Å; S56-T103 PolarHBondContact N-OG1 2.96Å; S56-T103 VanDerWaalsContact N-OG1 3.11Å; S56-T103 PolarHBondContact OG-N 2.79Å; S56-T103 PolarHBondContact OG-O 3.48Å; S56-T103 PolarHBondContact OG-OG1 2.95Å
57	H	88	Confident	79	Confident	46 Å²	46	55.1 Å²	55.1	21%	0.213	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	134.5	176.3	-59.1	-64.6	0	0	0	110.7	P55 V95 S96 T103 V108	P55-H57 PolarHBondContact O-N 3.02Å; H57-V95 WeakPolarHBondContact CA-O 3.41Å; H57-S96 PolarHBondContact ND1-OG 2.87Å; H57-T103 PolarHBondContact CD2-O 2.86Å; H57-T103 PolarHBondContact N-OG1 2.81Å; H57-T103 VanDerWaalsContact N-OG1 3.12Å; H57-V108 HydrophobicContact CB-CG2 3.76Å
58	L	88.2	Confident	78.5	Confident	0 Å²	0	57.4 Å²	57.4	0%	0	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	145.4	176.3	-71.2	165.4	0	0	0	110	E36 T42 P55 V95 I97	E36-L58 HydrophobicContact CB-CD2 4.06Å; E36-L58 HydrophobicContact CG-CD2 4.43Å; T42-L58 HydrophobicContact CG2-CB 3.69Å; T42-L58 HydrophobicContact CG2-CD1 4.24Å; P55-L58 HydrophobicContact CG-CD1 4.25Å; P55-L58 HydrophobicContact CG-CD2 3.32Å; P55-L58 HydrophobicContact CG-CG 3.71Å; L58-V95 HydrophobicContact CB-CB 4.26Å; L58-V95 PolarHBondContact N-O 2.86Å; L58-V95 PolarHBondContact O-N 2.66Å; L58-I97 HydrophobicContact CD1-CD1 4Å
59	L	88.8	Confident	78.3	Confident	3 Å²	3	54.2 Å²	54.2	2%	0.016	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	122.2	169.4	-172.2	68.8	0	0	0	110	L40 I41 T42 I61 M86 F89 D93 V108	L40-L59 PolarHBondContact O-N 2.78Å; I41-L59 CarbonylContact C-O 3.04Å; I41-L59 VanDerWaalsContact CA-O 3.29Å; I41-L59 WeakPolarHBondContact CA-O 3.39Å; T42-L59 PolarHBondContact N-O 3.44Å; L59-I61 PolarHBondContact O-N 2.67Å; L59-M86 HydrophobicContact CD2-SD 4.02Å; L59-F89 HydrophobicContact CD1-CD1 4.37Å; L59-F89 HydrophobicContact CD2-CD1 4.1Å; L59-F89 HydrophobicContact CD2-CE1 4.19Å; L59-D93 HydrophobicContact CD1-CB 4.14Å; L59-V108 HydrophobicContact CB-CG1 3.88Å
60	Y	89.2	Confident	78.5	Confident	46 Å²	46	55 Å²	55	18%	0.18	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	124	173.7	176.2	-107.5	0	0	0	110.7	T42 H43 K45 Q62 D93	T42-Y60 WeakPolarHBondContact O-CA 3.41Å; T42-Y60 WeakPolarHBondContact O-CD2 3.43Å; H43-Y60 WeakPolarHBondContact O-CE2 3.35Å; K45-Y60 HydrophobicContact CB-CD2 3.61Å; K45-Y60 HydrophobicContact CB-CE2 3.6Å; K45-Y60 HydrophobicContact CB-CG 4.15Å; K45-Y60 HydrophobicContact CD-CD1 3.87Å; K45-Y60 HydrophobicContact CD-CD2 4.32Å; K45-Y60 HydrophobicContact CD-CE1 3.97Å; K45-Y60 HydrophobicContact CD-CE2 4.42Å; K45-Y60 HydrophobicContact CD-CG 4.03Å; K45-Y60 HydrophobicContact CG-CD1 4.5Å; K45-Y60 HydrophobicContact CG-CD2 4.13Å; K45-Y60 HydrophobicContact CG-CE2 4.41Å; K45-Y60 HydrophobicContact CG-CG 4.16Å; Y60-Q62 HydrophobicContact CE1-CB 4.22Å; Y60-D93 WeakPolarHBondContact CB-O 3.35Å; Y60-D93 PolarHBondContact N-O 3.5Å
61	I	86	Confident	78.4	Confident	8 Å²	8	53.7 Å²	53.7	4%	0.041	32%	0.321	C	S	.	.			trans	-117.6	127.6	169	-61.5	-175.6	0	0	0	107.5	I41 T42 H43 L59 P63 L79 R83 M86	I41-I61 HydrophobicContact CD1-CD1 4.05Å; I41-I61 HydrophobicContact CG1-CD1 4.16Å; I41-I61 HydrophobicContact CG2-CB 4.01Å; I41-I61 HydrophobicContact CG2-CD1 3.62Å; I41-I61 HydrophobicContact CG2-CG1 3.72Å; T42-I61 PolarHBondContact O-N 3.04Å; H43-I61 PolarHBondContact ND1-O 2.83Å; L59-I61 PolarHBondContact O-N 2.67Å; I61-P63 WeakPolarHBondContact O-CD 3.5Å; I61-L79 HydrophobicContact CD1-CD1 4.45Å; I61-L79 HydrophobicContact CG2-CD1 4.48Å; I61-R83 HydrophobicContact CD1-CB 3.94Å; I61-M86 HydrophobicContact CD1-CE 4.44Å; I61-M86 HydrophobicContact CD1-SD 4.39Å; I61-M86 HydrophobicContact CG1-CE 4.2Å; I61-M86 HydrophobicContact CG1-SD 4.41Å
62	Q	81.9	Confident	78.2	Confident	152 Å²	152	52.4 Å²	52.4	71%	0.71	32%	0.32	S	S	*	.			trans	-67.4	124.3	-179.2	-175.4	172.8	-5.7	0	0	110.3	Y60	Y60-Q62 HydrophobicContact CE1-CB 4.22Å
63	P	74.9	Confident	77.8	Confident	23 Å²	23	50.6 Å²	50.6	15%	0.149	32%	0.315	C	S	.	.			trans	-68.8	143.5	178.4	26.2	-32.3	0	0	0	111.5	H43 I61 S65	H43-P63 HydrophobicContact CB-CB 4.34Å; H43-P63 HydrophobicContact CB-CG 4.25Å; I61-P63 WeakPolarHBondContact O-CD 3.5Å; P63-S65 VanDerWaalsContact C-N 3.29Å; P63-S65 PolarHBondContact O-N 3.4Å
64	F	67.8	Low	77.7	Confident	164 Å²	164	53.1 Å²	53.1	72%	0.719	32%	0.324	S	S	*	.	S	Bend	trans	-59.7	-36.6	176.8	-85.7	-80.5	0	0	0	113.2	E78 D82	F64-E78 WeakPolarHBondContact CD2-OE1 3.46Å; F64-E78 HydrophobicContact CE2-CG 4.29Å; F64-E78 VanDerWaalsContact CE2-OE1 3.22Å; F64-E78 WeakPolarHBondContact CE2-OE1 3.29Å; F64-D82 WeakPolarHBondContact CE2-OD2 3.48Å
65	S	66.4	Low	77.4	Confident	69 Å²	69	54.6 Å²	54.6	48%	0.483	33%	0.334	S	S	.	.	S	Bend	trans	-99.9	114.4	176.4	58.9	0	0	0	0	111	P63 G67 N68	P63-S65 VanDerWaalsContact C-N 3.29Å; P63-S65 PolarHBondContact O-N 3.4Å; S65-G67 PolarHBondContact O-N 3.46Å; S65-N68 PolarHBondContact O-N 3.36Å
66	C	55.5	Low	77.5	Confident	142 Å²	142	54.8 Å²	54.8	96%	0.959	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	110.8	177.9	-165.8	0	0	0	0	110.7
67	G	63.3	Low	77.6	Confident	70 Å²	70	57.1 Å²	57.1	72%	0.722	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	113.1	-8	173.7	0	0	0	0	0	116.4	S65	S65-G67 PolarHBondContact O-N 3.46Å
68	N	69.9	Low	77.4	Confident	84 Å²	84	59.8 Å²	59.8	45%	0.449	36%	0.359	S	S	.	.			trans	-98.2	106.6	173.7	-156.4	2.8	0	0	0	110.5	S65	S65-N68 PolarHBondContact O-N 3.36Å
69	V	76.8	Confident	77.4	Confident	37 Å²	37	60.1 Å²	60.1	22%	0.224	36%	0.36	C	S	.	.			trans	-93.7	-13	-176	-166.3	0	0	0	0	111.2	H43 D44 F49	H43-V69 HydrophobicContact CB-CG1 4.48Å; D44-V69 HydrophobicContact CB-CG1 3.25Å; F49-V69 HydrophobicContact CD2-CG1 4.47Å; F49-V69 HydrophobicContact CE2-CB 3.97Å; F49-V69 HydrophobicContact CE2-CG1 3.62Å; F49-V69 WeakPolarHBondContact CE2-O 3.08Å; F49-V69 HydrophobicContact CZ-CB 3.76Å; F49-V69 HydrophobicContact CZ-CG1 3.92Å
70	H	80.4	Confident	77.5	Confident	50 Å²	50	60 Å²	60	23%	0.231	36%	0.36	C	S	.	.			trans	-75	138.7	178.7	-69	-70	0	0	0	112.3	F49	F49-H70 AromaticContact CE1-CE1 3.28Å; F49-H70 WeakPolarHBondContact CE1-CE1 3.47Å; F49-H70 AromaticContact CE1-ND1 3.84Å; F49-H70 AromaticContact CE1-NE2 3.67Å; F49-H70 AromaticContact CZ-CE1 3.36Å; F49-H70 WeakPolarHBondContact CZ-CE1 3.1Å; F49-H70 AromaticContact CZ-CG 3.9Å; F49-H70 AromaticContact CZ-ND1 3.44Å; F49-H70 WeakPolarHBondContact CZ-ND1 3.26Å; F49-H70 AromaticContact CZ-NE2 3.75Å
71	I	80	Confident	77.5	Confident	2 Å²	2	61.5 Å²	61.5	1%	0.01	37%	0.367	C	S	.	.			trans	-91.4	111	169.9	-58.5	172.1	0	0	0	107.7	T32 L35 E36 L76 L79	T32-I71 HydrophobicContact CG2-CB 4.2Å; T32-I71 HydrophobicContact CG2-CD1 4.22Å; T32-I71 HydrophobicContact CG2-CG1 4.02Å; T32-I71 PolarHBondContact OG1-N 2.93Å; L35-I71 HydrophobicContact CB-CG2 4.28Å; L35-I71 HydrophobicContact CD1-CB 4.18Å; L35-I71 HydrophobicContact CD1-CG2 3.64Å; E36-I71 HydrophobicContact CG-CD1 4.11Å; I71-L76 HydrophobicContact CG2-CD2 4.38Å; I71-L79 HydrophobicContact CD1-CD2 4.04Å; I71-L79 HydrophobicContact CG1-CD2 4.27Å; I71-L79 HydrophobicContact CG2-CD2 3.74Å
72	S	75.2	Confident	77.5	Confident	46 Å²	46	63.2 Å²	63.2	32%	0.322	38%	0.377	S	S	.	.			trans	-89.3	151.7	178.4	78.6	0	0	0	0	111.8	S74 S75	S72-S74 PolarHBondContact O-N 2.78Å; S72-S74 PolarHBondContact OG-OG 3.25Å; S72-S75 PolarHBondContact N-OG 3.33Å; S72-S75 PolarHBondContact O-N 2.86Å; S72-S75 PolarHBondContact O-OG 2.87Å; S72-S75 PolarHBondContact OG-N 3.2Å; S72-S75 PolarHBondContact OG-OG 3.26Å
73	G	71.9	Confident	77.9	Confident	47 Å²	47	56.1 Å²	56.1	49%	0.485	34%	0.344	S	S	.	.	G	3₁₀ helix	trans	-59.3	-30.1	173.6	0	0	0	0	0	113.6	S75	G73-S75 VanDerWaalsContact C-N 3.33Å; G73-S75 PolarHBondContact O-N 3.47Å
74	S	73.7	Confident	78.5	Confident	110 Å²	110	55.2 Å²	55.2	77%	0.769	34%	0.338	S	S	*	.	G	3₁₀ helix	trans	-72.2	-20.6	178.6	40.5	0	0	0	0	114.7	S72	S72-S74 PolarHBondContact O-N 2.78Å; S72-S74 PolarHBondContact OG-OG 3.25Å
75	S	79.6	Confident	79.4	Confident	31 Å²	31	52.7 Å²	52.7	22%	0.217	33%	0.328	C	S	.	.	G	3₁₀ helix	trans	-101	5.3	-179.2	56	0	0	0	0	113.1	S72 G73 L79	S72-S75 PolarHBondContact N-OG 3.33Å; S72-S75 PolarHBondContact O-N 2.86Å; S72-S75 PolarHBondContact O-OG 2.87Å; S72-S75 PolarHBondContact OG-N 3.2Å; S72-S75 PolarHBondContact OG-OG 3.26Å; G73-S75 VanDerWaalsContact C-N 3.33Å; G73-S75 PolarHBondContact O-N 3.47Å; S75-L79 WeakPolarHBondContact O-CB 3.47Å; S75-L79 PolarHBondContact O-N 3.41Å
76	L	85.1	Confident	80.4	Confident	4 Å²	4	52.6 Å²	52.6	2%	0.021	32%	0.321	C	S	.	.	H	α-helix	trans	-62.2	-48.4	-174.5	-80.6	171.6	0	0	0	113.1	L35 L39 I71 E78 L79 I80 C140	L35-L76 HydrophobicContact CD1-CD2 3.92Å; L35-L76 HydrophobicContact CD2-CD1 4.41Å; L35-L76 HydrophobicContact CD2-CD2 3.88Å; L35-L76 HydrophobicContact CG-CD2 4.41Å; L39-L76 HydrophobicContact CD1-CD2 4.03Å; I71-L76 HydrophobicContact CG2-CD2 4.38Å; L76-E78 VanDerWaalsContact C-N 3.32Å; L76-E78 PolarHBondContact O-N 3.11Å; L76-L79 PolarHBondContact O-N 2.87Å; L76-I80 WeakPolarHBondContact O-CB 3.42Å; L76-I80 VanDerWaalsContact O-CG1 3.22Å; L76-I80 WeakPolarHBondContact O-CG1 3.48Å; L76-I80 PolarHBondContact O-N 3.13Å; L76-C140 HydrophobicContact CD1-CB 4.22Å
77	D	86.1	Confident	81.6	Confident	66 Å²	66	51.2 Å²	51.2	35%	0.353	30%	0.296	S	S	.	.	H	α-helix	trans	-62.4	-41	-176.9	-67.8	-49.6	0	0	0	111	F81 S143 R146	D77-F81 WeakPolarHBondContact O-CB 3.48Å; D77-F81 PolarHBondContact O-N 3.32Å; D77-S143 PolarHBondContact N-OG 2.87Å; D77-S143 WeakPolarHBondContact OD1-CA 3.48Å; D77-S143 VanDerWaalsContact OD1-CB 3.28Å; D77-S143 WeakPolarHBondContact OD1-CB 3.34Å; D77-S143 PolarHBondContact OD1-OG 2.83Å; D77-R146 IonicContact OD1-CZ 2.69Å; D77-R146 IonicContact OD1-NE 2.64Å; D77-R146 PolarHBondContact OD1-NE 2.99Å; D77-R146 VanDerWaalsContact OD1-NE 3.1Å; D77-R146 IonicContact OD1-NH2 3.26Å; D77-R146 PolarHBondContact OD1-NH2 3.29Å; D77-R146 IonicContact OD2-CZ 3.76Å; D77-R146 IonicContact OD2-NE 2.92Å; D77-R146 IonicContact OD2-NH2 3.42Å; D77-R146 PolarHBondContact OD2-NH2 2.73Å
78	E	85.5	Confident	82.4	Confident	101 Å²	101	57.2 Å²	57.2	47%	0.472	30%	0.302	S	S	.	.	H	α-helix	trans	-66	-45.9	176.1	-175	176	-158.9	0	0	112	F64 L76 I80 F81 D82	F64-E78 WeakPolarHBondContact CD2-OE1 3.46Å; F64-E78 HydrophobicContact CE2-CG 4.29Å; F64-E78 VanDerWaalsContact CE2-OE1 3.22Å; F64-E78 WeakPolarHBondContact CE2-OE1 3.29Å; L76-E78 VanDerWaalsContact C-N 3.32Å; L76-E78 PolarHBondContact O-N 3.11Å; E78-I80 PolarHBondContact O-N 3.25Å; E78-F81 WeakPolarHBondContact O-CB 3.47Å; E78-F81 PolarHBondContact O-N 2.61Å; E78-D82 PolarHBondContact O-N 3.18Å
79	L	87.4	Confident	83.1	Confident	7 Å²	7	55.4 Å²	55.4	4%	0.037	29%	0.29	C	S	.	.	H	α-helix	trans	-62.3	-44.8	179.5	-176.2	67.2	0	0	0	112.2	L39 I41 I61 I71 S75 L76 F81 R83	L39-L79 HydrophobicContact CD1-CD2 4.24Å; I41-L79 HydrophobicContact CD1-CG 4.19Å; I41-L79 HydrophobicContact CG2-CD1 3.94Å; I41-L79 HydrophobicContact CG2-CD2 4.39Å; I41-L79 HydrophobicContact CG2-CG 4.37Å; I61-L79 HydrophobicContact CD1-CD1 4.45Å; I61-L79 HydrophobicContact CG2-CD1 4.48Å; I71-L79 HydrophobicContact CD1-CD2 4.04Å; I71-L79 HydrophobicContact CG1-CD2 4.27Å; I71-L79 HydrophobicContact CG2-CD2 3.74Å; S75-L79 WeakPolarHBondContact O-CB 3.47Å; S75-L79 PolarHBondContact O-N 3.41Å; L76-L79 PolarHBondContact O-N 2.87Å; L79-F81 VanDerWaalsContact C-N 3.34Å; L79-R83 PolarHBondContact O-N 2.79Å; L79-R83 VanDerWaalsContact O-N 3.1Å
80	I	90.4	Very high	83.3	Confident	0 Å²	0	58.6 Å²	58.6	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-66.6	-41.5	178	-63.1	174.9	0	0	0	109.3	L39 L76 E78 R83 T84 L117 S143 I144 Q147	L39-I80 HydrophobicContact CD1-CD1 4.28Å; L39-I80 HydrophobicContact CD1-CG1 3.87Å; L39-I80 HydrophobicContact CD2-CD1 3.9Å; L39-I80 HydrophobicContact CD2-CG1 3.86Å; L76-I80 WeakPolarHBondContact O-CB 3.42Å; L76-I80 VanDerWaalsContact O-CG1 3.22Å; L76-I80 WeakPolarHBondContact O-CG1 3.48Å; L76-I80 PolarHBondContact O-N 3.13Å; E78-I80 PolarHBondContact O-N 3.25Å; I80-R83 PolarHBondContact O-N 2.92Å; I80-T84 HydrophobicContact CG2-CG2 4.41Å; I80-T84 VanDerWaalsContact O-CG2 3.32Å; I80-T84 WeakPolarHBondContact O-CG2 3.37Å; I80-T84 PolarHBondContact O-N 2.79Å; I80-T84 PolarHBondContact O-OG1 2.85Å; I80-L117 HydrophobicContact CG2-CD2 3.42Å; I80-L117 VanDerWaalsContact CG2-CD2 3.42Å; I80-S143 WeakPolarHBondContact CD1-OG 3.35Å; I80-I144 HydrophobicContact CD1-CG1 3.89Å; I80-Q147 HydrophobicContact CG2-CB 3.97Å; I80-Q147 HydrophobicContact CG2-CG 3.89Å
81	F	89.2	Confident	83.1	Confident	78 Å²	78	62.9 Å²	62.9	34%	0.342	33%	0.33	S	S	.	.	H	α-helix	trans	-56	-53.7	175	178.8	-91.2	0	0	0	111.3	D77 E78 L79 R83 T84 Q85 L150	D77-F81 WeakPolarHBondContact O-CB 3.48Å; D77-F81 PolarHBondContact O-N 3.32Å; E78-F81 WeakPolarHBondContact O-CB 3.47Å; E78-F81 PolarHBondContact O-N 2.61Å; L79-F81 VanDerWaalsContact C-N 3.34Å; F81-R83 VanDerWaalsContact C-N 3.31Å; F81-R83 PolarHBondContact O-N 3.41Å; F81-T84 PolarHBondContact O-N 2.99Å; F81-T84 PolarHBondContact O-OG1 3.04Å; F81-Q85 HydrophobicContact CD1-CG 4.31Å; F81-Q85 HydrophobicContact CE1-CG 3.91Å; F81-Q85 HydrophobicContact CZ-CG 4.11Å; F81-Q85 VanDerWaalsContact CZ-NE2 3.34Å; F81-Q85 WeakPolarHBondContact O-CG 3.37Å; F81-Q85 PolarHBondContact O-N 3.26Å; F81-L150 HydrophobicContact CD2-CD2 3.78Å; F81-L150 HydrophobicContact CE2-CD2 3.88Å
82	D	86.4	Confident	83.2	Confident	45 Å²	45	72.6 Å²	72.6	24%	0.241	37%	0.368	C	S	.	.	H	α-helix	trans	-56.7	-43.9	179.8	-76.6	-12.6	0	0	0	112.1	F64 E78 T84 Q85	F64-D82 WeakPolarHBondContact CE2-OD2 3.48Å; E78-D82 PolarHBondContact O-N 3.18Å; D82-T84 VanDerWaalsContact C-N 3.33Å; D82-T84 PolarHBondContact O-N 3.42Å; D82-Q85 PolarHBondContact O-N 3.06Å
83	R	89.6	Confident	83.6	Confident	3 Å²	3	72.6 Å²	72.6	1%	0.011	37%	0.365	C	S	.	.	H	α-helix	trans	-61.8	-41.1	176	176.2	61.6	-174	78.5	0.2	112.3	I41 I61 L79 I80 F81 Q85 M86 V108 A110 Y116	I41-R83 HydrophobicContact CD1-CB 3.49Å; I41-R83 VanDerWaalsContact CD1-CB 3.49Å; I41-R83 HydrophobicContact CD1-CG 3.69Å; I41-R83 HydrophobicContact CG1-CB 4.37Å; I41-R83 HydrophobicContact CG1-CG 4.17Å; I61-R83 HydrophobicContact CD1-CB 3.94Å; L79-R83 PolarHBondContact O-N 2.79Å; L79-R83 VanDerWaalsContact O-N 3.1Å; I80-R83 PolarHBondContact O-N 2.92Å; F81-R83 VanDerWaalsContact C-N 3.31Å; F81-R83 PolarHBondContact O-N 3.41Å; R83-Q85 PolarHBondContact O-N 2.73Å; R83-M86 PolarHBondContact O-N 2.91Å; R83-M86 VanDerWaalsContact O-N 3.17Å; R83-V108 PolarHBondContact NH2-O 3.05Å; R83-A110 PolarHBondContact NH2-O 2.84Å; R83-Y116 HydrophobicContact CB-CE1 4.35Å; R83-Y116 HydrophobicContact CG-CD1 4.14Å; R83-Y116 HydrophobicContact CG-CE1 3.51Å; R83-Y116 HydrophobicContact CG-CE2 4.18Å
84	T	88.7	Confident	84.2	Confident	4 Å²	4	71.6 Å²	71.6	3%	0.025	35%	0.349	C	S	.	.	H	α-helix	trans	-68.5	-21.3	-179.4	57.6	0	0	0	0	113.3	I80 F81 D82 P113 Y116 L117 Q147	I80-T84 HydrophobicContact CG2-CG2 4.41Å; I80-T84 VanDerWaalsContact O-CG2 3.32Å; I80-T84 WeakPolarHBondContact O-CG2 3.37Å; I80-T84 PolarHBondContact O-N 2.79Å; I80-T84 PolarHBondContact O-OG1 2.85Å; F81-T84 PolarHBondContact O-N 2.99Å; F81-T84 PolarHBondContact O-OG1 3.04Å; D82-T84 VanDerWaalsContact C-N 3.33Å; D82-T84 PolarHBondContact O-N 3.42Å; T84-P113 HydrophobicContact CG2-CB 4.27Å; T84-P113 WeakPolarHBondContact O-CG 3.25Å; T84-Y116 HydrophobicContact CG2-CD1 4.4Å; T84-L117 HydrophobicContact CG2-CD1 3.95Å; T84-L117 HydrophobicContact CG2-CD2 3.92Å; T84-L117 HydrophobicContact CG2-CG 3.96Å; T84-Q147 HydrophobicContact CG2-CG 4.05Å; T84-Q147 PolarHBondContact OG1-NE2 3.28Å
85	Q	87.3	Confident	84.7	Confident	110 Å²	110	67 Å²	67	51%	0.514	32%	0.316	S	S	.	.	H	α-helix	trans	-77.5	-21.3	173.3	-61	-57.3	-27.1	0	0	113	F81 D82 R83 R87	F81-Q85 HydrophobicContact CD1-CG 4.31Å; F81-Q85 HydrophobicContact CE1-CG 3.91Å; F81-Q85 HydrophobicContact CZ-CG 4.11Å; F81-Q85 VanDerWaalsContact CZ-NE2 3.34Å; F81-Q85 WeakPolarHBondContact O-CG 3.37Å; F81-Q85 PolarHBondContact O-N 3.26Å; D82-Q85 PolarHBondContact O-N 3.06Å; R83-Q85 PolarHBondContact O-N 2.73Å; Q85-R87 PolarHBondContact O-N 2.87Å
86	M	86.1	Confident	84.9	Confident	68 Å²	68	68.8 Å²	68.8	34%	0.335	33%	0.329	S	S	.	.			trans	-75.2	108.2	179.1	-65.7	-173.1	171.2	0	0	111.6	L59 I61 R83 F89	L59-M86 HydrophobicContact CD2-SD 4.02Å; I61-M86 HydrophobicContact CD1-CE 4.44Å; I61-M86 HydrophobicContact CD1-SD 4.39Å; I61-M86 HydrophobicContact CG1-CE 4.2Å; I61-M86 HydrophobicContact CG1-SD 4.41Å; R83-M86 PolarHBondContact O-N 2.91Å; R83-M86 VanDerWaalsContact O-N 3.17Å; M86-F89 HydrophobicContact CB-CE1 3.88Å; M86-F89 WeakPolarHBondContact O-CZ 3.39Å
87	R	80.9	Confident	84.8	Confident	113 Å²	113	69 Å²	69	43%	0.426	33%	0.33	S	S	.	.			trans	-101.5	-17.7	176.6	-60.7	-81.9	-167	146.8	6.3	113.7	Q85 S111 E162	Q85-R87 PolarHBondContact O-N 2.87Å; R87-S111 WeakPolarHBondContact CD-O 3.38Å; R87-E162 IonicContact CZ-OE1 3.77Å; R87-E162 IonicContact CZ-OE2 3.84Å; R87-E162 IonicContact NH1-OE1 3.89Å; R87-E162 PolarHBondContact NH1-OE1 2.89Å; R87-E162 IonicContact NH1-OE2 3.67Å; R87-E162 IonicContact NH2-OE1 3.73Å; R87-E162 PolarHBondContact NH2-OE1 2.74Å; R87-E162 IonicContact NH2-OE2 2.69Å; R87-E162 PolarHBondContact NH2-OE2 3.02Å
88	K	80.8	Confident	84.1	Confident	195 Å²	195	73.5 Å²	73.5	85%	0.848	35%	0.354	S	S	*	.	S	Bend	trans	-129.3	138.2	179	-67.3	-177.6	-179.2	178.6	0	108.9
89	F	84	Confident	83.3	Confident	46 Å²	46	73.3 Å²	73.3	20%	0.202	36%	0.36	C	S	.	.			trans	-121.5	140.5	-173.8	-48.9	-74	0	0	0	109.9	L59 M86 L109 A110	L59-F89 HydrophobicContact CD1-CD1 4.37Å; L59-F89 HydrophobicContact CD2-CD1 4.1Å; L59-F89 HydrophobicContact CD2-CE1 4.19Å; M86-F89 HydrophobicContact CB-CE1 3.88Å; M86-F89 WeakPolarHBondContact O-CZ 3.39Å; F89-L109 HydrophobicContact CB-CD2 3.63Å; F89-L109 HydrophobicContact CD1-CD2 4.28Å; F89-L109 HydrophobicContact CD2-CB 4.07Å; F89-L109 HydrophobicContact CD2-CD2 4.03Å; F89-L109 HydrophobicContact CE2-CB 4.42Å; F89-L109 WeakPolarHBondContact CE2-O 3.35Å; F89-L109 HydrophobicContact CG-CD2 3.7Å; F89-A110 WeakPolarHBondContact CZ-O 3.48Å
90	N	81.2	Confident	82	Confident	104 Å²	104	74 Å²	74	56%	0.556	37%	0.369	S	S	*	.			trans	-97.7	138.3	170.9	-59.4	-43	0	0	0	109.1	Y92 D93	N90-Y92 PolarHBondContact O-N 3.49Å; N90-Y92 VanDerWaalsContact O-N 3.09Å; N90-D93 PolarHBondContact ND2-OD2 3.36Å; N90-D93 PolarHBondContact O-N 3.08Å
91	D	77.1	Confident	80.8	Confident	141 Å²	141	76.8 Å²	76.8	75%	0.754	39%	0.392	S	S	*	.	G	3₁₀ helix	trans	-57.8	-27.8	177.4	-64.1	-18.1	0	0	0	112.4	D93 V94	D91-D93 PolarHBondContact O-N 2.92Å; D91-V94 PolarHBondContact O-N 3.49Å
92	Y	80.5	Confident	79.8	Confident	205 Å²	205	78 Å²	78	80%	0.804	42%	0.417	S	S	*	.	G	3₁₀ helix	trans	-68.8	-13.9	177.8	-67.3	-70.4	0	0	0	115.2	K45 N90	K45-Y92 PolarHBondContact NZ-O 3.06Å; N90-Y92 PolarHBondContact O-N 3.49Å; N90-Y92 VanDerWaalsContact O-N 3.09Å
93	D	84.1	Confident	79.1	Confident	46 Å²	46	77.4 Å²	77.4	25%	0.246	41%	0.414	C	S	.	.	G	3₁₀ helix	trans	-98.1	-4.2	179	-61.1	-38.3	0	0	0	111.6	K45 L59 Y60 N90 D91	K45-D93 IonicContact NZ-OD1 3.84Å; L59-D93 HydrophobicContact CD1-CB 4.14Å; Y60-D93 WeakPolarHBondContact CB-O 3.35Å; Y60-D93 PolarHBondContact N-O 3.5Å; N90-D93 PolarHBondContact ND2-OD2 3.36Å; N90-D93 PolarHBondContact O-N 3.08Å; D91-D93 PolarHBondContact O-N 2.92Å
94	V	84.8	Confident	78.3	Confident	26 Å²	26	81.2 Å²	81.2	16%	0.158	44%	0.435	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	115	175.3	-175.3	0	0	0	0	110.2	D91 L109	D91-V94 PolarHBondContact O-N 3.49Å; V94-L109 HydrophobicContact CG2-CD2 3.9Å
95	V	84.9	Confident	77.9	Confident	14 Å²	14	84.2 Å²	84.2	9%	0.085	45%	0.45	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	117.3	173.3	-177.7	0	0	0	0	108.2	T42 K45 L47 H57 L58 I97	T42-V95 HydrophobicContact CG2-CB 4.38Å; T42-V95 HydrophobicContact CG2-CG2 3.94Å; K45-V95 HydrophobicContact CG-CG2 4.49Å; L47-V95 HydrophobicContact CD1-CG1 4.4Å; L47-V95 HydrophobicContact CD2-CG1 3.73Å; L47-V95 HydrophobicContact CG-CG1 4.17Å; H57-V95 WeakPolarHBondContact CA-O 3.41Å; L58-V95 HydrophobicContact CB-CB 4.26Å; L58-V95 PolarHBondContact N-O 2.86Å; L58-V95 PolarHBondContact O-N 2.66Å; V95-I97 HydrophobicContact CG1-CG1 4.49Å
96	S	83.7	Confident	77.6	Confident	69 Å²	69	84.2 Å²	84.2	48%	0.483	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	128.8	179.4	-62.6	0	0	0	0	111.2	S56 H57	S56-S96 WeakPolarHBondContact O-CA 3.49Å; H57-S96 PolarHBondContact ND1-OG 2.87Å
97	I	82	Confident	77.4	Confident	7 Å²	7	83.6 Å²	83.6	4%	0.036	45%	0.452	C	S	.	.			trans	-116.7	119.8	-175.5	-58.6	177.5	0	0	0	109.2	L47 E51 R54 S56 L58 V95 T99 G100	L47-I97 HydrophobicContact CD1-CG1 4.03Å; L47-I97 HydrophobicContact CD2-CD1 3.6Å; L47-I97 HydrophobicContact CD2-CG1 3.93Å; E51-I97 HydrophobicContact CB-CG2 3.64Å; E51-I97 HydrophobicContact CG-CG2 3.8Å; R54-I97 HydrophobicContact CB-CD1 3.68Å; S56-I97 PolarHBondContact O-N 2.87Å; L58-I97 HydrophobicContact CD1-CD1 4Å; V95-I97 HydrophobicContact CG1-CG1 4.49Å; I97-T99 VanDerWaalsContact C-N 3.3Å; I97-T99 PolarHBondContact O-N 2.95Å; I97-G100 PolarHBondContact O-N 3.01Å
98	N	72.1	Confident	77.5	Confident	161 Å²	161	78.3 Å²	78.3	86%	0.861	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.9	-23.7	-174.7	-70.3	-30.7	0	0	0	113.7
99	T	67.3	Low	77.7	Confident	98 Å²	98	71.3 Å²	71.3	60%	0.601	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.3	8.1	-177.1	61.2	0	0	0	0	113.8	E51 I97	E51-T99 VanDerWaalsContact CB-OG1 3.26Å; E51-T99 WeakPolarHBondContact CB-OG1 3.48Å; E51-T99 PolarHBondContact OE2-OG1 3.45Å; I97-T99 VanDerWaalsContact C-N 3.3Å; I97-T99 PolarHBondContact O-N 2.95Å
100	G	61.2	Low	77.8	Confident	21 Å²	21	69.8 Å²	69.8	22%	0.216	40%	0.4	C	S	.	.	S	Bend	trans	-77.3	161.7	-173.7	0	0	0	0	0	114.5	R54 I97	R54-G100 CarbonylContact O-C 3.58Å; R54-G100 WeakPolarHBondContact O-CA 3.37Å; I97-G100 PolarHBondContact O-N 3.01Å
101	A	65.1	Low	78	Confident	58 Å²	58	68.2 Å²	68.2	48%	0.479	40%	0.397	S	S	.	.	B	Isolated β-bridge	trans	-60.6	136.3	170.9	0	0	0	0	0	109.9	R54 S56 T103	R54-A101 PolarHBondContact O-N 3.41Å; S56-A101 WeakPolarHBondContact CB-O 3.33Å; S56-A101 PolarHBondContact N-O 3.03Å; S56-A101 PolarHBondContact OG-O 2.98Å; A101-T103 PolarHBondContact O-N 2.66Å
102	A	67.7	Low	78.6	Confident	105 Å²	105	63.2 Å²	63.2	87%	0.868	37%	0.37	S	S	*	.			trans	-58.5	112.6	-175.9	0	0	0	0	0	110.9
103	T	71.2	Confident	79.1	Confident	32 Å²	32	53.8 Å²	53.8	20%	0.196	33%	0.334	C	S	.	.			trans	-123.1	137.9	175.3	47.9	0	0	0	0	110.1	L40 P55 S56 H57 A101	L40-T103 HydrophobicContact CD2-CG2 4.04Å; P55-T103 HydrophobicContact CB-CG2 3.39Å; S56-T103 PolarHBondContact N-OG1 2.96Å; S56-T103 VanDerWaalsContact N-OG1 3.11Å; S56-T103 PolarHBondContact OG-N 2.79Å; S56-T103 PolarHBondContact OG-O 3.48Å; S56-T103 PolarHBondContact OG-OG1 2.95Å; H57-T103 PolarHBondContact CD2-O 2.86Å; H57-T103 PolarHBondContact N-OG1 2.81Å; H57-T103 VanDerWaalsContact N-OG1 3.12Å; A101-T103 PolarHBondContact O-N 2.66Å
104	D	74.5	Confident	79.6	Confident	83 Å²	83	51.6 Å²	51.6	44%	0.444	32%	0.322	S	S	.	.			trans	-73.4	126.9	176.3	-169.7	-12.1	0	0	0	109.4	N106 D107	D104-N106 PolarHBondContact O-N 3.41Å; D104-N106 WeakPolarHBondContact OD1-CB 3.47Å; D104-N106 PolarHBondContact OD1-N 3.12Å; D104-N106 PolarHBondContact OD1-ND2 3.4Å; D104-N106 PolarHBondContact OD2-ND2 2.82Å; D104-D107 WeakPolarHBondContact O-CB 3.37Å; D104-D107 PolarHBondContact O-N 3.12Å
105	I	80	Confident	80	Confident	67 Å²	67	52.5 Å²	52.5	34%	0.344	33%	0.33	S	S	.	.	H	α-helix	trans	-59	-27.2	175.7	-163.4	166.3	0	0	0	111.7	D107 V108 L109	I105-D107 VanDerWaalsContact C-N 3.3Å; I105-D107 PolarHBondContact O-N 3.49Å; I105-V108 WeakPolarHBondContact O-CB 3.41Å; I105-V108 PolarHBondContact O-N 3.16Å; I105-L109 HydrophobicContact CD1-CD1 4.37Å; I105-L109 HydrophobicContact CG1-CD1 3.95Å; I105-L109 HydrophobicContact CG1-CG 4.3Å; I105-L109 WeakPolarHBondContact O-CG 3.27Å; I105-L109 PolarHBondContact O-N 3.33Å
106	N	80.9	Confident	80.4	Confident	109 Å²	109	51.9 Å²	51.9	58%	0.583	33%	0.326	S	S	*	.	H	α-helix	trans	-64.9	-33.3	176.4	-61.7	-48	0	0	0	112.4	D104 V108 L109 A110	D104-N106 PolarHBondContact O-N 3.41Å; D104-N106 WeakPolarHBondContact OD1-CB 3.47Å; D104-N106 PolarHBondContact OD1-N 3.12Å; D104-N106 PolarHBondContact OD1-ND2 3.4Å; D104-N106 PolarHBondContact OD2-ND2 2.82Å; N106-V108 VanDerWaalsContact C-N 3.34Å; N106-L109 CarbonylContact O-C 3.52Å; N106-L109 PolarHBondContact O-N 2.79Å; N106-A110 PolarHBondContact O-N 3.21Å
107	D	80.4	Confident	81	Confident	56 Å²	56	48.6 Å²	48.6	30%	0.299	30%	0.303	S	S	.	.	H	α-helix	trans	-69.8	-34.3	176.1	-83.1	-13.5	0	0	0	111.5	L40 D104 I105 R123	L40-D107 HydrophobicContact CD1-CB 3.9Å; D104-D107 WeakPolarHBondContact O-CB 3.37Å; D104-D107 PolarHBondContact O-N 3.12Å; I105-D107 VanDerWaalsContact C-N 3.3Å; I105-D107 PolarHBondContact O-N 3.49Å; D107-R123 IonicContact OD2-NH1 3.89Å
108	V	83.5	Confident	81.6	Confident	1 Å²	1	48.5 Å²	48.5	1%	0.006	30%	0.303	C	S	.	.	H	α-helix	trans	-69.2	-43.1	175.7	-176.1	0	0	0	0	110.5	L40 H57 L59 R83 I105 N106 A110	L40-V108 HydrophobicContact CB-CG2 4.1Å; L40-V108 HydrophobicContact CD1-CG2 3.82Å; H57-V108 HydrophobicContact CB-CG2 3.76Å; L59-V108 HydrophobicContact CB-CG1 3.88Å; R83-V108 PolarHBondContact NH2-O 3.05Å; I105-V108 WeakPolarHBondContact O-CB 3.41Å; I105-V108 PolarHBondContact O-N 3.16Å; N106-V108 VanDerWaalsContact C-N 3.34Å; V108-A110 VanDerWaalsContact C-N 3.33Å; V108-A110 PolarHBondContact O-N 2.76Å
109	L	85.1	Confident	82.5	Confident	48 Å²	48	42.1 Å²	42.1	25%	0.251	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.3	22	-175.7	-58	-178.7	0	0	0	113.2	F89 V94 I105 N106 S111	F89-L109 HydrophobicContact CB-CD2 3.63Å; F89-L109 HydrophobicContact CD1-CD2 4.28Å; F89-L109 HydrophobicContact CD2-CB 4.07Å; F89-L109 HydrophobicContact CD2-CD2 4.03Å; F89-L109 HydrophobicContact CE2-CB 4.42Å; F89-L109 WeakPolarHBondContact CE2-O 3.35Å; F89-L109 HydrophobicContact CG-CD2 3.7Å; V94-L109 HydrophobicContact CG2-CD2 3.9Å; I105-L109 HydrophobicContact CD1-CD1 4.37Å; I105-L109 HydrophobicContact CG1-CD1 3.95Å; I105-L109 HydrophobicContact CG1-CG 4.3Å; I105-L109 WeakPolarHBondContact O-CG 3.27Å; I105-L109 PolarHBondContact O-N 3.33Å; N106-L109 CarbonylContact O-C 3.52Å; N106-L109 PolarHBondContact O-N 2.79Å; L109-S111 PolarHBondContact O-N 3.08Å; L109-S111 VanDerWaalsContact O-N 3.08Å
110	A	85.8	Confident	83.8	Confident	15 Å²	15	37.5 Å²	37.5	12%	0.124	24%	0.242	C	C	.	.			trans	-61.5	113.6	175.7	0	0	0	0	0	110.2	R83 F89 N106 V108	R83-A110 PolarHBondContact NH2-O 2.84Å; F89-A110 WeakPolarHBondContact CZ-O 3.48Å; N106-A110 PolarHBondContact O-N 3.21Å; V108-A110 VanDerWaalsContact C-N 3.33Å; V108-A110 PolarHBondContact O-N 2.76Å
111	S	85.4	Confident	85.4	Confident	70 Å²	70	36.5 Å²	36.5	49%	0.49	23%	0.232	S	C	.	.			trans	-80.9	-20.8	-179.1	60.5	0	0	0	0	113.2	R87 L109 P113	R87-S111 WeakPolarHBondContact CD-O 3.38Å; L109-S111 PolarHBondContact O-N 3.08Å; L109-S111 VanDerWaalsContact O-N 3.08Å; S111-P113 WeakPolarHBondContact O-CD 3.24Å
112	N	90.1	Very high	86.7	Confident	37 Å²	37	37.2 Å²	37.2	20%	0.198	23%	0.225	C	C	.	.	S	Bend	trans	-86.5	116.4	176.3	-172.6	-54.4	0	0	0	109.9	I114 S115 Y116 N166	N112-I114 VanDerWaalsContact C-N 3.32Å; N112-I114 PolarHBondContact O-N 3.17Å; N112-I114 PolarHBondContact OD1-N 2.77Å; N112-S115 PolarHBondContact O-N 3.26Å; N112-S115 PolarHBondContact OD1-N 2.89Å; N112-S115 VanDerWaalsContact OD1-N 3.12Å; N112-Y116 PolarHBondContact O-N 2.95Å; N112-N166 PolarHBondContact ND2-ND2 2.85Å; N112-N166 PolarHBondContact ND2-OD1 2.85Å; N112-N166 VanDerWaalsContact ND2-OD1 3.15Å
113	P	92.2	Very high	87.8	Confident	6 Å²	6	33.8 Å²	33.8	4%	0.039	19%	0.19	C	C	.	.	H	α-helix	trans	-57.8	-42.5	-177.6	-26.7	36	0	0	0	113.3	T84 S111 Y116 L117 L151	T84-P113 HydrophobicContact CG2-CB 4.27Å; T84-P113 WeakPolarHBondContact O-CG 3.25Å; S111-P113 WeakPolarHBondContact O-CD 3.24Å; P113-Y116 PolarHBondContact O-N 3.05Å; P113-L117 VanDerWaalsContact O-CG 3.23Å; P113-L117 WeakPolarHBondContact O-CG 3.28Å; P113-L117 PolarHBondContact O-N 3.29Å; P113-L151 HydrophobicContact CB-CD1 3.83Å
114	I	94.5	Very high	88.7	Confident	0 Å²	0	32.3 Å²	32.3	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-68.4	-44.5	-178.8	-63.6	-68.4	0	0	0	110.5	N112 Y116 L117 V118 I148 L151 N166 L167 I170	N112-I114 VanDerWaalsContact C-N 3.32Å; N112-I114 PolarHBondContact O-N 3.17Å; N112-I114 PolarHBondContact OD1-N 2.77Å; I114-Y116 VanDerWaalsContact C-N 3.28Å; I114-Y116 PolarHBondContact O-N 3.09Å; I114-L117 PolarHBondContact O-N 3Å; I114-V118 HydrophobicContact CG2-CG2 4.16Å; I114-V118 WeakPolarHBondContact O-CG2 3.38Å; I114-V118 PolarHBondContact O-N 3.18Å; I114-I148 HydrophobicContact CD1-CG2 4.18Å; I114-L151 HydrophobicContact CD1-CB 4.26Å; I114-L151 HydrophobicContact CD1-CD1 3.72Å; I114-L151 HydrophobicContact CG1-CD1 4.35Å; I114-N166 HydrophobicContact CB-CB 4.1Å; I114-N166 HydrophobicContact CG1-CB 4.38Å; I114-N166 HydrophobicContact CG2-CB 4.4Å; I114-L167 HydrophobicContact CG2-CB 4.03Å; I114-L167 HydrophobicContact CG2-CD1 4.21Å; I114-I170 HydrophobicContact CG2-CD1 3.91Å
115	S	92.4	Very high	89.4	Confident	46 Å²	46	30.7 Å²	30.7	32%	0.322	18%	0.175	S	C	.	.	H	α-helix	trans	-58	-43.4	176.3	-168	0	0	0	0	111.6	N112 V118 S119	N112-S115 PolarHBondContact O-N 3.26Å; N112-S115 PolarHBondContact OD1-N 2.89Å; N112-S115 VanDerWaalsContact OD1-N 3.12Å; S115-V118 PolarHBondContact O-N 2.58Å; S115-S119 PolarHBondContact O-N 3.2Å; S115-S119 PolarHBondContact O-OG 3Å
116	Y	94.3	Very high	89.7	Confident	1 Å²	1	32 Å²	32	0%	0.004	19%	0.186	C	C	.	.	H	α-helix	trans	-62.4	-45.6	177.2	168	-101.1	0	0	0	112.2	L39 I41 R83 T84 N112 P113 I114 S119 S120	L39-Y116 VanDerWaalsContact O-CE2 3.29Å; L39-Y116 WeakPolarHBondContact O-CE2 2.95Å; L39-Y116 VanDerWaalsContact O-CZ 3.31Å; L39-Y116 PolarHBondContact O-OH 2.62Å; I41-Y116 WeakPolarHBondContact CD1-OH 3.35Å; R83-Y116 HydrophobicContact CB-CE1 4.35Å; R83-Y116 HydrophobicContact CG-CD1 4.14Å; R83-Y116 HydrophobicContact CG-CE1 3.51Å; R83-Y116 HydrophobicContact CG-CE2 4.18Å; T84-Y116 HydrophobicContact CG2-CD1 4.4Å; N112-Y116 PolarHBondContact O-N 2.95Å; P113-Y116 PolarHBondContact O-N 3.05Å; I114-Y116 VanDerWaalsContact C-N 3.28Å; I114-Y116 PolarHBondContact O-N 3.09Å; Y116-S119 PolarHBondContact O-N 3.44Å; Y116-S120 WeakPolarHBondContact O-CB 3.25Å; Y116-S120 PolarHBondContact O-N 3.09Å; Y116-S120 PolarHBondContact O-OG 2.79Å
117	L	95.5	Very high	89.9	Confident	0 Å²	0	29 Å²	29	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-65.2	-40.6	179.2	-69.3	170.5	0	0	0	111.8	I80 T84 P113 I114 S120 Y121 I144 Q147 I148 L151	I80-L117 HydrophobicContact CG2-CD2 3.42Å; I80-L117 VanDerWaalsContact CG2-CD2 3.42Å; T84-L117 HydrophobicContact CG2-CD1 3.95Å; T84-L117 HydrophobicContact CG2-CD2 3.92Å; T84-L117 HydrophobicContact CG2-CG 3.96Å; P113-L117 VanDerWaalsContact O-CG 3.23Å; P113-L117 WeakPolarHBondContact O-CG 3.28Å; P113-L117 PolarHBondContact O-N 3.29Å; I114-L117 PolarHBondContact O-N 3Å; L117-S120 WeakPolarHBondContact O-CB 3.5Å; L117-S120 PolarHBondContact O-N 3.3Å; L117-Y121 WeakPolarHBondContact O-CB 3.45Å; L117-Y121 PolarHBondContact O-N 2.85Å; L117-I144 HydrophobicContact CB-CG2 4.07Å; L117-I144 HydrophobicContact CD2-CG2 4.13Å; L117-I144 WeakPolarHBondContact O-CG2 3.15Å; L117-Q147 HydrophobicContact CD1-CB 4.21Å; L117-Q147 HydrophobicContact CD1-CG 3.89Å; L117-Q147 HydrophobicContact CD2-CB 4.26Å; L117-Q147 HydrophobicContact CD2-CG 4.19Å; L117-I148 HydrophobicContact CB-CD1 4.13Å; L117-I148 HydrophobicContact CB-CG1 3.87Å; L117-I148 HydrophobicContact CD1-CG1 3.67Å; L117-I148 HydrophobicContact CG-CG1 4.37Å; L117-L151 HydrophobicContact CD1-CD1 3.69Å
118	V	94.1	Very high	89.3	Confident	5 Å²	5	35.9 Å²	35.9	3%	0.03	20%	0.197	C	C	.	.	H	α-helix	trans	-64.1	-46.5	176.7	176.5	0	0	0	0	110.9	I114 S115 S120 Y121 H122 I170 Y185 M189	I114-V118 HydrophobicContact CG2-CG2 4.16Å; I114-V118 WeakPolarHBondContact O-CG2 3.38Å; I114-V118 PolarHBondContact O-N 3.18Å; S115-V118 PolarHBondContact O-N 2.58Å; V118-S120 VanDerWaalsContact C-N 3.28Å; V118-S120 PolarHBondContact O-N 3.19Å; V118-Y121 WeakPolarHBondContact O-CB 3.34Å; V118-Y121 PolarHBondContact O-N 3.17Å; V118-H122 PolarHBondContact O-N 3.27Å; V118-I170 HydrophobicContact CG1-CG2 4.05Å; V118-I170 HydrophobicContact CG2-CD1 4.11Å; V118-I170 HydrophobicContact CG2-CG2 4.33Å; V118-Y185 HydrophobicContact CG1-CE2 4.36Å; V118-M189 HydrophobicContact CB-SD 4.27Å; V118-M189 HydrophobicContact CG1-SD 4.23Å; V118-M189 HydrophobicContact CG2-CE 3.97Å; V118-M189 HydrophobicContact CG2-SD 3.71Å
119	S	92	Very high	88.4	Confident	27 Å²	27	41.2 Å²	41.2	19%	0.189	22%	0.222	C	C	.	.	H	α-helix	trans	-62	-37.7	175.7	-63.9	0	0	0	0	111.7	S115 Y116 H122 R123	S115-S119 PolarHBondContact O-N 3.2Å; S115-S119 PolarHBondContact O-OG 3Å; Y116-S119 PolarHBondContact O-N 3.44Å; S119-H122 PolarHBondContact O-N 2.97Å; S119-R123 WeakPolarHBondContact O-CG 3.33Å; S119-R123 PolarHBondContact O-N 3.2Å
120	S	93.2	Very high	87.3	Confident	0 Å²	0	43 Å²	43	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-65	-42.2	174.6	-56.4	0	0	0	0	111.6	I38 Y116 L117 V118 H122 R123 A124	I38-S120 WeakPolarHBondContact CG2-O 3.49Å; Y116-S120 WeakPolarHBondContact O-CB 3.25Å; Y116-S120 PolarHBondContact O-N 3.09Å; Y116-S120 PolarHBondContact O-OG 2.79Å; L117-S120 WeakPolarHBondContact O-CB 3.5Å; L117-S120 PolarHBondContact O-N 3.3Å; V118-S120 VanDerWaalsContact C-N 3.28Å; V118-S120 PolarHBondContact O-N 3.19Å; S120-H122 VanDerWaalsContact C-N 3.34Å; S120-H122 PolarHBondContact O-N 3.18Å; S120-R123 PolarHBondContact O-N 3.2Å; S120-R123 PolarHBondContact OG-NH2 3.13Å; S120-A124 PolarHBondContact O-N 2.93Å
121	Y	94.8	Very high	86.1	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-62.7	-41.2	175.9	-173.8	-83.9	0	0	0	111.8	L117 V118 A124 C125 R141 I144 V145 M189 E192	L117-Y121 WeakPolarHBondContact O-CB 3.45Å; L117-Y121 PolarHBondContact O-N 2.85Å; V118-Y121 WeakPolarHBondContact O-CB 3.34Å; V118-Y121 PolarHBondContact O-N 3.17Å; Y121-A124 WeakPolarHBondContact O-CB 3.18Å; Y121-A124 PolarHBondContact O-N 3.33Å; Y121-C125 WeakPolarHBondContact CE1-SG 3.37Å; Y121-C125 PolarHBondContact O-N 3.27Å; Y121-C125 PolarHBondContact O-SG 3.03Å; Y121-R141 HydrophobicContact CD2-CG 3.69Å; Y121-R141 HydrophobicContact CE2-CG 3.23Å; Y121-R141 PolarHBondContact OH-NH1 3.08Å; Y121-I144 HydrophobicContact CD2-CG2 4.38Å; Y121-V145 HydrophobicContact CD2-CG2 4.22Å; Y121-V145 HydrophobicContact CE2-CG2 3.87Å; Y121-M189 HydrophobicContact CD1-CB 3.66Å; Y121-M189 HydrophobicContact CD1-CG 3.89Å; Y121-M189 HydrophobicContact CD1-SD 4.49Å; Y121-M189 HydrophobicContact CD2-CB 4.32Å; Y121-M189 HydrophobicContact CD2-CG 3.87Å; Y121-M189 HydrophobicContact CE1-CB 3.44Å; Y121-M189 VanDerWaalsContact CE1-CB 3.44Å; Y121-M189 HydrophobicContact CE1-CG 4.06Å; Y121-M189 HydrophobicContact CE2-CB 4.12Å; Y121-M189 HydrophobicContact CE2-CG 4.02Å; Y121-M189 HydrophobicContact CG-CB 4.11Å; Y121-M189 HydrophobicContact CG-CG 3.8Å; Y121-M189 HydrophobicContact CG-SD 4.33Å; Y121-M189 PolarHBondContact OH-N 2.9Å; Y121-E192 PolarHBondContact OH-OE2 3.47Å
122	H	92.8	Very high	85.2	Confident	74 Å²	74	51 Å²	51	34%	0.343	28%	0.282	S	S	.	.	H	α-helix	trans	-59.2	-49.3	174	174.4	-117.8	0	0	0	111.2	V118 S119 S120 A124 C125 V126 Y185	V118-H122 PolarHBondContact O-N 3.27Å; S119-H122 PolarHBondContact O-N 2.97Å; S120-H122 VanDerWaalsContact C-N 3.34Å; S120-H122 PolarHBondContact O-N 3.18Å; H122-A124 VanDerWaalsContact C-N 3.28Å; H122-A124 PolarHBondContact O-N 3.06Å; H122-C125 WeakPolarHBondContact O-CB 3.48Å; H122-C125 PolarHBondContact O-N 3.37Å; H122-V126 WeakPolarHBondContact O-CG2 3.4Å; H122-V126 PolarHBondContact O-N 2.84Å; H122-V126 VanDerWaalsContact O-N 3.1Å; H122-Y185 HydrophobicContact CB-CD2 4.05Å; H122-Y185 HydrophobicContact CB-CE1 4.44Å; H122-Y185 HydrophobicContact CB-CE2 3.74Å; H122-Y185 AromaticContact CD2-CD1 3.4Å; H122-Y185 WeakPolarHBondContact CD2-CD1 3.38Å; H122-Y185 AromaticContact CD2-CE1 3.29Å; H122-Y185 WeakPolarHBondContact CD2-CE1 3.36Å; H122-Y185 AromaticContact CD2-CG 3.85Å; H122-Y185 AromaticContact CD2-CZ 3.73Å; H122-Y185 AromaticContact CG-CE1 3.96Å; H122-Y185 AromaticContact CG-CZ 3.92Å; H122-Y185 AromaticContact NE2-CE1 3.87Å
123	R	90.8	Very high	84.5	Confident	32 Å²	32	50.6 Å²	50.6	12%	0.121	28%	0.28	C	S	.	.	H	α-helix	trans	-58.3	-40.4	176.2	-70.3	-174.9	-62.5	-97.3	1.1	111.9	N37 I38 D107 S119 S120 C125 V126 I127	N37-R123 WeakPolarHBondContact O-CD 3.48Å; I38-R123 VanDerWaalsContact O-CZ 3.27Å; I38-R123 PolarHBondContact O-NE 3.12Å; I38-R123 PolarHBondContact O-NH2 3.42Å; D107-R123 IonicContact OD2-NH1 3.89Å; S119-R123 WeakPolarHBondContact O-CG 3.33Å; S119-R123 PolarHBondContact O-N 3.2Å; S120-R123 PolarHBondContact O-N 3.2Å; S120-R123 PolarHBondContact OG-NH2 3.13Å; R123-C125 VanDerWaalsContact C-N 3.29Å; R123-C125 PolarHBondContact O-N 3.07Å; R123-V126 PolarHBondContact O-N 3.22Å; R123-I127 WeakPolarHBondContact O-CG1 3.46Å; R123-I127 PolarHBondContact O-N 2.87Å
124	A	90.9	Very high	83.9	Confident	2 Å²	2	51.9 Å²	51.9	2%	0.017	29%	0.288	C	S	.	.	H	α-helix	trans	-61.9	-34.1	174.3	0	0	0	0	0	113.1	I38 S120 Y121 H122 V137	I38-A124 HydrophobicContact CD1-CB 4.13Å; I38-A124 HydrophobicContact CG1-CB 4.34Å; I38-A124 HydrophobicContact CG2-CB 3.92Å; S120-A124 PolarHBondContact O-N 2.93Å; Y121-A124 WeakPolarHBondContact O-CB 3.18Å; Y121-A124 PolarHBondContact O-N 3.33Å; H122-A124 VanDerWaalsContact C-N 3.28Å; H122-A124 PolarHBondContact O-N 3.06Å; A124-V137 HydrophobicContact CB-CG1 4.36Å; A124-V137 VanDerWaalsContact O-CG1 3.29Å; A124-V137 WeakPolarHBondContact O-CG1 3.37Å
125	C	88.8	Confident	83.4	Confident	48 Å²	48	57.1 Å²	57.1	32%	0.324	31%	0.313	S	S	.	.	H	α-helix	trans	-73.8	-31.3	177.6	-68.6	0	0	0	0	113.4	Y121 H122 R123	Y121-C125 WeakPolarHBondContact CE1-SG 3.37Å; Y121-C125 PolarHBondContact O-N 3.27Å; Y121-C125 PolarHBondContact O-SG 3.03Å; H122-C125 WeakPolarHBondContact O-CB 3.48Å; H122-C125 PolarHBondContact O-N 3.37Å; R123-C125 VanDerWaalsContact C-N 3.29Å; R123-C125 PolarHBondContact O-N 3.07Å
126	V	86.4	Confident	83	Confident	95 Å²	95	56.6 Å²	56.6	58%	0.576	31%	0.306	S	S	*	.	H	α-helix	trans	-80.9	-24	-175.6	175.6	0	0	0	0	112.5	H122 R123 K128	H122-V126 WeakPolarHBondContact O-CG2 3.4Å; H122-V126 PolarHBondContact O-N 2.84Å; H122-V126 VanDerWaalsContact O-N 3.1Å; R123-V126 PolarHBondContact O-N 3.22Å; V126-K128 PolarHBondContact O-N 3.18Å
127	I	84.2	Confident	82.7	Confident	46 Å²	46	56.7 Å²	56.7	24%	0.236	31%	0.307	C	S	.	.	S	Bend	trans	-65.5	120.8	-178.6	-70.6	169.3	0	0	0	110.9	I34 I38 R123 Q129 V137	I34-I127 HydrophobicContact CG2-CD1 4.35Å; I38-I127 HydrophobicContact CD1-CD1 3.81Å; I38-I127 HydrophobicContact CG1-CD1 3.31Å; R123-I127 WeakPolarHBondContact O-CG1 3.46Å; R123-I127 PolarHBondContact O-N 2.87Å; I127-Q129 PolarHBondContact O-N 2.96Å; I127-V137 HydrophobicContact CG2-CG2 4.26Å
128	K	67.9	Low	82.4	Confident	200 Å²	200	58.5 Å²	58.5	87%	0.87	32%	0.316	S	S	*	.			trans	-64.7	115.8	177.1	-72.2	-174.8	179.5	179.3	0	110.4	V126 T130	V126-K128 PolarHBondContact O-N 3.18Å; K128-T130 PolarHBondContact O-N 2.93Å
129	Q	64.6	Low	82.1	Confident	113 Å²	113	61.2 Å²	61.2	53%	0.528	33%	0.33	S	S	.	.			trans	-73.6	117.3	-177.4	-63.5	-176.6	-0.3	0	0	111.5	I127 S134	I127-Q129 PolarHBondContact O-N 2.96Å; Q129-S134 VanDerWaalsContact CD-OG 3.32Å; Q129-S134 PolarHBondContact OE1-OG 2.76Å
130	T	62.4	Low	82	Confident	85 Å²	85	60 Å²	60	52%	0.521	32%	0.321	S	S	.	.			trans	-90.9	145.6	160.1	56.2	0	0	0	0	108.8	K128 A132 L133 S134	K128-T130 PolarHBondContact O-N 2.93Å; T130-A132 PolarHBondContact O-N 3.34Å; T130-L133 PolarHBondContact O-N 3.18Å; T130-S134 PolarHBondContact O-N 3.37Å
131	N	60.7	Low	82	Confident	169 Å²	169	60.8 Å²	60.8	90%	0.904	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.1	-31.3	-170.6	-75.7	-7.4	0	0	0	114.6
132	A	66.5	Low	81.8	Confident	84 Å²	84	65 Å²	65	69%	0.694	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.2	-25.3	-178.6	0	0	0	0	0	114.3	T130	T130-A132 PolarHBondContact O-N 3.34Å
133	L	74.9	Confident	81.8	Confident	30 Å²	30	61.5 Å²	61.5	16%	0.157	33%	0.326	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.4	-9.7	-173.7	-62.3	167.2	0	0	0	112.9	V31 I34 T130 Q135 I136 V137	V31-L133 HydrophobicContact CG2-CD2 3.97Å; I34-L133 HydrophobicContact CD1-CB 3.93Å; I34-L133 HydrophobicContact CD1-CD1 3.45Å; I34-L133 VanDerWaalsContact CD1-CD1 3.45Å; I34-L133 HydrophobicContact CD1-CD2 4.3Å; I34-L133 HydrophobicContact CD1-CG 4.07Å; T130-L133 PolarHBondContact O-N 3.18Å; L133-Q135 VanDerWaalsContact C-N 3.27Å; L133-Q135 PolarHBondContact O-N 3.44Å; L133-I136 HydrophobicContact CD2-CD1 3.83Å; L133-I136 PolarHBondContact O-N 2.75Å; L133-V137 PolarHBondContact O-N 2.99Å
134	S	80.5	Confident	82.1	Confident	32 Å²	32	60 Å²	60	22%	0.224	32%	0.32	C	S	.	.	H	α-helix	trans	-53.2	-42.6	176.1	178.7	0	0	0	0	112.5	Q129 T130 I136 V137 E138	Q129-S134 VanDerWaalsContact CD-OG 3.32Å; Q129-S134 PolarHBondContact OE1-OG 2.76Å; T130-S134 PolarHBondContact O-N 3.37Å; S134-I136 PolarHBondContact O-N 2.99Å; S134-V137 PolarHBondContact O-N 3.44Å; S134-E138 WeakPolarHBondContact O-CB 3.45Å; S134-E138 PolarHBondContact O-N 2.9Å
135	Q	83.4	Confident	82.2	Confident	110 Å²	110	60.1 Å²	60.1	51%	0.514	32%	0.321	S	S	.	.	H	α-helix	trans	-63.4	-40.4	-178.7	-171.9	59.5	46.1	0	0	112.5	L133 E138 D139	L133-Q135 VanDerWaalsContact C-N 3.27Å; L133-Q135 PolarHBondContact O-N 3.44Å; Q135-E138 WeakPolarHBondContact O-CB 3.32Å; Q135-E138 PolarHBondContact O-N 3.4Å; Q135-D139 PolarHBondContact NE2-OD1 3.42Å; Q135-D139 WeakPolarHBondContact O-CB 3.21Å; Q135-D139 PolarHBondContact O-N 2.84Å
136	I	85.3	Confident	82.4	Confident	36 Å²	36	62.2 Å²	62.2	19%	0.185	32%	0.322	C	S	.	.	H	α-helix	trans	-67.2	-41.3	179.2	-69.6	129.8	0	0	0	111.4	V31 L35 L133 S134 E138 D139 C140	V31-I136 HydrophobicContact CG1-CG2 4.14Å; V31-I136 HydrophobicContact CG2-CD1 3.69Å; V31-I136 HydrophobicContact CG2-CG1 4.47Å; L35-I136 HydrophobicContact CD1-CG2 4.46Å; L35-I136 HydrophobicContact CD2-CG2 3.98Å; L35-I136 HydrophobicContact CG-CG2 4.27Å; L133-I136 HydrophobicContact CD2-CD1 3.83Å; L133-I136 PolarHBondContact O-N 2.75Å; S134-I136 PolarHBondContact O-N 2.99Å; I136-E138 VanDerWaalsContact C-N 3.28Å; I136-E138 PolarHBondContact O-N 3.24Å; I136-D139 PolarHBondContact O-N 3.21Å; I136-C140 WeakPolarHBondContact O-CB 3.42Å; I136-C140 PolarHBondContact O-N 3.21Å
137	V	88.1	Confident	82.8	Confident	3 Å²	3	58.1 Å²	58.1	2%	0.018	30%	0.297	C	S	.	.	H	α-helix	trans	-62.1	-41.6	175.5	177.3	0	0	0	0	110	I34 I38 A124 I127 L133 S134 C140 R141	I34-V137 HydrophobicContact CG2-CG2 3.86Å; I38-V137 HydrophobicContact CD1-CG1 4.27Å; I38-V137 HydrophobicContact CD1-CG2 4.36Å; A124-V137 HydrophobicContact CB-CG1 4.36Å; A124-V137 VanDerWaalsContact O-CG1 3.29Å; A124-V137 WeakPolarHBondContact O-CG1 3.37Å; I127-V137 HydrophobicContact CG2-CG2 4.26Å; L133-V137 PolarHBondContact O-N 2.99Å; S134-V137 PolarHBondContact O-N 3.44Å; V137-C140 PolarHBondContact O-N 2.97Å; V137-R141 VanDerWaalsContact O-CB 3.3Å; V137-R141 WeakPolarHBondContact O-CB 3.48Å; V137-R141 PolarHBondContact O-N 3.46Å
138	E	87.8	Confident	83.3	Confident	38 Å²	38	55.9 Å²	55.9	18%	0.178	29%	0.285	C	S	.	.	H	α-helix	trans	-64.7	-41.1	176.2	-175.9	58.8	-161.2	0	0	112.6	S134 Q135 I136 R141 K142	S134-E138 WeakPolarHBondContact O-CB 3.45Å; S134-E138 PolarHBondContact O-N 2.9Å; Q135-E138 WeakPolarHBondContact O-CB 3.32Å; Q135-E138 PolarHBondContact O-N 3.4Å; I136-E138 VanDerWaalsContact C-N 3.28Å; I136-E138 PolarHBondContact O-N 3.24Å; E138-R141 WeakPolarHBondContact O-CB 3.19Å; E138-R141 PolarHBondContact O-N 2.96Å; E138-R141 IonicContact OE1-CZ 2.82Å; E138-R141 IonicContact OE1-NE 3.97Å; E138-R141 IonicContact OE1-NH2 3.72Å; E138-R141 PolarHBondContact OE1-NH2 3.23Å; E138-R141 IonicContact OE2-CZ 3.39Å; E138-R141 IonicContact OE2-NE 3.09Å; E138-R141 PolarHBondContact OE2-NE 2.95Å; E138-R141 IonicContact OE2-NH2 3.59Å; E138-R141 PolarHBondContact OE2-NH2 2.89Å; E138-K142 WeakPolarHBondContact O-CG 3.29Å; E138-K142 PolarHBondContact O-N 3.09Å; E138-K142 VanDerWaalsContact OE1-CE 3.31Å; E138-K142 WeakPolarHBondContact OE1-CE 3.46Å
139	D	87.6	Confident	84.4	Confident	62 Å²	62	46.5 Å²	46.5	33%	0.332	25%	0.245	S	C	.	.	H	α-helix	trans	-67.5	-40.5	177.5	-66.1	-22.2	0	0	0	111.4	Q135 I136 K142 S143	Q135-D139 PolarHBondContact NE2-OD1 3.42Å; Q135-D139 WeakPolarHBondContact O-CB 3.21Å; Q135-D139 PolarHBondContact O-N 2.84Å; I136-D139 PolarHBondContact O-N 3.21Å; D139-K142 PolarHBondContact O-N 3.36Å; D139-S143 WeakPolarHBondContact O-CB 3.47Å; D139-S143 PolarHBondContact O-N 3.22Å
140	C	91	Very high	85.7	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-61.2	-44	172.5	-174.5	0	0	0	0	111.4	L35 I38 L76 I136 V137 K142 S143 I144	L35-C140 HydrophobicContact CD2-CB 3.75Å; I38-C140 HydrophobicContact CD1-CB 4.42Å; L76-C140 HydrophobicContact CD1-CB 4.22Å; I136-C140 WeakPolarHBondContact O-CB 3.42Å; I136-C140 PolarHBondContact O-N 3.21Å; V137-C140 PolarHBondContact O-N 2.97Å; C140-K142 PolarHBondContact O-N 3.04Å; C140-S143 WeakPolarHBondContact O-CB 3.36Å; C140-S143 PolarHBondContact O-N 3.04Å; C140-S143 VanDerWaalsContact O-N 3.16Å; C140-I144 WeakPolarHBondContact O-CG1 3.47Å; C140-I144 PolarHBondContact O-N 3.01Å
141	R	92.7	Very high	87	Confident	17 Å²	17	41.2 Å²	41.2	6%	0.064	22%	0.217	C	C	.	.	H	α-helix	trans	-60	-45.2	176.4	-167.7	170.7	74.8	99.3	9.3	112.2	Y121 V137 E138 S143 I144 V145 E192	Y121-R141 HydrophobicContact CD2-CG 3.69Å; Y121-R141 HydrophobicContact CE2-CG 3.23Å; Y121-R141 PolarHBondContact OH-NH1 3.08Å; V137-R141 VanDerWaalsContact O-CB 3.3Å; V137-R141 WeakPolarHBondContact O-CB 3.48Å; V137-R141 PolarHBondContact O-N 3.46Å; E138-R141 WeakPolarHBondContact O-CB 3.19Å; E138-R141 PolarHBondContact O-N 2.96Å; E138-R141 IonicContact OE1-CZ 2.82Å; E138-R141 IonicContact OE1-NE 3.97Å; E138-R141 IonicContact OE1-NH2 3.72Å; E138-R141 PolarHBondContact OE1-NH2 3.23Å; E138-R141 IonicContact OE2-CZ 3.39Å; E138-R141 IonicContact OE2-NE 3.09Å; E138-R141 PolarHBondContact OE2-NE 2.95Å; E138-R141 IonicContact OE2-NH2 3.59Å; E138-R141 PolarHBondContact OE2-NH2 2.89Å; R141-S143 VanDerWaalsContact C-N 3.34Å; R141-S143 PolarHBondContact O-N 2.73Å; R141-I144 PolarHBondContact O-N 2.97Å; R141-V145 WeakPolarHBondContact O-CG2 3.48Å; R141-V145 PolarHBondContact O-N 2.91Å; R141-E192 IonicContact CZ-OE1 3.03Å; R141-E192 IonicContact CZ-OE2 3.58Å; R141-E192 IonicContact NH1-OE1 3.28Å; R141-E192 PolarHBondContact NH1-OE1 2.93Å; R141-E192 IonicContact NH1-OE2 2.75Å; R141-E192 PolarHBondContact NH1-OE2 3.25Å; R141-E192 IonicContact NH2-OE1 3.08Å; R141-E192 PolarHBondContact NH2-OE1 3.25Å; R141-E192 IonicContact NH2-OE2 3.46Å
142	K	91.5	Very high	88.5	Confident	89 Å²	89	33.2 Å²	33.2	39%	0.387	17%	0.174	S	C	.	.	H	α-helix	trans	-63.7	-38	174.1	-72	172.9	-177.2	169.6	0	112.5	E138 D139 C140 V145 R146	E138-K142 WeakPolarHBondContact O-CG 3.29Å; E138-K142 PolarHBondContact O-N 3.09Å; E138-K142 VanDerWaalsContact OE1-CE 3.31Å; E138-K142 WeakPolarHBondContact OE1-CE 3.46Å; D139-K142 PolarHBondContact O-N 3.36Å; C140-K142 PolarHBondContact O-N 3.04Å; K142-V145 PolarHBondContact O-N 3.42Å; K142-R146 WeakPolarHBondContact O-CG 3.34Å; K142-R146 PolarHBondContact O-N 2.61Å
143	S	92.7	Very high	89.5	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-64.3	-43.4	175.8	-175	0	0	0	0	111.8	D77 I80 D139 C140 R141 V145 R146 Q147	D77-S143 PolarHBondContact N-OG 2.87Å; D77-S143 WeakPolarHBondContact OD1-CA 3.48Å; D77-S143 VanDerWaalsContact OD1-CB 3.28Å; D77-S143 WeakPolarHBondContact OD1-CB 3.34Å; D77-S143 PolarHBondContact OD1-OG 2.83Å; I80-S143 WeakPolarHBondContact CD1-OG 3.35Å; D139-S143 WeakPolarHBondContact O-CB 3.47Å; D139-S143 PolarHBondContact O-N 3.22Å; C140-S143 WeakPolarHBondContact O-CB 3.36Å; C140-S143 PolarHBondContact O-N 3.04Å; C140-S143 VanDerWaalsContact O-N 3.16Å; R141-S143 VanDerWaalsContact C-N 3.34Å; R141-S143 PolarHBondContact O-N 2.73Å; S143-V145 VanDerWaalsContact C-N 3.35Å; S143-V145 PolarHBondContact O-N 3.39Å; S143-R146 PolarHBondContact O-N 3.21Å; S143-Q147 PolarHBondContact O-N 3.16Å
144	I	95.2	Very high	90.1	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-58.4	-46.5	172.2	-66.9	165.2	0	0	0	110.8	I38 L39 I80 L117 Y121 C140 R141 R146 Q147 I148	I38-I144 HydrophobicContact CG2-CD1 4.04Å; L39-I144 HydrophobicContact CD2-CD1 4.23Å; L39-I144 HydrophobicContact CD2-CG1 4.32Å; I80-I144 HydrophobicContact CD1-CG1 3.89Å; L117-I144 HydrophobicContact CB-CG2 4.07Å; L117-I144 HydrophobicContact CD2-CG2 4.13Å; L117-I144 WeakPolarHBondContact O-CG2 3.15Å; Y121-I144 HydrophobicContact CD2-CG2 4.38Å; C140-I144 WeakPolarHBondContact O-CG1 3.47Å; C140-I144 PolarHBondContact O-N 3.01Å; R141-I144 PolarHBondContact O-N 2.97Å; I144-R146 PolarHBondContact O-N 2.96Å; I144-Q147 PolarHBondContact O-N 2.69Å; I144-I148 HydrophobicContact CG2-CD1 4.26Å; I144-I148 WeakPolarHBondContact O-CG1 3.19Å; I144-I148 PolarHBondContact O-N 3.35Å
145	V	94.8	Very high	90.4	Very high	5 Å²	5	33.4 Å²	33.4	3%	0.03	16%	0.163	C	C	.	.	H	α-helix	trans	-60.1	-45.2	177.3	169.3	0	0	0	0	111.3	Y121 R141 K142 S143 Q147 I148 V149 E192 V193 H196	Y121-V145 HydrophobicContact CD2-CG2 4.22Å; Y121-V145 HydrophobicContact CE2-CG2 3.87Å; R141-V145 WeakPolarHBondContact O-CG2 3.48Å; R141-V145 PolarHBondContact O-N 2.91Å; K142-V145 PolarHBondContact O-N 3.42Å; S143-V145 VanDerWaalsContact C-N 3.35Å; S143-V145 PolarHBondContact O-N 3.39Å; V145-Q147 VanDerWaalsContact C-N 3.3Å; V145-Q147 PolarHBondContact O-N 3.26Å; V145-I148 PolarHBondContact O-N 3.33Å; V145-V149 WeakPolarHBondContact O-CG2 3.45Å; V145-V149 PolarHBondContact O-N 3.26Å; V145-E192 HydrophobicContact CG1-CB 4.33Å; V145-E192 HydrophobicContact CG2-CB 4.05Å; V145-V193 HydrophobicContact CG1-CG2 4.01Å; V145-V193 HydrophobicContact CG2-CG2 4.44Å; V145-H196 HydrophobicContact CG1-CB 4.3Å
146	R	93	Very high	90.4	Very high	92 Å²	92	29.3 Å²	29.3	35%	0.347	15%	0.148	S	C	.	.	H	α-helix	trans	-58.3	-41.6	175.6	-77	-171	-63.1	-98.5	8.1	112.1	D77 K142 S143 I144 V149 L150 H196	D77-R146 IonicContact OD1-CZ 2.69Å; D77-R146 IonicContact OD1-NE 2.64Å; D77-R146 PolarHBondContact OD1-NE 2.99Å; D77-R146 VanDerWaalsContact OD1-NE 3.1Å; D77-R146 IonicContact OD1-NH2 3.26Å; D77-R146 PolarHBondContact OD1-NH2 3.29Å; D77-R146 IonicContact OD2-CZ 3.76Å; D77-R146 IonicContact OD2-NE 2.92Å; D77-R146 IonicContact OD2-NH2 3.42Å; D77-R146 PolarHBondContact OD2-NH2 2.73Å; K142-R146 WeakPolarHBondContact O-CG 3.34Å; K142-R146 PolarHBondContact O-N 2.61Å; S143-R146 PolarHBondContact O-N 3.21Å; I144-R146 PolarHBondContact O-N 2.96Å; R146-V149 PolarHBondContact O-N 3.43Å; R146-L150 PolarHBondContact O-N 3.34Å; R146-H196 WeakPolarHBondContact CG-NE2 3.27Å
147	Q	93.8	Very high	90.4	Very high	9 Å²	9	35.8 Å²	35.8	4%	0.042	18%	0.177	C	C	.	.	H	α-helix	trans	-67.8	-37.2	178.4	-171	61.8	17.5	0	0	112.4	I80 T84 L117 S143 I144 V145 V149 L150 L151	I80-Q147 HydrophobicContact CG2-CB 3.97Å; I80-Q147 HydrophobicContact CG2-CG 3.89Å; T84-Q147 HydrophobicContact CG2-CG 4.05Å; T84-Q147 PolarHBondContact OG1-NE2 3.28Å; L117-Q147 HydrophobicContact CD1-CB 4.21Å; L117-Q147 HydrophobicContact CD1-CG 3.89Å; L117-Q147 HydrophobicContact CD2-CB 4.26Å; L117-Q147 HydrophobicContact CD2-CG 4.19Å; S143-Q147 PolarHBondContact O-N 3.16Å; I144-Q147 PolarHBondContact O-N 2.69Å; V145-Q147 VanDerWaalsContact C-N 3.3Å; V145-Q147 PolarHBondContact O-N 3.26Å; Q147-V149 VanDerWaalsContact C-N 3.34Å; Q147-L150 WeakPolarHBondContact O-CB 3.3Å; Q147-L150 PolarHBondContact O-N 3.41Å; Q147-L151 WeakPolarHBondContact O-CG 3.39Å; Q147-L151 PolarHBondContact O-N 3.34Å
148	I	94.3	Very high	90.3	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-61.4	-45.9	172.2	-65	171.4	0	0	0	110	I114 L117 I144 V145 L150 L151 L152 L167 M189 V193	I114-I148 HydrophobicContact CD1-CG2 4.18Å; L117-I148 HydrophobicContact CB-CD1 4.13Å; L117-I148 HydrophobicContact CB-CG1 3.87Å; L117-I148 HydrophobicContact CD1-CG1 3.67Å; L117-I148 HydrophobicContact CG-CG1 4.37Å; I144-I148 HydrophobicContact CG2-CD1 4.26Å; I144-I148 WeakPolarHBondContact O-CG1 3.19Å; I144-I148 PolarHBondContact O-N 3.35Å; V145-I148 PolarHBondContact O-N 3.33Å; I148-L150 VanDerWaalsContact C-N 3.33Å; I148-L150 PolarHBondContact O-N 2.83Å; I148-L151 PolarHBondContact O-N 3.21Å; I148-L152 HydrophobicContact CG2-CD1 4.36Å; I148-L152 WeakPolarHBondContact O-CG 3.49Å; I148-L152 PolarHBondContact O-N 3.04Å; I148-L152 VanDerWaalsContact O-N 3.08Å; I148-L167 HydrophobicContact CG2-CD2 4.38Å; I148-M189 HydrophobicContact CD1-CG 4.36Å; I148-M189 HydrophobicContact CD1-SD 3.87Å; I148-V193 HydrophobicContact CB-CG2 4.15Å; I148-V193 HydrophobicContact CD1-CG2 4.2Å; I148-V193 HydrophobicContact CG2-CG1 3.99Å; I148-V193 HydrophobicContact CG2-CG2 3.86Å
149	V	92.5	Very high	90	Very high	3 Å²	3	44.3 Å²	44.3	2%	0.018	23%	0.229	C	C	.	.	H	α-helix	trans	-59.6	-44.5	177.4	171.4	0	0	0	0	111	V145 R146 Q147 L151 L152 L153 V193 H196 L197	V145-V149 WeakPolarHBondContact O-CG2 3.45Å; V145-V149 PolarHBondContact O-N 3.26Å; R146-V149 PolarHBondContact O-N 3.43Å; Q147-V149 VanDerWaalsContact C-N 3.34Å; V149-L151 VanDerWaalsContact C-N 3.34Å; V149-L151 PolarHBondContact O-N 3.12Å; V149-L152 PolarHBondContact O-N 3.35Å; V149-L152 VanDerWaalsContact O-N 3.15Å; V149-L153 HydrophobicContact CG1-CD1 4.08Å; V149-L153 HydrophobicContact CG1-CG 4.41Å; V149-L153 WeakPolarHBondContact O-CG 3.21Å; V149-L153 PolarHBondContact O-N 3.34Å; V149-V193 HydrophobicContact CG2-CG1 4.09Å; V149-H196 HydrophobicContact CG2-CB 4.13Å; V149-L197 HydrophobicContact CG1-CB 4.34Å; V149-L197 HydrophobicContact CG1-CD1 4.35Å; V149-L197 HydrophobicContact CG1-CG 4.47Å; V149-L197 HydrophobicContact CG2-CB 4.49Å
150	L	90.6	Very high	90	Very high	68 Å²	68	45.3 Å²	45.3	36%	0.356	24%	0.235	S	C	.	.	H	α-helix	trans	-56.3	-47.4	176.3	-171.2	87.7	0	0	0	111.4	F81 R146 Q147 I148 L152 L153 V154	F81-L150 HydrophobicContact CD2-CD2 3.78Å; F81-L150 HydrophobicContact CE2-CD2 3.88Å; R146-L150 PolarHBondContact O-N 3.34Å; Q147-L150 WeakPolarHBondContact O-CB 3.3Å; Q147-L150 PolarHBondContact O-N 3.41Å; I148-L150 VanDerWaalsContact C-N 3.33Å; I148-L150 PolarHBondContact O-N 2.83Å; L150-L152 VanDerWaalsContact C-N 3.31Å; L150-L152 PolarHBondContact O-N 3.4Å; L150-L153 PolarHBondContact O-N 3.3Å; L150-L153 VanDerWaalsContact O-N 3.16Å; L150-V154 WeakPolarHBondContact O-CG2 3.44Å; L150-V154 PolarHBondContact O-N 3.21Å
151	L	91.2	Very high	89.9	Confident	19 Å²	19	47.7 Å²	47.7	10%	0.099	25%	0.25	C	S	.	.	H	α-helix	trans	-61.4	-39	178.1	-70.5	171.3	0	0	0	112.1	P113 I114 L117 Q147 I148 V149 L153 V154 D155	P113-L151 HydrophobicContact CB-CD1 3.83Å; I114-L151 HydrophobicContact CD1-CB 4.26Å; I114-L151 HydrophobicContact CD1-CD1 3.72Å; I114-L151 HydrophobicContact CG1-CD1 4.35Å; L117-L151 HydrophobicContact CD1-CD1 3.69Å; Q147-L151 WeakPolarHBondContact O-CG 3.39Å; Q147-L151 PolarHBondContact O-N 3.34Å; I148-L151 PolarHBondContact O-N 3.21Å; V149-L151 VanDerWaalsContact C-N 3.34Å; V149-L151 PolarHBondContact O-N 3.12Å; L151-L153 VanDerWaalsContact C-N 3.35Å; L151-V154 PolarHBondContact O-N 3.34Å; L151-D155 PolarHBondContact O-N 3.43Å
152	L	90.6	Very high	89.8	Confident	1 Å²	1	50.1 Å²	50.1	1%	0.005	26%	0.262	C	S	.	.	H	α-helix	trans	-68.3	-32.2	175.8	-65.2	176.7	0	0	0	113	I148 V149 L150 A156 L167 V193 L219	I148-L152 HydrophobicContact CG2-CD1 4.36Å; I148-L152 WeakPolarHBondContact O-CG 3.49Å; I148-L152 PolarHBondContact O-N 3.04Å; I148-L152 VanDerWaalsContact O-N 3.08Å; V149-L152 PolarHBondContact O-N 3.35Å; V149-L152 VanDerWaalsContact O-N 3.15Å; L150-L152 VanDerWaalsContact C-N 3.31Å; L150-L152 PolarHBondContact O-N 3.4Å; L152-A156 PolarHBondContact O-N 3.1Å; L152-L167 HydrophobicContact CD1-CD2 3.98Å; L152-L167 HydrophobicContact CD2-CD2 4.24Å; L152-V193 HydrophobicContact CD1-CG1 3.95Å; L152-L219 HydrophobicContact CD1-CD2 4.45Å
153	L	88.1	Confident	89.8	Confident	66 Å²	66	46.3 Å²	46.3	35%	0.346	25%	0.247	S	C	.	.	H	α-helix	trans	-71.3	-40.8	173.9	-67.8	172.6	0	0	0	111.2	V149 L150 L151 A156 E157	V149-L153 HydrophobicContact CG1-CD1 4.08Å; V149-L153 HydrophobicContact CG1-CG 4.41Å; V149-L153 WeakPolarHBondContact O-CG 3.21Å; V149-L153 PolarHBondContact O-N 3.34Å; L150-L153 PolarHBondContact O-N 3.3Å; L150-L153 VanDerWaalsContact O-N 3.16Å; L151-L153 VanDerWaalsContact C-N 3.35Å; L153-A156 WeakPolarHBondContact O-CA 3.42Å; L153-A156 VanDerWaalsContact O-CB 3.22Å; L153-A156 WeakPolarHBondContact O-CB 3.4Å; L153-A156 PolarHBondContact O-N 3.47Å; L153-A156 VanDerWaalsContact O-N 3.07Å; L153-E157 PolarHBondContact O-N 3.06Å; L153-E157 VanDerWaalsContact O-N 3.12Å
154	V	87.6	Confident	89.7	Confident	74 Å²	74	46.4 Å²	46.4	45%	0.448	25%	0.247	S	C	.	.	H	α-helix	trans	-63	-41.3	175.1	172	0	0	0	0	111.4	L150 L151 A156 E157 S158	L150-V154 WeakPolarHBondContact O-CG2 3.44Å; L150-V154 PolarHBondContact O-N 3.21Å; L151-V154 PolarHBondContact O-N 3.34Å; V154-A156 PolarHBondContact O-N 3.31Å; V154-E157 PolarHBondContact O-N 3.33Å; V154-S158 WeakPolarHBondContact O-CB 3.42Å; V154-S158 PolarHBondContact O-N 3.4Å; V154-S158 PolarHBondContact O-OG 2.94Å
155	D	87.7	Confident	89.6	Confident	9 Å²	9	48 Å²	48	5%	0.048	26%	0.257	C	S	.	.	H	α-helix	trans	-55.2	-38.8	172.2	-84.6	23.4	0	0	0	111.5	L151 D159 N160 P161 E162 S163 S164	L151-D155 PolarHBondContact O-N 3.43Å; D155-D159 PolarHBondContact O-N 2.82Å; D155-N160 WeakPolarHBondContact CA-O 3.29Å; D155-N160 WeakPolarHBondContact CB-O 3.48Å; D155-N160 PolarHBondContact O-N 3.47Å; D155-P161 WeakPolarHBondContact OD2-CA 3.38Å; D155-E162 PolarHBondContact OD2-N 3.45Å; D155-S163 WeakPolarHBondContact OD1-CB 3.47Å; D155-S163 PolarHBondContact OD1-N 3.36Å; D155-S163 PolarHBondContact OD1-OG 2.91Å; D155-S163 WeakPolarHBondContact OD2-CA 3.44Å; D155-S163 VanDerWaalsContact OD2-CB 3.24Å; D155-S163 WeakPolarHBondContact OD2-CB 3.3Å; D155-S163 PolarHBondContact OD2-N 2.87Å; D155-S164 WeakPolarHBondContact OD2-CB 3.45Å; D155-S164 PolarHBondContact OD2-N 2.79Å
156	A	83	Confident	89.5	Confident	24 Å²	24	49.3 Å²	49.3	20%	0.198	26%	0.264	C	S	.	.	H	α-helix	trans	-69.7	-36.9	-179.7	0	0	0	0	0	113.2	L152 L153 V154	L152-A156 PolarHBondContact O-N 3.1Å; L153-A156 WeakPolarHBondContact O-CA 3.42Å; L153-A156 VanDerWaalsContact O-CB 3.22Å; L153-A156 WeakPolarHBondContact O-CB 3.4Å; L153-A156 PolarHBondContact O-N 3.47Å; L153-A156 VanDerWaalsContact O-N 3.07Å; V154-A156 PolarHBondContact O-N 3.31Å
157	E	85	Confident	89.6	Confident	173 Å²	173	45 Å²	45	81%	0.808	25%	0.248	S	C	*	.	H	α-helix	trans	-80.3	-29.4	179.5	-68.1	-172.6	169.4	0	0	112.8	L153 V154	L153-E157 PolarHBondContact O-N 3.06Å; L153-E157 VanDerWaalsContact O-N 3.12Å; V154-E157 PolarHBondContact O-N 3.33Å
158	S	85.7	Confident	89.7	Confident	67 Å²	67	44.6 Å²	44.6	47%	0.469	25%	0.246	S	C	.	.	H	α-helix	trans	-92.3	-3	-176.2	61.9	0	0	0	0	114.6	V154 N160	V154-S158 WeakPolarHBondContact O-CB 3.42Å; V154-S158 PolarHBondContact O-N 3.4Å; V154-S158 PolarHBondContact O-OG 2.94Å; S158-N160 PolarHBondContact O-N 3.32Å
159	D	81.6	Confident	89.7	Confident	153 Å²	153	46.7 Å²	46.7	82%	0.818	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	52	22.4	-170.8	-74.7	-34.5	0	0	0	113.6	D155	D155-D159 PolarHBondContact O-N 2.82Å
160	N	87.8	Confident	89.8	Confident	83 Å²	83	48 Å²	48	44%	0.444	26%	0.264	S	S	.	.			trans	-117.5	99.6	179.3	-178.7	18.9	0	0	0	110.3	D155 S158 E162	D155-N160 WeakPolarHBondContact CA-O 3.29Å; D155-N160 WeakPolarHBondContact CB-O 3.48Å; D155-N160 PolarHBondContact O-N 3.47Å; S158-N160 PolarHBondContact O-N 3.32Å; N160-E162 PolarHBondContact O-N 2.93Å
161	P	88.2	Confident	90	Very high	50 Å²	50	44.8 Å²	44.8	33%	0.325	25%	0.247	S	C	.	.			trans	-82.5	37.2	-172.3	36.2	-38.5	0	0	0	113.5	D155 T165 P221	D155-P161 WeakPolarHBondContact OD2-CA 3.38Å; P161-T165 VanDerWaalsContact O-CB 3.28Å; P161-T165 WeakPolarHBondContact O-CB 3.41Å; P161-T165 PolarHBondContact O-N 3.18Å; P161-T165 PolarHBondContact O-OG1 2.94Å; P161-P221 HydrophobicContact CB-CB 3.47Å; P161-P221 VanDerWaalsContact CB-CB 3.47Å; P161-P221 HydrophobicContact CB-CG 3.96Å
162	E	90.9	Very high	90.1	Very high	68 Å²	68	46 Å²	46	32%	0.318	25%	0.25	S	S	.	.	H	α-helix	trans	-60.7	-52.6	-175.8	-168.4	-165.6	166.1	0	0	110.7	R87 D155 N160 T165 N166	R87-E162 IonicContact CZ-OE1 3.77Å; R87-E162 IonicContact CZ-OE2 3.84Å; R87-E162 IonicContact NH1-OE1 3.89Å; R87-E162 PolarHBondContact NH1-OE1 2.89Å; R87-E162 IonicContact NH1-OE2 3.67Å; R87-E162 IonicContact NH2-OE1 3.73Å; R87-E162 PolarHBondContact NH2-OE1 2.74Å; R87-E162 IonicContact NH2-OE2 2.69Å; R87-E162 PolarHBondContact NH2-OE2 3.02Å; D155-E162 PolarHBondContact OD2-N 3.45Å; N160-E162 PolarHBondContact O-N 2.93Å; E162-T165 PolarHBondContact O-N 3.13Å; E162-N166 PolarHBondContact O-N 2.98Å; E162-N166 PolarHBondContact O-ND2 3.43Å
163	S	91.6	Very high	90.3	Very high	9 Å²	9	52 Å²	52	6%	0.063	28%	0.278	C	S	.	.	H	α-helix	trans	-65.3	-42.7	-177.3	-44.9	0	0	0	0	111.4	D155 T165 N166 L167	D155-S163 WeakPolarHBondContact OD1-CB 3.47Å; D155-S163 PolarHBondContact OD1-N 3.36Å; D155-S163 PolarHBondContact OD1-OG 2.91Å; D155-S163 WeakPolarHBondContact OD2-CA 3.44Å; D155-S163 VanDerWaalsContact OD2-CB 3.24Å; D155-S163 WeakPolarHBondContact OD2-CB 3.3Å; D155-S163 PolarHBondContact OD2-N 2.87Å; S163-T165 VanDerWaalsContact C-N 3.34Å; S163-T165 PolarHBondContact O-N 3.46Å; S163-N166 PolarHBondContact O-N 3.07Å; S163-L167 WeakPolarHBondContact O-CB 3.34Å; S163-L167 PolarHBondContact O-N 3.04Å
164	S	91.2	Very high	90.5	Very high	1 Å²	1	48.9 Å²	48.9	1%	0.007	26%	0.262	C	S	.	.	H	α-helix	trans	-61.9	-41.1	176.6	-168.3	0	0	0	0	111.9	D155 L167 F168 L222	D155-S164 WeakPolarHBondContact OD2-CB 3.45Å; D155-S164 PolarHBondContact OD2-N 2.79Å; S164-L167 PolarHBondContact O-N 2.87Å; S164-F168 WeakPolarHBondContact O-CB 3.32Å; S164-F168 PolarHBondContact O-N 3.37Å; S164-L222 WeakPolarHBondContact OG-CB 3.23Å; S164-L222 PolarHBondContact OG-N 2.99Å
165	T	91.9	Very high	90.8	Very high	35 Å²	35	45.6 Å²	45.6	22%	0.215	24%	0.242	C	C	.	.	H	α-helix	trans	-66.1	-44.2	176.4	-58.6	0	0	0	0	111.1	P161 E162 S163 L167 F168 D169	P161-T165 VanDerWaalsContact O-CB 3.28Å; P161-T165 WeakPolarHBondContact O-CB 3.41Å; P161-T165 PolarHBondContact O-N 3.18Å; P161-T165 PolarHBondContact O-OG1 2.94Å; E162-T165 PolarHBondContact O-N 3.13Å; S163-T165 VanDerWaalsContact C-N 3.34Å; S163-T165 PolarHBondContact O-N 3.46Å; T165-L167 VanDerWaalsContact C-N 3.35Å; T165-L167 PolarHBondContact O-N 3.03Å; T165-F168 WeakPolarHBondContact O-CB 3.48Å; T165-F168 PolarHBondContact O-N 3.26Å; T165-D169 PolarHBondContact O-N 3.09Å
166	N	93.4	Very high	91	Very high	32 Å²	32	48.2 Å²	48.2	17%	0.171	26%	0.26	C	S	.	.	H	α-helix	trans	-63.7	-41.5	177.9	-66.1	-40	0	0	0	111.9	N112 I114 E162 S163 F168 D169 I170	N112-N166 PolarHBondContact ND2-ND2 2.85Å; N112-N166 PolarHBondContact ND2-OD1 2.85Å; N112-N166 VanDerWaalsContact ND2-OD1 3.15Å; I114-N166 HydrophobicContact CB-CB 4.1Å; I114-N166 HydrophobicContact CG1-CB 4.38Å; I114-N166 HydrophobicContact CG2-CB 4.4Å; E162-N166 PolarHBondContact O-N 2.98Å; E162-N166 PolarHBondContact O-ND2 3.43Å; S163-N166 PolarHBondContact O-N 3.07Å; N166-F168 VanDerWaalsContact C-N 3.34Å; N166-D169 PolarHBondContact O-N 3.3Å; N166-I170 VanDerWaalsContact O-CG1 3.32Å; N166-I170 WeakPolarHBondContact O-CG1 3.49Å; N166-I170 PolarHBondContact O-N 3.37Å
167	L	95.1	Very high	91.2	Very high	1 Å²	1	50.8 Å²	50.8	1%	0.005	27%	0.274	C	S	.	.	H	α-helix	trans	-62.5	-43.3	175.1	-177.8	61.6	0	0	0	111.1	I114 I148 L152 S163 S164 T165 V171 M189 F190	I114-L167 HydrophobicContact CG2-CB 4.03Å; I114-L167 HydrophobicContact CG2-CD1 4.21Å; I148-L167 HydrophobicContact CG2-CD2 4.38Å; L152-L167 HydrophobicContact CD1-CD2 3.98Å; L152-L167 HydrophobicContact CD2-CD2 4.24Å; S163-L167 WeakPolarHBondContact O-CB 3.34Å; S163-L167 PolarHBondContact O-N 3.04Å; S164-L167 PolarHBondContact O-N 2.87Å; T165-L167 VanDerWaalsContact C-N 3.35Å; T165-L167 PolarHBondContact O-N 3.03Å; L167-V171 HydrophobicContact CD1-CG2 4.36Å; L167-V171 VanDerWaalsContact O-CG2 3.31Å; L167-V171 WeakPolarHBondContact O-CG2 3.37Å; L167-V171 PolarHBondContact O-N 3.43Å; L167-V171 VanDerWaalsContact O-N 3.09Å; L167-M189 HydrophobicContact CD1-CE 3.85Å; L167-F190 HydrophobicContact CD2-CD2 4.48Å; L167-F190 HydrophobicContact CD2-CE2 4.23Å; L167-F190 HydrophobicContact CG-CE2 4.42Å
168	F	95.2	Very high	91	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-56.6	-52.5	174.6	-175.6	-82.9	0	0	0	111.4	S164 T165 N166 I170 V171 Y172 L222 R225 L226 Q229 L268 M271	S164-F168 WeakPolarHBondContact O-CB 3.32Å; S164-F168 PolarHBondContact O-N 3.37Å; T165-F168 WeakPolarHBondContact O-CB 3.48Å; T165-F168 PolarHBondContact O-N 3.26Å; N166-F168 VanDerWaalsContact C-N 3.34Å; F168-I170 VanDerWaalsContact C-N 3.31Å; F168-I170 PolarHBondContact O-N 3.39Å; F168-V171 PolarHBondContact O-N 3.27Å; F168-Y172 HydrophobicContact CE1-CG 4.26Å; F168-Y172 VanDerWaalsContact O-CB 3.31Å; F168-Y172 WeakPolarHBondContact O-CB 3.04Å; F168-Y172 PolarHBondContact O-N 3.48Å; F168-L222 HydrophobicContact CB-CD1 3.75Å; F168-L222 HydrophobicContact CD2-CD1 3.95Å; F168-L222 HydrophobicContact CG-CD1 4.36Å; F168-R225 HydrophobicContact CB-CG 4.16Å; F168-R225 HydrophobicContact CD1-CG 3.63Å; F168-R225 HydrophobicContact CD2-CB 4.07Å; F168-R225 HydrophobicContact CD2-CG 3.83Å; F168-R225 HydrophobicContact CE1-CG 4Å; F168-R225 HydrophobicContact CE2-CB 4.43Å; F168-R225 HydrophobicContact CE2-CG 4.17Å; F168-R225 HydrophobicContact CG-CB 4.24Å; F168-R225 HydrophobicContact CG-CG 3.57Å; F168-R225 HydrophobicContact CZ-CG 4.26Å; F168-L226 HydrophobicContact CE2-CB 3.8Å; F168-L226 HydrophobicContact CE2-CD1 4.19Å; F168-L226 HydrophobicContact CZ-CD1 4.42Å; F168-Q229 HydrophobicContact CE1-CG 3.75Å; F168-Q229 HydrophobicContact CZ-CB 4.3Å; F168-Q229 HydrophobicContact CZ-CG 3.88Å; F168-L268 HydrophobicContact CZ-CD2 4.01Å; F168-M271 HydrophobicContact CD2-CE 3.4Å; F168-M271 HydrophobicContact CD2-SD 3.75Å; F168-M271 HydrophobicContact CE2-CE 3.72Å; F168-M271 HydrophobicContact CE2-SD 3.38Å; F168-M271 WeakPolarHBondContact CE2-SD 3.32Å; F168-M271 HydrophobicContact CG-CE 4.12Å; F168-M271 HydrophobicContact CZ-SD 3.94Å
169	D	94.6	Very high	91.3	Very high	45 Å²	45	47.8 Å²	47.8	24%	0.241	26%	0.258	C	S	.	.	H	α-helix	trans	-64.9	-36.8	-172.9	-69.2	-21.1	0	0	0	110.9	T165 N166 Q173 R225	T165-D169 PolarHBondContact O-N 3.09Å; N166-D169 PolarHBondContact O-N 3.3Å; D169-Q173 VanDerWaalsContact O-CB 3.31Å; D169-Q173 WeakPolarHBondContact O-CB 3.3Å; D169-Q173 WeakPolarHBondContact O-CG 3.15Å; D169-Q173 PolarHBondContact O-N 2.96Å; D169-R225 IonicContact OD1-CZ 3.64Å; D169-R225 IonicContact OD1-NE 3.32Å; D169-R225 IonicContact OD1-NH2 3Å; D169-R225 PolarHBondContact OD1-NH2 3.25Å; D169-R225 IonicContact OD2-NH2 3.85Å
170	I	94.2	Very high	91.7	Very high	30 Å²	30	45.3 Å²	45.3	15%	0.154	25%	0.251	C	S	.	.	H	α-helix	trans	-65.4	-48.2	174.5	-69.5	167	0	0	0	111.7	I114 V118 N166 F168 Y172 Q173 A174 I186	I114-I170 HydrophobicContact CG2-CD1 3.91Å; V118-I170 HydrophobicContact CG1-CG2 4.05Å; V118-I170 HydrophobicContact CG2-CD1 4.11Å; V118-I170 HydrophobicContact CG2-CG2 4.33Å; N166-I170 VanDerWaalsContact O-CG1 3.32Å; N166-I170 WeakPolarHBondContact O-CG1 3.49Å; N166-I170 PolarHBondContact O-N 3.37Å; F168-I170 VanDerWaalsContact C-N 3.31Å; F168-I170 PolarHBondContact O-N 3.39Å; I170-Y172 VanDerWaalsContact C-N 3.32Å; I170-Y172 PolarHBondContact O-N 3.12Å; I170-Q173 PolarHBondContact O-N 2.85Å; I170-A174 WeakPolarHBondContact O-CB 3.44Å; I170-A174 PolarHBondContact O-N 3.4Å; I170-I186 HydrophobicContact CG2-CD1 4.35Å
171	V	95.1	Very high	91.7	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-62	-43.9	178.7	172.1	0	0	0	0	110.3	L167 F168 A174 L175 I186 F190 M271 W274	L167-V171 HydrophobicContact CD1-CG2 4.36Å; L167-V171 VanDerWaalsContact O-CG2 3.31Å; L167-V171 WeakPolarHBondContact O-CG2 3.37Å; L167-V171 PolarHBondContact O-N 3.43Å; L167-V171 VanDerWaalsContact O-N 3.09Å; F168-V171 PolarHBondContact O-N 3.27Å; V171-A174 PolarHBondContact O-N 2.76Å; V171-L175 HydrophobicContact CG1-CD1 4.09Å; V171-L175 WeakPolarHBondContact O-CG 3.31Å; V171-L175 PolarHBondContact O-N 3.46Å; V171-L175 VanDerWaalsContact O-N 3.08Å; V171-I186 HydrophobicContact CB-CG2 4.43Å; V171-I186 HydrophobicContact CG1-CG2 4.49Å; V171-I186 HydrophobicContact CG2-CG2 3.91Å; V171-F190 HydrophobicContact CG2-CD2 3.98Å; V171-F190 HydrophobicContact CG2-CE2 4.22Å; V171-F190 HydrophobicContact CG2-CG 4.43Å; V171-M271 HydrophobicContact CB-CE 4.11Å; V171-M271 HydrophobicContact CG1-CE 3.93Å; V171-M271 HydrophobicContact CG1-CG 4.22Å; V171-M271 HydrophobicContact CG1-SD 4.18Å; V171-W274 HydrophobicContact CG1-CE3 4.23Å; V171-W274 HydrophobicContact CG1-CZ3 3.85Å
172	Y	94.3	Very high	91.9	Very high	44 Å²	44	47.7 Å²	47.7	17%	0.173	26%	0.26	C	S	.	.	H	α-helix	trans	-63	-46.6	178.3	179.3	-102.6	0	0	0	111.9	F168 I170 A174 L175 C176 P267 L268	F168-Y172 HydrophobicContact CE1-CG 4.26Å; F168-Y172 VanDerWaalsContact O-CB 3.31Å; F168-Y172 WeakPolarHBondContact O-CB 3.04Å; F168-Y172 PolarHBondContact O-N 3.48Å; I170-Y172 VanDerWaalsContact C-N 3.32Å; I170-Y172 PolarHBondContact O-N 3.12Å; Y172-A174 VanDerWaalsContact C-N 3.33Å; Y172-A174 PolarHBondContact O-N 3.05Å; Y172-L175 PolarHBondContact O-N 3.02Å; Y172-C176 PolarHBondContact O-N 3.47Å; Y172-C176 PolarHBondContact O-SG 2.6Å; Y172-P267 HydrophobicContact CD2-CB 4.02Å; Y172-P267 HydrophobicContact CE2-CB 3.8Å; Y172-L268 HydrophobicContact CD2-CD2 3.65Å; Y172-L268 HydrophobicContact CD2-CG 4.37Å; Y172-L268 HydrophobicContact CE2-CD2 3.53Å; Y172-L268 HydrophobicContact CE2-CG 3.85Å
173	Q	93.4	Very high	92	Very high	127 Å²	127	46 Å²	46	59%	0.593	25%	0.253	S	S	*	.	H	α-helix	trans	-60.1	-42.4	177.9	-77.8	174.6	5.4	0	0	112.1	D169 I170 L175 C176 T177	D169-Q173 VanDerWaalsContact O-CB 3.31Å; D169-Q173 WeakPolarHBondContact O-CB 3.3Å; D169-Q173 WeakPolarHBondContact O-CG 3.15Å; D169-Q173 PolarHBondContact O-N 2.96Å; I170-Q173 PolarHBondContact O-N 2.85Å; Q173-L175 VanDerWaalsContact C-N 3.31Å; Q173-L175 PolarHBondContact O-N 3.13Å; Q173-C176 WeakPolarHBondContact O-CB 3.3Å; Q173-C176 PolarHBondContact O-N 2.92Å; Q173-T177 PolarHBondContact O-N 3.48Å
174	A	93.3	Very high	92	Very high	1 Å²	1	48.2 Å²	48.2	1%	0.008	27%	0.272	C	S	.	.	H	α-helix	trans	-64.7	-35.1	176.6	0	0	0	0	0	113.3	I170 V171 Y172 C176 T177 Q182 I183 I186	I170-A174 WeakPolarHBondContact O-CB 3.44Å; I170-A174 PolarHBondContact O-N 3.4Å; V171-A174 PolarHBondContact O-N 2.76Å; Y172-A174 VanDerWaalsContact C-N 3.33Å; Y172-A174 PolarHBondContact O-N 3.05Å; A174-C176 PolarHBondContact O-N 2.97Å; A174-T177 PolarHBondContact O-N 2.94Å; A174-T177 PolarHBondContact O-OG1 3.15Å; A174-Q182 HydrophobicContact CB-CG 4.11Å; A174-I183 WeakPolarHBondContact O-CG1 3.31Å; A174-I186 HydrophobicContact CB-CD1 3.2Å; A174-I186 HydrophobicContact CB-CG1 4.41Å
175	L	93.8	Very high	92	Very high	5 Å²	5	50 Å²	50	3%	0.026	28%	0.279	C	S	.	.	H	α-helix	trans	-71.8	-20.8	173.4	-70.5	172.3	0	0	0	112.5	V171 Y172 Q173 I183 P267 I270 M271 W274	V171-L175 HydrophobicContact CG1-CD1 4.09Å; V171-L175 WeakPolarHBondContact O-CG 3.31Å; V171-L175 PolarHBondContact O-N 3.46Å; V171-L175 VanDerWaalsContact O-N 3.08Å; Y172-L175 PolarHBondContact O-N 3.02Å; Q173-L175 VanDerWaalsContact C-N 3.31Å; Q173-L175 PolarHBondContact O-N 3.13Å; L175-I183 HydrophobicContact CD2-CG1 4.34Å; L175-I183 HydrophobicContact CD2-CG2 4.2Å; L175-P267 HydrophobicContact CB-CB 3.75Å; L175-P267 HydrophobicContact CB-CG 4.47Å; L175-P267 WeakPolarHBondContact CD1-O 3.32Å; L175-I270 HydrophobicContact CD1-CB 4.38Å; L175-I270 HydrophobicContact CD1-CG2 4.22Å; L175-I270 HydrophobicContact CD2-CB 4.29Å; L175-I270 HydrophobicContact CD2-CG2 3.64Å; L175-M271 HydrophobicContact CD1-CB 3.97Å; L175-W274 HydrophobicContact CD1-CH2 4.42Å; L175-W274 HydrophobicContact CD1-CZ3 4.36Å; L175-W274 HydrophobicContact CD2-CH2 3.65Å; L175-W274 HydrophobicContact CD2-CZ2 3.8Å; L175-W274 HydrophobicContact CD2-CZ3 4.38Å; L175-W274 HydrophobicContact CG-CH2 4.22Å
176	C	91.6	Very high	92.2	Very high	64 Å²	64	48.4 Å²	48.4	43%	0.432	27%	0.269	S	S	.	.	H	α-helix	trans	-82.2	-20.2	174.5	-68.4	0	0	0	0	114	Y172 Q173 A174 D178	Y172-C176 PolarHBondContact O-N 3.47Å; Y172-C176 PolarHBondContact O-SG 2.6Å; Q173-C176 WeakPolarHBondContact O-CB 3.3Å; Q173-C176 PolarHBondContact O-N 2.92Å; A174-C176 PolarHBondContact O-N 2.97Å; C176-D178 VanDerWaalsContact C-N 3.34Å
177	T	88.1	Confident	92.3	Very high	78 Å²	78	49.8 Å²	49.8	48%	0.479	27%	0.274	S	S	.	.	S	Bend	trans	-79.7	-16.6	-179	54.4	0	0	0	0	113.2	Q173 A174 D179 Q182	Q173-T177 PolarHBondContact O-N 3.48Å; A174-T177 PolarHBondContact O-N 2.94Å; A174-T177 PolarHBondContact O-OG1 3.15Å; T177-D179 PolarHBondContact O-N 3.36Å; T177-D179 VanDerWaalsContact O-N 3.08Å; T177-Q182 PolarHBondContact OG1-OE1 3.01Å
178	D	80.2	Confident	92.3	Very high	103 Å²	103	54.5 Å²	54.5	55%	0.551	29%	0.294	S	S	*	.			trans	52.6	20.6	-171.4	-78.2	-40.1	0	0	0	113.2	C176 C180 R266	C176-D178 VanDerWaalsContact C-N 3.34Å; D178-C180 PolarHBondContact O-N 3.08Å; D178-R266 IonicContact OD1-NH1 2.8Å
179	D	91.6	Very high	92.3	Very high	75 Å²	75	54.5 Å²	54.5	40%	0.401	29%	0.294	S	S	.	.			trans	-79.5	108.1	175.4	-179.5	-13.6	0	0	0	110	T177 D181 Q182 I183	T177-D179 PolarHBondContact O-N 3.36Å; T177-D179 VanDerWaalsContact O-N 3.08Å; D179-D181 VanDerWaalsContact C-N 3.3Å; D179-D181 PolarHBondContact O-N 3.08Å; D179-D181 PolarHBondContact OD1-N 3.1Å; D179-Q182 HydrophobicContact CB-CB 3.81Å; D179-Q182 PolarHBondContact O-N 3.37Å; D179-Q182 PolarHBondContact OD1-N 3.43Å; D179-I183 WeakPolarHBondContact O-CB 3.44Å; D179-I183 VanDerWaalsContact O-CG1 3.24Å; D179-I183 WeakPolarHBondContact O-CG1 3.45Å; D179-I183 PolarHBondContact O-N 3.35Å
180	C	90.4	Very high	92.3	Very high	100 Å²	100	52.3 Å²	52.3	68%	0.676	28%	0.283	S	S	*	.	H	α-helix	trans	-55.7	-40.3	-177.5	-68.5	0	0	0	0	113.6	D178 A184	D178-C180 PolarHBondContact O-N 3.08Å; C180-A184 VanDerWaalsContact O-CB 3.25Å; C180-A184 WeakPolarHBondContact O-CB 3.44Å; C180-A184 PolarHBondContact O-N 3.4Å
181	D	88.6	Confident	92.4	Very high	133 Å²	133	52.3 Å²	52.3	71%	0.711	28%	0.283	S	S	*	.	H	α-helix	trans	-71.6	-41.3	-178.2	-72.1	-26.3	0	0	0	109.7	D179 A184 Y185	D179-D181 VanDerWaalsContact C-N 3.3Å; D179-D181 PolarHBondContact O-N 3.08Å; D179-D181 PolarHBondContact OD1-N 3.1Å; D181-A184 PolarHBondContact O-N 2.96Å; D181-Y185 VanDerWaalsContact O-CD1 3.26Å; D181-Y185 WeakPolarHBondContact O-CD1 3.38Å; D181-Y185 PolarHBondContact O-N 3.07Å
182	Q	90.7	Very high	92.4	Very high	51 Å²	51	54.6 Å²	54.6	24%	0.238	29%	0.294	C	S	.	.	H	α-helix	trans	-61.9	-49	176.3	-166.5	-178.8	14.7	0	0	112.3	A174 T177 D179 A184 Y185 I186	A174-Q182 HydrophobicContact CB-CG 4.11Å; T177-Q182 PolarHBondContact OG1-OE1 3.01Å; D179-Q182 HydrophobicContact CB-CB 3.81Å; D179-Q182 PolarHBondContact O-N 3.37Å; D179-Q182 PolarHBondContact OD1-N 3.43Å; Q182-A184 VanDerWaalsContact C-N 3.28Å; Q182-A184 PolarHBondContact O-N 2.92Å; Q182-Y185 VanDerWaalsContact CA-CE1 3.41Å; Q182-Y185 HydrophobicContact CB-CE1 4.07Å; Q182-Y185 HydrophobicContact CG-CE1 3.75Å; Q182-Y185 WeakPolarHBondContact O-CD1 3.15Å; Q182-I186 HydrophobicContact CG-CD1 3.95Å; Q182-I186 WeakPolarHBondContact O-CB 3.4Å; Q182-I186 WeakPolarHBondContact O-CG1 3.49Å; Q182-I186 PolarHBondContact O-N 3.17Å; Q182-I186 VanDerWaalsContact O-N 3.11Å
183	I	92.7	Very high	92.4	Very high	33 Å²	33	52.5 Å²	52.5	17%	0.169	29%	0.286	C	S	.	.	H	α-helix	trans	-60.9	-40.6	178.1	-68.2	168.5	0	0	0	110	A174 L175 D179 Q187 W274	A174-I183 WeakPolarHBondContact O-CG1 3.31Å; L175-I183 HydrophobicContact CD2-CG1 4.34Å; L175-I183 HydrophobicContact CD2-CG2 4.2Å; D179-I183 WeakPolarHBondContact O-CB 3.44Å; D179-I183 VanDerWaalsContact O-CG1 3.24Å; D179-I183 WeakPolarHBondContact O-CG1 3.45Å; D179-I183 PolarHBondContact O-N 3.35Å; I183-Q187 WeakPolarHBondContact O-CB 3.37Å; I183-Q187 PolarHBondContact O-N 3.47Å; I183-W274 HydrophobicContact CG2-CH2 4.05Å; I183-W274 HydrophobicContact CG2-CZ2 3.91Å
184	A	92.4	Very high	92.4	Very high	55 Å²	55	46.5 Å²	46.5	46%	0.455	26%	0.258	S	S	.	.	H	α-helix	trans	-63.2	-48.6	-178.3	0	0	0	0	0	112.8	C180 D181 Q182 K188	C180-A184 VanDerWaalsContact O-CB 3.25Å; C180-A184 WeakPolarHBondContact O-CB 3.44Å; C180-A184 PolarHBondContact O-N 3.4Å; D181-A184 PolarHBondContact O-N 2.96Å; Q182-A184 VanDerWaalsContact C-N 3.28Å; Q182-A184 PolarHBondContact O-N 2.92Å; A184-K188 WeakPolarHBondContact O-CB 3.37Å; A184-K188 PolarHBondContact O-N 3.31Å
185	Y	92.3	Very high	92.4	Very high	39 Å²	39	49 Å²	49	15%	0.153	28%	0.275	C	S	.	.	H	α-helix	trans	-71.9	-35.9	-179.4	80.5	-105.5	0	0	0	112	V118 H122 D181 Q182 K188 M189	V118-Y185 HydrophobicContact CG1-CE2 4.36Å; H122-Y185 HydrophobicContact CB-CD2 4.05Å; H122-Y185 HydrophobicContact CB-CE1 4.44Å; H122-Y185 HydrophobicContact CB-CE2 3.74Å; H122-Y185 AromaticContact CD2-CD1 3.4Å; H122-Y185 WeakPolarHBondContact CD2-CD1 3.38Å; H122-Y185 AromaticContact CD2-CE1 3.29Å; H122-Y185 WeakPolarHBondContact CD2-CE1 3.36Å; H122-Y185 AromaticContact CD2-CG 3.85Å; H122-Y185 AromaticContact CD2-CZ 3.73Å; H122-Y185 AromaticContact CG-CE1 3.96Å; H122-Y185 AromaticContact CG-CZ 3.92Å; H122-Y185 AromaticContact NE2-CE1 3.87Å; D181-Y185 VanDerWaalsContact O-CD1 3.26Å; D181-Y185 WeakPolarHBondContact O-CD1 3.38Å; D181-Y185 PolarHBondContact O-N 3.07Å; Q182-Y185 VanDerWaalsContact CA-CE1 3.41Å; Q182-Y185 HydrophobicContact CB-CE1 4.07Å; Q182-Y185 HydrophobicContact CG-CE1 3.75Å; Q182-Y185 WeakPolarHBondContact O-CD1 3.15Å; Y185-K188 PolarHBondContact O-N 3.04Å; Y185-M189 WeakPolarHBondContact O-CB 3.28Å; Y185-M189 PolarHBondContact O-N 3.37Å
186	I	95.4	Very high	92.3	Very high	1 Å²	1	51 Å²	51	1%	0.005	28%	0.284	C	S	.	.	H	α-helix	trans	-67.6	-43.1	176.5	-72.7	178.1	0	0	0	110.5	I170 V171 A174 Q182 K188 M189 F190 W274	I170-I186 HydrophobicContact CG2-CD1 4.35Å; V171-I186 HydrophobicContact CB-CG2 4.43Å; V171-I186 HydrophobicContact CG1-CG2 4.49Å; V171-I186 HydrophobicContact CG2-CG2 3.91Å; A174-I186 HydrophobicContact CB-CD1 3.2Å; A174-I186 HydrophobicContact CB-CG1 4.41Å; Q182-I186 HydrophobicContact CG-CD1 3.95Å; Q182-I186 WeakPolarHBondContact O-CB 3.4Å; Q182-I186 WeakPolarHBondContact O-CG1 3.49Å; Q182-I186 PolarHBondContact O-N 3.17Å; Q182-I186 VanDerWaalsContact O-N 3.11Å; I186-K188 VanDerWaalsContact C-N 3.3Å; I186-K188 PolarHBondContact O-N 3.03Å; I186-M189 PolarHBondContact O-N 3.43Å; I186-F190 WeakPolarHBondContact O-CB 3.28Å; I186-F190 PolarHBondContact O-N 3.35Å; I186-W274 HydrophobicContact CG2-CZ3 4.34Å
187	Q	95	Very high	92.2	Very high	61 Å²	61	48.1 Å²	48.1	29%	0.285	26%	0.264	S	S	.	.	H	α-helix	trans	-58.5	-46	173.8	-172.6	-175.8	-27.5	0	0	110.4	I183 M189 F190 D191 W274	I183-Q187 WeakPolarHBondContact O-CB 3.37Å; I183-Q187 PolarHBondContact O-N 3.47Å; Q187-M189 PolarHBondContact O-N 2.89Å; Q187-F190 PolarHBondContact O-N 3.42Å; Q187-D191 VanDerWaalsContact O-CB 3.3Å; Q187-D191 WeakPolarHBondContact O-CB 3.37Å; Q187-D191 PolarHBondContact O-N 3.24Å; Q187-W274 HydrophobicContact CB-CH2 3.58Å; Q187-W274 HydrophobicContact CB-CZ2 3.59Å; Q187-W274 HydrophobicContact CB-CZ3 4.09Å; Q187-W274 HydrophobicContact CG-CD2 4.01Å; Q187-W274 HydrophobicContact CG-CE3 4.38Å; Q187-W274 HydrophobicContact CG-CH2 4.03Å; Q187-W274 HydrophobicContact CG-CZ2 3.64Å; Q187-W274 HydrophobicContact CG-CZ3 4.38Å
188	K	94.6	Very high	92.1	Very high	99 Å²	99	45.3 Å²	45.3	43%	0.43	25%	0.247	S	C	.	.	H	α-helix	trans	-59.8	-47.9	178.6	-167	-172.2	-171.5	-160.8	0	111.6	A184 Y185 I186 D191 E192	A184-K188 WeakPolarHBondContact O-CB 3.37Å; A184-K188 PolarHBondContact O-N 3.31Å; Y185-K188 PolarHBondContact O-N 3.04Å; I186-K188 VanDerWaalsContact C-N 3.3Å; I186-K188 PolarHBondContact O-N 3.03Å; K188-D191 PolarHBondContact O-N 3.48Å; K188-E192 WeakPolarHBondContact O-CG 3.49Å; K188-E192 PolarHBondContact O-N 3.47Å
189	M	95.7	Very high	92.4	Very high	0 Å²	0	44 Å²	44	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-59.3	-48.5	176.6	-174.2	-159.8	66.4	0	0	111.3	V118 Y121 I148 L167 Y185 I186 Q187 D191 E192 V193	V118-M189 HydrophobicContact CB-SD 4.27Å; V118-M189 HydrophobicContact CG1-SD 4.23Å; V118-M189 HydrophobicContact CG2-CE 3.97Å; V118-M189 HydrophobicContact CG2-SD 3.71Å; Y121-M189 HydrophobicContact CD1-CB 3.66Å; Y121-M189 HydrophobicContact CD1-CG 3.89Å; Y121-M189 HydrophobicContact CD1-SD 4.49Å; Y121-M189 HydrophobicContact CD2-CB 4.32Å; Y121-M189 HydrophobicContact CD2-CG 3.87Å; Y121-M189 HydrophobicContact CE1-CB 3.44Å; Y121-M189 VanDerWaalsContact CE1-CB 3.44Å; Y121-M189 HydrophobicContact CE1-CG 4.06Å; Y121-M189 HydrophobicContact CE2-CB 4.12Å; Y121-M189 HydrophobicContact CE2-CG 4.02Å; Y121-M189 HydrophobicContact CG-CB 4.11Å; Y121-M189 HydrophobicContact CG-CG 3.8Å; Y121-M189 HydrophobicContact CG-SD 4.33Å; Y121-M189 PolarHBondContact OH-N 2.9Å; I148-M189 HydrophobicContact CD1-CG 4.36Å; I148-M189 HydrophobicContact CD1-SD 3.87Å; L167-M189 HydrophobicContact CD1-CE 3.85Å; Y185-M189 WeakPolarHBondContact O-CB 3.28Å; Y185-M189 PolarHBondContact O-N 3.37Å; I186-M189 PolarHBondContact O-N 3.43Å; Q187-M189 PolarHBondContact O-N 2.89Å; M189-D191 PolarHBondContact O-N 2.96Å; M189-E192 PolarHBondContact O-N 3.47Å; M189-E192 VanDerWaalsContact O-N 3.16Å; M189-V193 HydrophobicContact CG-CG2 4.43Å; M189-V193 WeakPolarHBondContact O-CG2 3.44Å; M189-V193 PolarHBondContact O-N 3.48Å
190	F	95.4	Very high	91.9	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-65.6	-40.4	-176.7	-165.6	-117.1	0	0	0	111.6	L167 V171 I186 Q187 E192 V193 L194 L222 M271 W274 L275	L167-F190 HydrophobicContact CD2-CD2 4.48Å; L167-F190 HydrophobicContact CD2-CE2 4.23Å; L167-F190 HydrophobicContact CG-CE2 4.42Å; V171-F190 HydrophobicContact CG2-CD2 3.98Å; V171-F190 HydrophobicContact CG2-CE2 4.22Å; V171-F190 HydrophobicContact CG2-CG 4.43Å; I186-F190 WeakPolarHBondContact O-CB 3.28Å; I186-F190 PolarHBondContact O-N 3.35Å; Q187-F190 PolarHBondContact O-N 3.42Å; F190-E192 VanDerWaalsContact C-N 3.32Å; F190-E192 PolarHBondContact O-N 3.02Å; F190-V193 PolarHBondContact O-N 3.5Å; F190-L194 HydrophobicContact CD1-CD1 3.78Å; F190-L194 HydrophobicContact CE1-CD1 3.56Å; F190-L194 HydrophobicContact CE1-CG 4.45Å; F190-L194 HydrophobicContact CG-CD1 4.39Å; F190-L194 HydrophobicContact CZ-CD1 3.97Å; F190-L194 WeakPolarHBondContact O-CB 3.45Å; F190-L194 VanDerWaalsContact O-CG 3.3Å; F190-L194 WeakPolarHBondContact O-CG 3.21Å; F190-L194 PolarHBondContact O-N 2.9Å; F190-L222 HydrophobicContact CE2-CD2 4.01Å; F190-L222 HydrophobicContact CZ-CD2 3.87Å; F190-M271 HydrophobicContact CZ-CE 4.14Å; F190-W274 HydrophobicContact CD1-CB 4.27Å; F190-W274 AromaticContact CD1-CE3 3.82Å; F190-W274 HydrophobicContact CD1-CE3 3.82Å; F190-W274 HydrophobicContact CE1-CB 4.29Å; F190-W274 HydrophobicContact CE1-CE3 4.36Å; F190-L275 HydrophobicContact CE1-CD2 4.01Å; F190-L275 HydrophobicContact CE1-CG 4.24Å; F190-L275 HydrophobicContact CZ-CD2 3.85Å; F190-L275 HydrophobicContact CZ-CG 4.4Å
191	D	95	Very high	91.4	Very high	30 Å²	30	42 Å²	42	16%	0.16	23%	0.228	C	C	.	.	H	α-helix	trans	-61.5	-39.8	173	-83	-28.6	0	0	0	111	Q187 K188 M189 S195 K277 Y278	Q187-D191 VanDerWaalsContact O-CB 3.3Å; Q187-D191 WeakPolarHBondContact O-CB 3.37Å; Q187-D191 PolarHBondContact O-N 3.24Å; K188-D191 PolarHBondContact O-N 3.48Å; M189-D191 PolarHBondContact O-N 2.96Å; D191-S195 WeakPolarHBondContact O-CB 3.28Å; D191-S195 PolarHBondContact O-N 3.37Å; D191-S195 PolarHBondContact O-OG 2.95Å; D191-K277 IonicContact OD1-NZ 3.66Å; D191-K277 PolarHBondContact OD1-NZ 3.3Å; D191-K277 IonicContact OD2-NZ 2.96Å; D191-K277 PolarHBondContact OD2-NZ 3.44Å; D191-K277 VanDerWaalsContact OD2-NZ 3.13Å; D191-Y278 WeakPolarHBondContact CA-OH 3.35Å; D191-Y278 VanDerWaalsContact CB-OH 3.23Å; D191-Y278 WeakPolarHBondContact CB-OH 3.32Å; D191-Y278 PolarHBondContact O-OH 3.31Å; D191-Y278 PolarHBondContact OD1-OH 2.87Å
192	E	95.3	Very high	91.1	Very high	47 Å²	47	37.2 Å²	37.2	22%	0.22	20%	0.202	C	C	.	.	H	α-helix	trans	-69.1	-43.3	176.3	-75.5	179.5	-170.1	0	0	113.3	Y121 R141 V145 K188 M189 F190 S195 H196	Y121-E192 PolarHBondContact OH-OE2 3.47Å; R141-E192 IonicContact CZ-OE1 3.03Å; R141-E192 IonicContact CZ-OE2 3.58Å; R141-E192 IonicContact NH1-OE1 3.28Å; R141-E192 PolarHBondContact NH1-OE1 2.93Å; R141-E192 IonicContact NH1-OE2 2.75Å; R141-E192 PolarHBondContact NH1-OE2 3.25Å; R141-E192 IonicContact NH2-OE1 3.08Å; R141-E192 PolarHBondContact NH2-OE1 3.25Å; R141-E192 IonicContact NH2-OE2 3.46Å; V145-E192 HydrophobicContact CG1-CB 4.33Å; V145-E192 HydrophobicContact CG2-CB 4.05Å; K188-E192 WeakPolarHBondContact O-CG 3.49Å; K188-E192 PolarHBondContact O-N 3.47Å; M189-E192 PolarHBondContact O-N 3.47Å; M189-E192 VanDerWaalsContact O-N 3.16Å; F190-E192 VanDerWaalsContact C-N 3.32Å; F190-E192 PolarHBondContact O-N 3.02Å; E192-S195 PolarHBondContact O-N 2.88Å; E192-H196 WeakPolarHBondContact O-CB 3.16Å; E192-H196 PolarHBondContact O-N 3.13Å
193	V	94.8	Very high	90.5	Very high	1 Å²	1	38.9 Å²	38.9	1%	0.006	22%	0.219	C	C	.	.	H	α-helix	trans	-60	-49.4	176	170.1	0	0	0	0	110.9	V145 I148 V149 L152 M189 F190 H196 L197	V145-V193 HydrophobicContact CG1-CG2 4.01Å; V145-V193 HydrophobicContact CG2-CG2 4.44Å; I148-V193 HydrophobicContact CB-CG2 4.15Å; I148-V193 HydrophobicContact CD1-CG2 4.2Å; I148-V193 HydrophobicContact CG2-CG1 3.99Å; I148-V193 HydrophobicContact CG2-CG2 3.86Å; V149-V193 HydrophobicContact CG2-CG1 4.09Å; L152-V193 HydrophobicContact CD1-CG1 3.95Å; M189-V193 HydrophobicContact CG-CG2 4.43Å; M189-V193 WeakPolarHBondContact O-CG2 3.44Å; M189-V193 PolarHBondContact O-N 3.48Å; F190-V193 PolarHBondContact O-N 3.5Å; V193-H196 PolarHBondContact O-N 3.03Å; V193-L197 PolarHBondContact O-N 3.32Å; V193-L197 VanDerWaalsContact O-N 3.11Å
194	L	94	Very high	89.8	Confident	1 Å²	1	44.7 Å²	44.7	1%	0.005	25%	0.25	C	S	.	.	H	α-helix	trans	-66.9	-40.7	179.6	-68.1	177.1	0	0	0	111.8	F190 H196 V198 L219 L275 Y278 T281	F190-L194 HydrophobicContact CD1-CD1 3.78Å; F190-L194 HydrophobicContact CE1-CD1 3.56Å; F190-L194 HydrophobicContact CE1-CG 4.45Å; F190-L194 HydrophobicContact CG-CD1 4.39Å; F190-L194 HydrophobicContact CZ-CD1 3.97Å; F190-L194 WeakPolarHBondContact O-CB 3.45Å; F190-L194 VanDerWaalsContact O-CG 3.3Å; F190-L194 WeakPolarHBondContact O-CG 3.21Å; F190-L194 PolarHBondContact O-N 2.9Å; L194-H196 VanDerWaalsContact C-N 3.34Å; L194-H196 PolarHBondContact O-N 3.41Å; L194-V198 VanDerWaalsContact O-CB 3.29Å; L194-V198 WeakPolarHBondContact O-CB 3.43Å; L194-V198 WeakPolarHBondContact O-CG2 3.33Å; L194-V198 PolarHBondContact O-N 3.11Å; L194-L219 HydrophobicContact CD2-CD1 3.82Å; L194-L219 HydrophobicContact CD2-CD2 4.04Å; L194-L275 HydrophobicContact CD1-CD2 3.99Å; L194-L275 HydrophobicContact CD2-CD2 4.43Å; L194-Y278 HydrophobicContact CB-CD1 4.28Å; L194-Y278 HydrophobicContact CB-CD2 3.74Å; L194-Y278 HydrophobicContact CB-CE1 4.27Å; L194-Y278 HydrophobicContact CB-CE2 3.71Å; L194-Y278 HydrophobicContact CB-CG 4.05Å; L194-Y278 HydrophobicContact CD1-CD2 3.62Å; L194-Y278 HydrophobicContact CD1-CE2 3.62Å; L194-Y278 HydrophobicContact CG-CD2 4.32Å; L194-Y278 HydrophobicContact CG-CE2 4.33Å; L194-T281 HydrophobicContact CD2-CG2 4.2Å
195	S	93	Very high	89.2	Confident	54 Å²	54	44 Å²	44	38%	0.378	24%	0.24	S	C	.	.	H	α-helix	trans	-60.1	-44.9	176.2	-64.7	0	0	0	0	111.6	D191 E192 S199 Y278	D191-S195 WeakPolarHBondContact O-CB 3.28Å; D191-S195 PolarHBondContact O-N 3.37Å; D191-S195 PolarHBondContact O-OG 2.95Å; E192-S195 PolarHBondContact O-N 2.88Å; S195-S199 VanDerWaalsContact O-CB 3.27Å; S195-S199 WeakPolarHBondContact O-CB 3.31Å; S195-S199 PolarHBondContact O-N 2.91Å; S195-S199 PolarHBondContact O-OG 3.39Å; S195-Y278 VanDerWaalsContact OG-CE1 3.25Å; S195-Y278 WeakPolarHBondContact OG-CE1 3.49Å
196	H	91.5	Very high	88.8	Confident	47 Å²	47	44.8 Å²	44.8	22%	0.218	25%	0.252	C	S	.	.	H	α-helix	trans	-61.7	-54.2	179.8	-165.9	-73.6	0	0	0	111.2	V145 R146 V149 E192 V193 L194 V198 S199 E200	V145-H196 HydrophobicContact CG1-CB 4.3Å; R146-H196 WeakPolarHBondContact CG-NE2 3.27Å; V149-H196 HydrophobicContact CG2-CB 4.13Å; E192-H196 WeakPolarHBondContact O-CB 3.16Å; E192-H196 PolarHBondContact O-N 3.13Å; V193-H196 PolarHBondContact O-N 3.03Å; L194-H196 VanDerWaalsContact C-N 3.34Å; L194-H196 PolarHBondContact O-N 3.41Å; H196-V198 VanDerWaalsContact C-N 3.29Å; H196-V198 PolarHBondContact O-N 3.45Å; H196-S199 PolarHBondContact O-N 2.93Å; H196-S199 VanDerWaalsContact O-N 3.12Å; H196-S199 PolarHBondContact O-OG 3.28Å; H196-E200 IonicContact CE1-OE1 3.58Å; H196-E200 PolarHBondContact CE1-OE1 3.46Å; H196-E200 IonicContact CE1-OE2 3.05Å; H196-E200 PolarHBondContact CE1-OE2 3.03Å; H196-E200 VanDerWaalsContact CE1-OE2 3.31Å; H196-E200 IonicContact ND1-OE1 3.77Å; H196-E200 IonicContact ND1-OE2 3.51Å; H196-E200 PolarHBondContact ND1-OE2 3.06Å; H196-E200 VanDerWaalsContact ND1-OE2 3.1Å; H196-E200 PolarHBondContact O-N 3.43Å
197	L	88.4	Confident	88.4	Confident	2 Å²	2	49.1 Å²	49.1	1%	0.01	27%	0.274	C	S	.	.	H	α-helix	trans	-60	-40.3	-177.7	-167.4	151.9	0	0	0	111.9	V149 V193 S201 L219	V149-L197 HydrophobicContact CG1-CB 4.34Å; V149-L197 HydrophobicContact CG1-CD1 4.35Å; V149-L197 HydrophobicContact CG1-CG 4.47Å; V149-L197 HydrophobicContact CG2-CB 4.49Å; V193-L197 PolarHBondContact O-N 3.32Å; V193-L197 VanDerWaalsContact O-N 3.11Å; L197-S201 VanDerWaalsContact O-CB 3.22Å; L197-S201 WeakPolarHBondContact O-CB 3.41Å; L197-S201 PolarHBondContact O-N 3.2Å; L197-S201 VanDerWaalsContact O-N 3.1Å; L197-S201 PolarHBondContact O-OG 2.99Å; L197-L219 HydrophobicContact CD1-CD2 4.01Å; L197-L219 HydrophobicContact CD1-CG 4.2Å; L197-L219 HydrophobicContact CD2-CD1 3.83Å; L197-L219 HydrophobicContact CD2-CG 3.96Å
198	V	86.4	Confident	87.9	Confident	19 Å²	19	51.5 Å²	51.5	12%	0.115	29%	0.288	C	S	.	.	H	α-helix	trans	-70.8	-38.6	178.2	173.8	0	0	0	0	111.5	L194 H196 S201 L202 V280	L194-V198 VanDerWaalsContact O-CB 3.29Å; L194-V198 WeakPolarHBondContact O-CB 3.43Å; L194-V198 WeakPolarHBondContact O-CG2 3.33Å; L194-V198 PolarHBondContact O-N 3.11Å; H196-V198 VanDerWaalsContact C-N 3.29Å; H196-V198 PolarHBondContact O-N 3.45Å; V198-S201 PolarHBondContact O-N 3.42Å; V198-L202 HydrophobicContact CG1-CD1 3.61Å; V198-L202 HydrophobicContact CG1-CG 4.21Å; V198-L202 WeakPolarHBondContact O-CB 3.23Å; V198-L202 VanDerWaalsContact O-CG 3.3Å; V198-L202 WeakPolarHBondContact O-CG 3.42Å; V198-L202 PolarHBondContact O-N 3.31Å; V198-L202 VanDerWaalsContact O-N 3.16Å; V198-V280 HydrophobicContact CG2-CB 4.22Å; V198-V280 HydrophobicContact CG2-CG2 3.98Å
199	S	86.4	Confident	87.6	Confident	76 Å²	76	52.5 Å²	52.5	53%	0.531	29%	0.294	S	S	.	.	H	α-helix	trans	-66.2	-40.2	179.2	69.1	0	0	0	0	112.7	S195 H196	S195-S199 VanDerWaalsContact O-CB 3.27Å; S195-S199 WeakPolarHBondContact O-CB 3.31Å; S195-S199 PolarHBondContact O-N 2.91Å; S195-S199 PolarHBondContact O-OG 3.39Å; H196-S199 PolarHBondContact O-N 2.93Å; H196-S199 VanDerWaalsContact O-N 3.12Å; H196-S199 PolarHBondContact O-OG 3.28Å
200	E	81	Confident	87.3	Confident	106 Å²	106	54.6 Å²	54.6	50%	0.495	31%	0.309	S	S	.	.	H	α-helix	trans	-70.4	-37.8	176	-73.6	-178.5	140.3	0	0	112	H196	H196-E200 IonicContact CE1-OE1 3.58Å; H196-E200 PolarHBondContact CE1-OE1 3.46Å; H196-E200 IonicContact CE1-OE2 3.05Å; H196-E200 PolarHBondContact CE1-OE2 3.03Å; H196-E200 VanDerWaalsContact CE1-OE2 3.31Å; H196-E200 IonicContact ND1-OE1 3.77Å; H196-E200 IonicContact ND1-OE2 3.51Å; H196-E200 PolarHBondContact ND1-OE2 3.06Å; H196-E200 VanDerWaalsContact ND1-OE2 3.1Å; H196-E200 PolarHBondContact O-N 3.43Å
201	S	80.3	Confident	87	Confident	28 Å²	28	54.7 Å²	54.7	20%	0.196	31%	0.31	C	S	.	.	H	α-helix	trans	-75.5	-24.9	-175.1	-66.3	0	0	0	0	114.4	L197 V198 P212 A215	L197-S201 VanDerWaalsContact O-CB 3.22Å; L197-S201 WeakPolarHBondContact O-CB 3.41Å; L197-S201 PolarHBondContact O-N 3.2Å; L197-S201 VanDerWaalsContact O-N 3.1Å; L197-S201 PolarHBondContact O-OG 2.99Å; V198-S201 PolarHBondContact O-N 3.42Å; S201-P212 WeakPolarHBondContact O-CG 2.9Å; S201-A215 VanDerWaalsContact CB-CB 3.43Å; S201-A215 VanDerWaalsContact OG-CB 3.3Å; S201-A215 WeakPolarHBondContact OG-CB 3.44Å
202	L	83.2	Confident	86.7	Confident	32 Å²	32	54.9 Å²	54.9	17%	0.168	31%	0.312	C	S	.	.	H	α-helix	trans	-111.5	2.9	-167.9	-60.6	-171.5	0	0	0	114.7	V198 D204 V205 C211 P212 A279 V280	V198-L202 HydrophobicContact CG1-CD1 3.61Å; V198-L202 HydrophobicContact CG1-CG 4.21Å; V198-L202 WeakPolarHBondContact O-CB 3.23Å; V198-L202 VanDerWaalsContact O-CG 3.3Å; V198-L202 WeakPolarHBondContact O-CG 3.42Å; V198-L202 PolarHBondContact O-N 3.31Å; V198-L202 VanDerWaalsContact O-N 3.16Å; L202-D204 PolarHBondContact O-N 3.38Å; L202-D204 VanDerWaalsContact O-N 3.15Å; L202-V205 PolarHBondContact O-N 2.98Å; L202-C211 HydrophobicContact CD2-CB 4.47Å; L202-P212 HydrophobicContact CD2-CG 4.21Å; L202-A279 HydrophobicContact CD1-CB 3.94Å; L202-V280 HydrophobicContact CD1-CG2 4.42Å; L202-V280 HydrophobicContact CD2-CG2 4.38Å; L202-V280 HydrophobicContact CG-CG2 4.49Å
203	S	78.4	Confident	86.3	Confident	86 Å²	86	57 Å²	57	60%	0.601	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.8	-38	-176.2	53	0	0	0	0	113.6
204	D	77.2	Confident	85.8	Confident	154 Å²	154	61 Å²	61	82%	0.824	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.4	14.8	-171.2	-57.7	-61.3	0	0	0	114.1	L202	L202-D204 PolarHBondContact O-N 3.38Å; L202-D204 VanDerWaalsContact O-N 3.15Å
205	V	80.3	Confident	85.4	Confident	40 Å²	40	61 Å²	61	24%	0.242	35%	0.35	C	S	.	.			trans	-109.4	125.3	-174.4	-176.6	0	0	0	0	112.1	L202 P212 R381	L202-V205 PolarHBondContact O-N 2.98Å; V205-P212 HydrophobicContact CG2-CB 4.49Å; V205-P212 HydrophobicContact CG2-CG 3.97Å; V205-R381 PolarHBondContact O-NH2 2.93Å
206	S	84.6	Confident	85.3	Confident	56 Å²	56	58.4 Å²	58.4	39%	0.392	33%	0.332	S	S	.	.			trans	-49.5	140.9	176.1	179.1	0	0	0	0	112.6	L208 E209 R381	S206-L208 PolarHBondContact O-N 3.44Å; S206-L208 PolarHBondContact OG-N 3.12Å; S206-E209 PolarHBondContact O-N 3.19Å; S206-R381 PolarHBondContact O-NH2 3.43Å
207	I	85.7	Confident	85.2	Confident	92 Å²	92	59.3 Å²	59.3	47%	0.472	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71	-16.5	178.6	61.4	171.4	0	0	0	113.8	R381 P382	I207-R381 HydrophobicContact CB-CG 4.07Å; I207-R381 HydrophobicContact CG2-CG 4.23Å; I207-P382 WeakPolarHBondContact O-CD 2.89Å
208	L	85.1	Confident	85.1	Confident	111 Å²	111	59.2 Å²	59.2	58%	0.581	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.1	-13.9	179.5	-65.5	174.5	0	0	0	112.9	S206 P382	S206-L208 PolarHBondContact O-N 3.44Å; S206-L208 PolarHBondContact OG-N 3.12Å; L208-P382 HydrophobicContact CD2-CB 4.01Å; L208-P382 HydrophobicContact CD2-CG 4.11Å
209	E	87.1	Confident	85.3	Confident	121 Å²	121	58.3 Å²	58.3	57%	0.565	33%	0.333	S	S	*	.	S	Bend	trans	-100.1	162.3	-176.8	-67.7	180	179.7	0	0	111.9	S206	S206-E209 PolarHBondContact O-N 3.19Å
210	S	90	Very high	85.7	Confident	43 Å²	43	58.3 Å²	58.3	30%	0.301	32%	0.321	S	S	.	.	P	Polyproline II helix	trans	-56.4	149	170.2	173.1	0	0	0	0	110.9	Q283	S210-Q283 PolarHBondContact OG-NE2 3.4Å
211	C	89	Confident	86.2	Confident	3 Å²	3	54.8 Å²	54.8	2%	0.02	31%	0.308	C	S	.	.	P	Polyproline II helix	trans	-56.9	146.2	167.6	-60.6	0	0	0	0	110.4	L202 L216 V280 Q283 R381	L202-C211 HydrophobicContact CD2-CB 4.47Å; C211-L216 HydrophobicContact CB-CD1 4.33Å; C211-L216 HydrophobicContact CB-CD2 4.01Å; C211-L216 HydrophobicContact CB-CG 4.02Å; C211-L216 WeakPolarHBondContact O-CD1 3.37Å; C211-V280 HydrophobicContact CB-CG2 4.31Å; C211-Q283 VanDerWaalsContact CB-OE1 3.3Å; C211-Q283 PolarHBondContact SG-OE1 2.7Å; C211-R381 PolarHBondContact SG-NH1 2.83Å
212	P	88.5	Confident	86.8	Confident	33 Å²	33	53.5 Å²	53.5	21%	0.214	30%	0.298	C	S	.	.	P	Polyproline II helix	trans	-62.2	143.3	-179.8	21.3	-28.3	0	0	0	111.1	S201 L202 V205 S214 A215 L216	S201-P212 WeakPolarHBondContact O-CG 2.9Å; L202-P212 HydrophobicContact CD2-CG 4.21Å; V205-P212 HydrophobicContact CG2-CB 4.49Å; V205-P212 HydrophobicContact CG2-CG 3.97Å; P212-S214 PolarHBondContact O-N 3.23Å; P212-A215 HydrophobicContact CG-CB 4.09Å; P212-A215 WeakPolarHBondContact O-CB 3.08Å; P212-A215 PolarHBondContact O-N 3.3Å; P212-A215 VanDerWaalsContact O-N 3.11Å; P212-L216 PolarHBondContact O-N 2.91Å; P212-L216 VanDerWaalsContact O-N 3.1Å
213	Q	88.4	Confident	87.3	Confident	92 Å²	92	52 Å²	52	43%	0.43	29%	0.29	S	S	.	.	H	α-helix	trans	-64.6	-30.1	-171.8	-165.2	58	31.8	0	0	112.7	L216 N217	Q213-L216 PolarHBondContact O-N 2.91Å; Q213-N217 PolarHBondContact NE2-OD1 3.39Å; Q213-N217 VanDerWaalsContact O-CB 3.28Å; Q213-N217 WeakPolarHBondContact O-CB 3.35Å; Q213-N217 PolarHBondContact O-N 3.45Å; Q213-N217 PolarHBondContact O-ND2 2.97Å; Q213-N217 PolarHBondContact O-OD1 3.31Å
214	S	84.1	Confident	88.1	Confident	85 Å²	85	50.7 Å²	50.7	59%	0.594	28%	0.277	S	S	*	.	H	α-helix	trans	-58.3	-47	173.4	50.5	0	0	0	0	112	P212 N217 S218	P212-S214 PolarHBondContact O-N 3.23Å; S214-N217 PolarHBondContact O-N 3.43Å; S214-S218 PolarHBondContact O-N 2.96Å; S214-S218 VanDerWaalsContact O-N 3.13Å
215	A	85.7	Confident	88.8	Confident	1 Å²	1	46.9 Å²	46.9	1%	0.008	25%	0.251	C	S	.	.	H	α-helix	trans	-68.8	-38.5	178.5	0	0	0	0	0	112.5	S201 P212 N217 S218 V280	S201-A215 VanDerWaalsContact CB-CB 3.43Å; S201-A215 VanDerWaalsContact OG-CB 3.3Å; S201-A215 WeakPolarHBondContact OG-CB 3.44Å; P212-A215 HydrophobicContact CG-CB 4.09Å; P212-A215 WeakPolarHBondContact O-CB 3.08Å; P212-A215 PolarHBondContact O-N 3.3Å; P212-A215 VanDerWaalsContact O-N 3.11Å; A215-N217 VanDerWaalsContact C-N 3.35Å; A215-S218 PolarHBondContact O-OG 3.31Å; A215-V280 HydrophobicContact CB-CG1 4.21Å; A215-V280 HydrophobicContact CB-CG2 4.14Å; A215-V280 VanDerWaalsContact O-CG1 3.31Å; A215-V280 WeakPolarHBondContact O-CG1 3.3Å
216	L	90.2	Very high	89.5	Confident	0 Å²	0	45 Å²	45	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-63.8	-43.4	173.8	-68.3	171.8	0	0	0	110.5	C211 P212 Q213 S218 L219 R220 V280 Q283 L284	C211-L216 HydrophobicContact CB-CD1 4.33Å; C211-L216 HydrophobicContact CB-CD2 4.01Å; C211-L216 HydrophobicContact CB-CG 4.02Å; C211-L216 WeakPolarHBondContact O-CD1 3.37Å; P212-L216 PolarHBondContact O-N 2.91Å; P212-L216 VanDerWaalsContact O-N 3.1Å; Q213-L216 PolarHBondContact O-N 2.91Å; L216-S218 PolarHBondContact O-N 2.77Å; L216-L219 PolarHBondContact O-N 2.88Å; L216-R220 WeakPolarHBondContact O-CA 3.28Å; L216-R220 WeakPolarHBondContact O-CB 3.19Å; L216-R220 PolarHBondContact O-N 3.47Å; L216-V280 HydrophobicContact CD2-CG1 3.97Å; L216-Q283 HydrophobicContact CD2-CB 4.35Å; L216-Q283 HydrophobicContact CD2-CG 4.23Å; L216-L284 HydrophobicContact CB-CD2 4.24Å; L216-L284 HydrophobicContact CD2-CD1 4.33Å; L216-L284 HydrophobicContact CD2-CD2 3.8Å; L216-L284 HydrophobicContact CD2-CG 3.68Å
217	N	88.7	Confident	90	Very high	65 Å²	65	42.7 Å²	42.7	35%	0.348	22%	0.223	S	C	.	.	H	α-helix	trans	-65.1	-35.9	-178.5	-72.6	-8	0	0	0	112.7	Q213 S214 A215 L219 P221	Q213-N217 PolarHBondContact NE2-OD1 3.39Å; Q213-N217 VanDerWaalsContact O-CB 3.28Å; Q213-N217 WeakPolarHBondContact O-CB 3.35Å; Q213-N217 PolarHBondContact O-N 3.45Å; Q213-N217 PolarHBondContact O-ND2 2.97Å; Q213-N217 PolarHBondContact O-OD1 3.31Å; S214-N217 PolarHBondContact O-N 3.43Å; A215-N217 VanDerWaalsContact C-N 3.35Å; N217-L219 PolarHBondContact O-N 3.15Å; N217-P221 WeakPolarHBondContact O-CD 3.41Å
218	S	87.2	Confident	90.3	Very high	1 Å²	1	42 Å²	42	1%	0.007	22%	0.219	C	C	.	.	H	α-helix	trans	-69.5	-30.1	179.6	61.2	0	0	0	0	114.2	S214 A215 L216	S214-S218 PolarHBondContact O-N 2.96Å; S214-S218 VanDerWaalsContact O-N 3.13Å; A215-S218 PolarHBondContact O-OG 3.31Å; L216-S218 PolarHBondContact O-N 2.77Å
219	L	91.3	Very high	90.6	Very high	0 Å²	0	39 Å²	39	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-102.4	-11.4	177.7	-66	-176.7	0	0	0	114	L152 L194 L197 L216 N217 L222 V223 V280 T281 L284	L152-L219 HydrophobicContact CD1-CD2 4.45Å; L194-L219 HydrophobicContact CD2-CD1 3.82Å; L194-L219 HydrophobicContact CD2-CD2 4.04Å; L197-L219 HydrophobicContact CD1-CD2 4.01Å; L197-L219 HydrophobicContact CD1-CG 4.2Å; L197-L219 HydrophobicContact CD2-CD1 3.83Å; L197-L219 HydrophobicContact CD2-CG 3.96Å; L216-L219 PolarHBondContact O-N 2.88Å; N217-L219 PolarHBondContact O-N 3.15Å; L219-L222 HydrophobicContact CD2-CD2 4.41Å; L219-L222 WeakPolarHBondContact O-CB 3.26Å; L219-L222 PolarHBondContact O-N 2.59Å; L219-V223 PolarHBondContact O-N 3.02Å; L219-V280 HydrophobicContact CD1-CB 4.48Å; L219-V280 HydrophobicContact CD1-CG1 4.15Å; L219-T281 HydrophobicContact CB-CG2 4.32Å; L219-T281 HydrophobicContact CD1-CG2 3.52Å; L219-L284 HydrophobicContact CB-CD1 4.04Å
220	R	93.2	Very high	90.8	Very high	76 Å²	76	33.4 Å²	33.4	29%	0.287	18%	0.176	S	C	.	.	H	α-helix	trans	-58.7	-41.2	179.6	178	171.8	-70.8	-179.7	-4.2	113.4	L216 L222 V223 N224 L284 E287	L216-R220 WeakPolarHBondContact O-CA 3.28Å; L216-R220 WeakPolarHBondContact O-CB 3.19Å; L216-R220 PolarHBondContact O-N 3.47Å; R220-L222 VanDerWaalsContact C-N 3.29Å; R220-L222 PolarHBondContact O-N 3.19Å; R220-V223 PolarHBondContact O-N 3.2Å; R220-N224 WeakPolarHBondContact CG-ND2 3.27Å; R220-N224 VanDerWaalsContact O-CB 3.27Å; R220-N224 WeakPolarHBondContact O-CB 3.47Å; R220-N224 VanDerWaalsContact O-CG 3.27Å; R220-N224 PolarHBondContact O-N 3.27Å; R220-L284 HydrophobicContact CB-CD1 4.36Å; R220-L284 HydrophobicContact CB-CD2 4.16Å; R220-L284 HydrophobicContact CG-CD2 4.43Å; R220-E287 IonicContact NH2-OE2 3.4Å
221	P	92.4	Very high	90.7	Very high	32 Å²	32	36.3 Å²	36.3	21%	0.208	18%	0.18	C	C	.	.	H	α-helix	trans	-58.9	-40.1	175.7	-25	33.4	0	0	0	113.3	P161 N217 N224 R225	P161-P221 HydrophobicContact CB-CB 3.47Å; P161-P221 VanDerWaalsContact CB-CB 3.47Å; P161-P221 HydrophobicContact CB-CG 3.96Å; N217-P221 WeakPolarHBondContact O-CD 3.41Å; P221-N224 PolarHBondContact O-N 3.15Å; P221-R225 WeakPolarHBondContact O-CB 3.49Å; P221-R225 PolarHBondContact O-N 3.09Å
222	L	92.2	Very high	90.6	Very high	1 Å²	1	41 Å²	41	1%	0.005	21%	0.205	C	C	.	.	H	α-helix	trans	-61.5	-47.8	178	-172	67.1	0	0	0	111.4	S164 F168 F190 L219 R220 R225 L226 M271 L275	S164-L222 WeakPolarHBondContact OG-CB 3.23Å; S164-L222 PolarHBondContact OG-N 2.99Å; F168-L222 HydrophobicContact CB-CD1 3.75Å; F168-L222 HydrophobicContact CD2-CD1 3.95Å; F168-L222 HydrophobicContact CG-CD1 4.36Å; F190-L222 HydrophobicContact CE2-CD2 4.01Å; F190-L222 HydrophobicContact CZ-CD2 3.87Å; L219-L222 HydrophobicContact CD2-CD2 4.41Å; L219-L222 WeakPolarHBondContact O-CB 3.26Å; L219-L222 PolarHBondContact O-N 2.59Å; R220-L222 VanDerWaalsContact C-N 3.29Å; R220-L222 PolarHBondContact O-N 3.19Å; L222-R225 PolarHBondContact O-N 3.46Å; L222-L226 PolarHBondContact O-N 3.24Å; L222-L226 VanDerWaalsContact O-N 3.11Å; L222-M271 HydrophobicContact CD1-CE 4.05Å; L222-L275 HydrophobicContact CD2-CD2 4.08Å
223	V	94.8	Very high	90.2	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-73.2	-34.3	179.9	-169.5	0	0	0	0	111.9	L219 R220 R225 L226 L227 L284 L285 L288 L308	L219-V223 PolarHBondContact O-N 3.02Å; R220-V223 PolarHBondContact O-N 3.2Å; V223-R225 VanDerWaalsContact C-N 3.35Å; V223-L226 WeakPolarHBondContact O-CB 3.48Å; V223-L226 PolarHBondContact O-N 3.42Å; V223-L227 PolarHBondContact O-N 3.35Å; V223-L284 HydrophobicContact CB-CB 4.31Å; V223-L284 HydrophobicContact CG1-CB 4.25Å; V223-L284 HydrophobicContact CG2-CB 4.06Å; V223-L284 HydrophobicContact CG2-CD1 3.96Å; V223-L285 HydrophobicContact CG1-CD2 3.71Å; V223-L285 HydrophobicContact CG1-CG 4.38Å; V223-L288 HydrophobicContact CB-CD1 4.08Å; V223-L288 HydrophobicContact CG1-CD1 3.56Å; V223-L308 HydrophobicContact CG1-CD1 3.75Å
224	N	93.9	Very high	89.2	Confident	58 Å²	58	42.1 Å²	42.1	31%	0.31	20%	0.203	S	C	.	.	H	α-helix	trans	-63.5	-41.9	172.8	-80.1	-16.1	0	0	0	111.3	R220 P221 L226 L227 I228 L288	R220-N224 WeakPolarHBondContact CG-ND2 3.27Å; R220-N224 VanDerWaalsContact O-CB 3.27Å; R220-N224 WeakPolarHBondContact O-CB 3.47Å; R220-N224 VanDerWaalsContact O-CG 3.27Å; R220-N224 PolarHBondContact O-N 3.27Å; P221-N224 PolarHBondContact O-N 3.15Å; N224-L226 VanDerWaalsContact C-N 3.32Å; N224-L226 PolarHBondContact O-N 3.09Å; N224-L227 PolarHBondContact O-N 3.03Å; N224-I228 VanDerWaalsContact O-CG1 3.26Å; N224-I228 WeakPolarHBondContact O-CG1 3.38Å; N224-I228 PolarHBondContact O-N 3.44Å; N224-L288 WeakPolarHBondContact OD1-CD1 3.42Å
225	R	93.2	Very high	88	Confident	74 Å²	74	40.7 Å²	40.7	28%	0.279	19%	0.185	S	C	.	.	H	α-helix	trans	-61.2	-42	175.2	-176.6	64.2	168.7	-153.4	-7	111.2	F168 D169 P221 L222 V223 L227 I228 Q229	F168-R225 HydrophobicContact CB-CG 4.16Å; F168-R225 HydrophobicContact CD1-CG 3.63Å; F168-R225 HydrophobicContact CD2-CB 4.07Å; F168-R225 HydrophobicContact CD2-CG 3.83Å; F168-R225 HydrophobicContact CE1-CG 4Å; F168-R225 HydrophobicContact CE2-CB 4.43Å; F168-R225 HydrophobicContact CE2-CG 4.17Å; F168-R225 HydrophobicContact CG-CB 4.24Å; F168-R225 HydrophobicContact CG-CG 3.57Å; F168-R225 HydrophobicContact CZ-CG 4.26Å; D169-R225 IonicContact OD1-CZ 3.64Å; D169-R225 IonicContact OD1-NE 3.32Å; D169-R225 IonicContact OD1-NH2 3Å; D169-R225 PolarHBondContact OD1-NH2 3.25Å; D169-R225 IonicContact OD2-NH2 3.85Å; P221-R225 WeakPolarHBondContact O-CB 3.49Å; P221-R225 PolarHBondContact O-N 3.09Å; L222-R225 PolarHBondContact O-N 3.46Å; V223-R225 VanDerWaalsContact C-N 3.35Å; R225-L227 PolarHBondContact O-N 2.86Å; R225-I228 PolarHBondContact O-N 2.98Å; R225-Q229 WeakPolarHBondContact O-CG 3.2Å; R225-Q229 PolarHBondContact O-N 2.92Å
226	L	95.2	Very high	86.5	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-56.2	-49.1	172.6	178.9	60.7	0	0	0	111.7	F168 L222 V223 N224 I228 Q229 L230 L268 T272 L275 L285 L308	F168-L226 HydrophobicContact CE2-CB 3.8Å; F168-L226 HydrophobicContact CE2-CD1 4.19Å; F168-L226 HydrophobicContact CZ-CD1 4.42Å; L222-L226 PolarHBondContact O-N 3.24Å; L222-L226 VanDerWaalsContact O-N 3.11Å; V223-L226 WeakPolarHBondContact O-CB 3.48Å; V223-L226 PolarHBondContact O-N 3.42Å; N224-L226 VanDerWaalsContact C-N 3.32Å; N224-L226 PolarHBondContact O-N 3.09Å; L226-I228 VanDerWaalsContact C-N 3.34Å; L226-I228 PolarHBondContact O-N 3.31Å; L226-Q229 PolarHBondContact O-N 3.19Å; L226-L230 HydrophobicContact CG-CD1 4.34Å; L226-L230 WeakPolarHBondContact O-CG 3.36Å; L226-L230 PolarHBondContact O-N 3.03Å; L226-L268 HydrophobicContact CD1-CB 4.04Å; L226-L268 HydrophobicContact CD1-CD2 3.86Å; L226-T272 HydrophobicContact CD2-CG2 4.48Å; L226-T272 WeakPolarHBondContact CD2-OG1 3.32Å; L226-L275 HydrophobicContact CD2-CD1 3.75Å; L226-L285 HydrophobicContact CD2-CD2 4.1Å; L226-L308 HydrophobicContact CD2-CD1 4.05Å; L226-L308 HydrophobicContact CG-CD1 4.28Å
227	L	93.8	Very high	84.7	Confident	9 Å²	9	48.6 Å²	48.6	5%	0.047	24%	0.24	C	C	.	.	H	α-helix	trans	-62.4	-40.2	177	178.9	57.8	0	0	0	112.3	V223 N224 R225 L230 R231 L288 L308	V223-L227 PolarHBondContact O-N 3.35Å; N224-L227 PolarHBondContact O-N 3.03Å; R225-L227 PolarHBondContact O-N 2.86Å; L227-L230 PolarHBondContact O-N 3.42Å; L227-R231 WeakPolarHBondContact O-CB 3.31Å; L227-R231 VanDerWaalsContact O-CG 3.29Å; L227-R231 WeakPolarHBondContact O-CG 3.28Å; L227-R231 PolarHBondContact O-N 3.44Å; L227-L288 HydrophobicContact CD2-CB 4.34Å; L227-L288 HydrophobicContact CD2-CD2 4.49Å; L227-L308 HydrophobicContact CB-CD1 4.31Å; L227-L308 HydrophobicContact CD1-CB 4.1Å
228	I	92.4	Very high	83	Confident	77 Å²	77	47 Å²	47	40%	0.395	23%	0.233	S	C	.	.	H	α-helix	trans	-64.4	-40.6	176.6	-68.9	163.4	0	0	0	110.7	N224 R225 L226 R231 N232	N224-I228 VanDerWaalsContact O-CG1 3.26Å; N224-I228 WeakPolarHBondContact O-CG1 3.38Å; N224-I228 PolarHBondContact O-N 3.44Å; R225-I228 PolarHBondContact O-N 2.98Å; L226-I228 VanDerWaalsContact C-N 3.34Å; L226-I228 PolarHBondContact O-N 3.31Å; I228-R231 CarbonylContact O-C 3.56Å; I228-R231 WeakPolarHBondContact O-CA 3.45Å; I228-R231 VanDerWaalsContact O-CB 3.27Å; I228-R231 WeakPolarHBondContact O-CB 3.26Å; I228-R231 PolarHBondContact O-N 3.44Å; I228-R231 VanDerWaalsContact O-N 3.08Å; I228-N232 WeakPolarHBondContact CG2-ND2 3.44Å; I228-N232 VanDerWaalsContact O-CG 3.24Å; I228-N232 PolarHBondContact O-N 3.43Å; I228-N232 PolarHBondContact O-ND2 3.04Å
229	Q	91.5	Very high	81.1	Confident	48 Å²	48	55.7 Å²	55.7	22%	0.224	27%	0.273	C	S	.	.	H	α-helix	trans	-67.7	-40.2	176	-70.6	-62.8	-4.2	0	0	111.9	F168 R225 L226 R231 N232 I233 L268	F168-Q229 HydrophobicContact CE1-CG 3.75Å; F168-Q229 HydrophobicContact CZ-CB 4.3Å; F168-Q229 HydrophobicContact CZ-CG 3.88Å; R225-Q229 WeakPolarHBondContact O-CG 3.2Å; R225-Q229 PolarHBondContact O-N 2.92Å; L226-Q229 PolarHBondContact O-N 3.19Å; Q229-R231 PolarHBondContact O-N 3.44Å; Q229-N232 CarbonylContact O-C 3.52Å; Q229-N232 PolarHBondContact O-N 2.9Å; Q229-I233 WeakPolarHBondContact O-CG1 3.43Å; Q229-I233 PolarHBondContact O-N 3.33Å; Q229-L268 HydrophobicContact CB-CD1 4.16Å; Q229-L268 HydrophobicContact CB-CD2 3.83Å
230	L	90.7	Very high	78.8	Confident	3 Å²	3	59.1 Å²	59.1	2%	0.016	30%	0.297	C	S	.	.	H	α-helix	trans	-60.5	-27.9	169.8	-71.6	169.3	0	0	0	112.3	L226 L227 I233 L268 L308 R311 L312	L226-L230 HydrophobicContact CG-CD1 4.34Å; L226-L230 WeakPolarHBondContact O-CG 3.36Å; L226-L230 PolarHBondContact O-N 3.03Å; L227-L230 PolarHBondContact O-N 3.42Å; L230-I233 HydrophobicContact CD2-CD1 4.06Å; L230-L268 HydrophobicContact CD2-CB 3.83Å; L230-L268 HydrophobicContact CD2-CD1 3.72Å; L230-L268 HydrophobicContact CD2-CG 4.41Å; L230-L268 HydrophobicContact CG-CB 4.37Å; L230-L268 HydrophobicContact CG-CD1 4.1Å; L230-L308 HydrophobicContact CD1-CD2 4.48Å; L230-L308 HydrophobicContact CD1-CG 4.01Å; L230-R311 HydrophobicContact CB-CB 4.24Å; L230-R311 PolarHBondContact O-NH1 2.61Å; L230-L312 HydrophobicContact CD1-CD2 4.13Å; L230-L312 HydrophobicContact CD1-CG 4.25Å; L230-L312 HydrophobicContact CD2-CD2 3.67Å
231	R	88.4	Confident	76.4	Confident	105 Å²	105	57.4 Å²	57.4	40%	0.396	30%	0.296	S	S	.	.	H	α-helix	trans	-72.5	-28.8	171.6	-75.1	168.8	178	-170.9	1.5	114.8	L227 I228 Q229	L227-R231 WeakPolarHBondContact O-CB 3.31Å; L227-R231 VanDerWaalsContact O-CG 3.29Å; L227-R231 WeakPolarHBondContact O-CG 3.28Å; L227-R231 PolarHBondContact O-N 3.44Å; I228-R231 CarbonylContact O-C 3.56Å; I228-R231 WeakPolarHBondContact O-CA 3.45Å; I228-R231 VanDerWaalsContact O-CB 3.27Å; I228-R231 WeakPolarHBondContact O-CB 3.26Å; I228-R231 PolarHBondContact O-N 3.44Å; I228-R231 VanDerWaalsContact O-N 3.08Å; Q229-R231 PolarHBondContact O-N 3.44Å
232	N	85.9	Confident	73.8	Confident	101 Å²	101	60.1 Å²	60.1	54%	0.54	31%	0.312	S	S	.	.	S	Bend	trans	-106	11	-172.7	-64	-23.4	0	0	0	113	I228 Q229 Y234	I228-N232 WeakPolarHBondContact CG2-ND2 3.44Å; I228-N232 VanDerWaalsContact O-CG 3.24Å; I228-N232 PolarHBondContact O-N 3.43Å; I228-N232 PolarHBondContact O-ND2 3.04Å; Q229-N232 CarbonylContact O-C 3.52Å; Q229-N232 PolarHBondContact O-N 2.9Å; N232-Y234 PolarHBondContact O-N 2.73Å; N232-Y234 VanDerWaalsContact O-N 3.09Å
233	I	81.2	Confident	71.3	Confident	14 Å²	14	65.9 Å²	65.9	7%	0.072	35%	0.347	C	S	.	.			trans	-54.9	120	174.4	-67.4	-179.9	0	0	0	108.7	Q229 L230 C262 R265 L268	Q229-I233 WeakPolarHBondContact O-CG1 3.43Å; Q229-I233 PolarHBondContact O-N 3.33Å; L230-I233 HydrophobicContact CD2-CD1 4.06Å; I233-C262 HydrophobicContact CG2-CB 4.43Å; I233-C262 WeakPolarHBondContact CG2-SG 3.47Å; I233-R265 HydrophobicContact CD1-CB 4.09Å; I233-R265 HydrophobicContact CD1-CG 4.11Å; I233-L268 HydrophobicContact CD1-CD1 4.02Å; I233-L268 HydrophobicContact CG1-CD1 4.1Å
234	Y	66.5	Low	68.7	Low	135 Å²	135	69.2 Å²	69.2	53%	0.529	37%	0.367	S	S	.	.			trans	-123.6	114.1	-176.9	-168.9	-91.6	0	0	0	109.9	N232 R256	N232-Y234 PolarHBondContact O-N 2.73Å; N232-Y234 VanDerWaalsContact O-N 3.09Å; Y234-R256 PolarHBondContact OH-NH1 2.93Å
235	Y	59.8	Low	66	Low	55 Å²	55	68.1 Å²	68.1	22%	0.216	36%	0.362	C	S	.	.			trans	-111.3	117.8	170.3	-159.3	-120.3	0	0	0	109.9	S237 V259	Y235-S237 WeakPolarHBondContact CD1-OG 3.3Å; Y235-S237 WeakPolarHBondContact CE1-OG 3.45Å; Y235-S237 PolarHBondContact O-N 3.1Å; Y235-V259 HydrophobicContact CD1-CG1 3.96Å; Y235-V259 HydrophobicContact CE1-CG1 4.34Å
236	S	54.3	Low	63.5	Low	95 Å²	95	68.7 Å²	68.7	66%	0.664	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77	-16.8	-169.2	55.6	0	0	0	0	114.4	V238	S236-V238 VanDerWaalsContact C-N 3.31Å; S236-V238 PolarHBondContact O-N 2.63Å
237	S	53.3	Low	60.9	Low	71 Å²	71	77.7 Å²	77.7	50%	0.497	42%	0.416	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-19.5	-173	73.2	0	0	0	0	113.9	Y235 Q239	Y235-S237 WeakPolarHBondContact CD1-OG 3.3Å; Y235-S237 WeakPolarHBondContact CE1-OG 3.45Å; Y235-S237 PolarHBondContact O-N 3.1Å; S237-Q239 PolarHBondContact O-N 2.77Å
238	V	51.8	Low	58.4	Low	33 Å²	33	83.6 Å²	83.6	20%	0.2	45%	0.447	C	S	.	.			trans	-90.7	102.2	-177.4	-174.5	0	0	0	0	110.1	S236 S240 R256 V259	S236-V238 VanDerWaalsContact C-N 3.31Å; S236-V238 PolarHBondContact O-N 2.63Å; V238-S240 PolarHBondContact O-N 3.05Å; V238-R256 HydrophobicContact CB-CG 4.25Å; V238-R256 HydrophobicContact CG1-CG 4.49Å; V238-R256 PolarHBondContact O-NE 3Å; V238-R256 PolarHBondContact O-NH2 3.27Å; V238-V259 HydrophobicContact CG2-CG2 3.76Å
239	Q	47.5	Very low	56.2	Low	182 Å²	182	83.8 Å²	83.8	85%	0.85	45%	0.449	S	S	*	.	P	Polyproline II helix	trans	-60.4	118.3	168	-68	-174	-2	0	0	108.6	S237	S237-Q239 PolarHBondContact O-N 2.77Å
240	S	42.6	Very low	54.4	Low	72 Å²	72	89.8 Å²	89.8	50%	0.503	47%	0.474	S	S	.	.	P	Polyproline II helix	trans	-65.4	134.4	172.1	51.7	0	0	0	0	108.6	V238 T242	V238-S240 PolarHBondContact O-N 3.05Å; S240-T242 PolarHBondContact O-N 3.34Å; S240-T242 VanDerWaalsContact O-N 3.12Å
241	P	42.4	Very low	53	Low	40 Å²	40	92.9 Å²	92.9	26%	0.26	49%	0.489	S	S	.	.	P	Polyproline II helix	trans	-58.9	124.3	172.1	24	-30.3	0	0	0	108.1	V243	P241-V243 PolarHBondContact O-N 3Å
242	T	38.1	Very low	52	Low	90 Å²	90	92.1 Å²	92.1	55%	0.552	49%	0.492	S	S	*	.	P	Polyproline II helix	trans	-54.8	118.9	-175	21.6	0	0	0	0	111.7	S240 V244	S240-T242 PolarHBondContact O-N 3.34Å; S240-T242 VanDerWaalsContact O-N 3.12Å; T242-V244 VanDerWaalsContact C-N 3.27Å; T242-V244 PolarHBondContact O-N 3.44Å
243	V	39.5	Very low	51.5	Low	122 Å²	122	87.3 Å²	87.3	74%	0.739	47%	0.466	S	S	*	.	S	Bend	trans	62.7	-27.4	153.2	-171.9	0	0	0	0	119.2	P241 S246	P241-V243 PolarHBondContact O-N 3Å; V243-S246 PolarHBondContact O-OG 2.84Å
244	V	40.3	Very low	51.1	Low	70 Å²	70	88.3 Å²	88.3	42%	0.424	48%	0.48	S	S	.	.	S	Bend	trans	-89.3	-27	-171	-173	0	0	0	0	113.6	T242 S246 T330	T242-V244 VanDerWaalsContact C-N 3.27Å; T242-V244 PolarHBondContact O-N 3.44Å; V244-S246 VanDerWaalsContact C-N 3.3Å; V244-S246 PolarHBondContact O-N 3.28Å; V244-T330 HydrophobicContact CB-CG2 4.39Å
245	N	38.4	Very low	51.5	Low	35 Å²	35	84.6 Å²	84.6	19%	0.187	48%	0.477	C	S	.	.	G	3₁₀ helix	trans	-74.5	-12.6	-177.5	-87.3	-6.2	0	0	0	115.1	F247 N249	N245-F247 VanDerWaalsContact C-N 3.3Å; N245-F247 PolarHBondContact O-N 3.29Å; N245-N249 PolarHBondContact O-N 2.96Å
246	S	40	Very low	52.1	Low	86 Å²	86	85.5 Å²	85.5	60%	0.601	48%	0.48	S	S	*	.	G	3₁₀ helix	trans	-70.6	-24.1	-178.3	64	0	0	0	0	113.5	V243 V244	V243-S246 PolarHBondContact O-OG 2.84Å; V244-S246 VanDerWaalsContact C-N 3.3Å; V244-S246 PolarHBondContact O-N 3.28Å
247	F	40	Very low	53.3	Low	188 Å²	188	82.7 Å²	82.7	83%	0.825	46%	0.456	S	S	*	.	G	3₁₀ helix	trans	-85.8	-17.9	-178.6	-82.2	-80.8	0	0	0	114	N245	N245-F247 VanDerWaalsContact C-N 3.3Å; N245-F247 PolarHBondContact O-N 3.29Å
248	L	41.9	Very low	54.9	Low	134 Å²	134	80.4 Å²	80.4	70%	0.702	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.4	-27.4	-174.3	-70.8	169.9	0	0	0	114.4
249	N	45.8	Very low	56.5	Low	81 Å²	81	79.2 Å²	79.2	43%	0.433	43%	0.43	S	S	.	.			trans	-110.6	84.2	-179.7	-93.7	-17.4	0	0	0	112.1	N245 Q251	N245-N249 PolarHBondContact O-N 2.96Å; N249-Q251 PolarHBondContact O-N 3.47Å
250	K	54.5	Low	58.5	Low	173 Å²	173	71.1 Å²	71.1	75%	0.752	39%	0.392	S	S	*	.			trans	-75.3	50.1	161.9	-70.5	-177.6	178	177.3	0	110.8	R300	K250-R300 PolarHBondContact O-NH1 3.32Å; K250-R300 VanDerWaalsContact O-NH1 3.12Å; K250-R300 PolarHBondContact O-NH2 3.44Å
251	Q	60.3	Low	60.4	Low	68 Å²	68	72 Å²	72	32%	0.318	39%	0.387	S	S	.	.			trans	-77.5	135.6	171.9	-74.5	-166.4	-21	0	0	109.1	N249 V253	N249-Q251 PolarHBondContact O-N 3.47Å; Q251-V253 VanDerWaalsContact C-N 3.25Å; Q251-V253 PolarHBondContact O-N 2.99Å
252	L	68.9	Low	62.4	Low	90 Å²	90	70.6 Å²	70.6	47%	0.471	38%	0.378	S	S	.	.	S	Bend	trans	-69.5	-27.5	-175.1	-150.3	98	0	0	0	112.5	G306	L252-G306 VanDerWaalsContact CD2-CA 3.42Å
253	V	74	Confident	64.6	Low	0 Å²	0	70 Å²	70	0%	0	38%	0.376	C	S	.	.	S	Bend	trans	-116.8	119.5	177	-179.5	0	0	0	0	109.8	Q251 E257 R258 E305 V314	Q251-V253 VanDerWaalsContact C-N 3.25Å; Q251-V253 PolarHBondContact O-N 2.99Å; V253-E257 WeakPolarHBondContact CA-OE2 3.46Å; V253-E257 HydrophobicContact CG1-CB 3.74Å; V253-E257 WeakPolarHBondContact CG1-OE2 3.37Å; V253-R258 HydrophobicContact CG1-CG 4Å; V253-R258 PolarHBondContact O-NE 2.88Å; V253-R258 PolarHBondContact O-NH2 3.34Å; V253-E305 HydrophobicContact CG2-CB 3.85Å; V253-E305 WeakPolarHBondContact CG2-O 3.27Å; V253-V314 HydrophobicContact CG1-CB 4.37Å; V253-V314 HydrophobicContact CG1-CG1 4.24Å; V253-V314 HydrophobicContact CG1-CG2 4.15Å
254	G	74.4	Confident	66.9	Low	34 Å²	34	67.9 Å²	67.9	35%	0.351	36%	0.358	S	S	.	.			trans	-83.8	166.2	-175.1	0	0	0	0	0	114	R256 E257 R258	G254-R256 VanDerWaalsContact C-N 3.25Å; G254-R256 PolarHBondContact O-N 3.33Å; G254-E257 PolarHBondContact N-OE2 3.43Å; G254-E257 PolarHBondContact O-N 3.37Å; G254-E257 VanDerWaalsContact O-N 3.07Å; G254-R258 PolarHBondContact O-N 3.48Å
255	A	73.6	Confident	69.2	Low	57 Å²	57	65.3 Å²	65.3	47%	0.471	34%	0.341	S	S	.	.	H	α-helix	trans	-56.4	-36	-179.1	0	0	0	0	0	113.6	E257 R258	A255-E257 VanDerWaalsContact C-N 3.31Å; A255-E257 PolarHBondContact O-N 2.94Å; A255-R258 PolarHBondContact O-N 3Å
256	R	73.4	Confident	71.8	Confident	75 Å²	75	68.5 Å²	68.5	28%	0.283	35%	0.35	S	S	.	.	H	α-helix	trans	-66.1	-31	178.4	-69.4	-175.4	174.7	169.1	-1.5	113.6	Y234 V238 G254 R258 V259	Y234-R256 PolarHBondContact OH-NH1 2.93Å; V238-R256 HydrophobicContact CB-CG 4.25Å; V238-R256 HydrophobicContact CG1-CG 4.49Å; V238-R256 PolarHBondContact O-NE 3Å; V238-R256 PolarHBondContact O-NH2 3.27Å; G254-R256 VanDerWaalsContact C-N 3.25Å; G254-R256 PolarHBondContact O-N 3.33Å; R256-R258 VanDerWaalsContact C-N 3.32Å; R256-V259 WeakPolarHBondContact O-CG2 3.38Å
257	E	78.7	Confident	74.3	Confident	35 Å²	35	64.9 Å²	64.9	16%	0.164	32%	0.324	C	S	.	.	H	α-helix	trans	-80.3	-19.7	-179.8	-62.9	171.9	130.7	0	0	111.6	V253 G254 A255 R265 R311	V253-E257 WeakPolarHBondContact CA-OE2 3.46Å; V253-E257 HydrophobicContact CG1-CB 3.74Å; V253-E257 WeakPolarHBondContact CG1-OE2 3.37Å; G254-E257 PolarHBondContact N-OE2 3.43Å; G254-E257 PolarHBondContact O-N 3.37Å; G254-E257 VanDerWaalsContact O-N 3.07Å; A255-E257 VanDerWaalsContact C-N 3.31Å; A255-E257 PolarHBondContact O-N 2.94Å; E257-R265 PolarHBondContact O-NH2 3.13Å; E257-R311 IonicContact OE1-CZ 2.78Å; E257-R311 VanDerWaalsContact OE1-CZ 3.29Å; E257-R311 IonicContact OE1-NH1 3.37Å; E257-R311 PolarHBondContact OE1-NH1 2.68Å; E257-R311 IonicContact OE1-NH2 3.45Å; E257-R311 PolarHBondContact OE1-NH2 3.49Å; E257-R311 IonicContact OE2-NH1 3.6Å; E257-R311 IonicContact OE2-NH2 2.65Å
258	R	86.3	Confident	77	Confident	24 Å²	24	56 Å²	56	9%	0.091	29%	0.285	C	S	.	.	H	α-helix	trans	-86.9	-12.9	-179.1	-63.3	-179.9	-169.4	-92.5	2.3	114.2	V253 G254 A255 R256 L260 E305 V314 S315 S316	V253-R258 HydrophobicContact CG1-CG 4Å; V253-R258 PolarHBondContact O-NE 2.88Å; V253-R258 PolarHBondContact O-NH2 3.34Å; G254-R258 PolarHBondContact O-N 3.48Å; A255-R258 PolarHBondContact O-N 3Å; R256-R258 VanDerWaalsContact C-N 3.32Å; R258-L260 PolarHBondContact O-N 3.45Å; R258-E305 IonicContact CZ-OE1 3.7Å; R258-E305 IonicContact CZ-OE2 2.94Å; R258-E305 VanDerWaalsContact NH1-CD 3.29Å; R258-E305 IonicContact NH1-OE1 3.44Å; R258-E305 PolarHBondContact NH1-OE1 3.37Å; R258-E305 IonicContact NH1-OE2 3.73Å; R258-E305 PolarHBondContact NH1-OE2 2.99Å; R258-E305 IonicContact NH2-OE1 3.04Å; R258-E305 IonicContact NH2-OE2 2.79Å; R258-E305 PolarHBondContact NH2-OE2 3.13Å; R258-V314 HydrophobicContact CG-CB 4.37Å; R258-S315 WeakPolarHBondContact O-CA 3.33Å; R258-S316 PolarHBondContact O-N 2.73Å
259	V	86.5	Confident	79.5	Confident	8 Å²	8	50 Å²	50	5%	0.048	25%	0.254	C	S	.	.			trans	-49.7	129	-177.3	-179	0	0	0	0	110.5	Y235 V238 R256 F261 R265 E337	Y235-V259 HydrophobicContact CD1-CG1 3.96Å; Y235-V259 HydrophobicContact CE1-CG1 4.34Å; V238-V259 HydrophobicContact CG2-CG2 3.76Å; R256-V259 WeakPolarHBondContact O-CG2 3.38Å; V259-F261 WeakPolarHBondContact CG1-O 3.45Å; V259-R265 VanDerWaalsContact O-CZ 3.24Å; V259-R265 PolarHBondContact O-NH1 3.33Å; V259-R265 PolarHBondContact O-NH2 3.24Å; V259-E337 WeakPolarHBondContact CG1-OE2 3.47Å
260	L	88.5	Confident	81.9	Confident	12 Å²	12	47.8 Å²	47.8	6%	0.063	24%	0.242	C	C	.	.	S	Bend	trans	-65.9	-49.2	-177	-179.2	62.1	0	0	0	110.5	R258 C262 R265 S315 H317 F338 I356 L359 M363	R258-L260 PolarHBondContact O-N 3.45Å; L260-C262 PolarHBondContact O-N 2.96Å; L260-R265 PolarHBondContact O-NH1 3.39Å; L260-S315 PolarHBondContact O-OG 3.46Å; L260-H317 HydrophobicContact CD2-CB 4.28Å; L260-F338 HydrophobicContact CB-CE2 4.31Å; L260-F338 HydrophobicContact CD2-CE2 4.27Å; L260-I356 HydrophobicContact CD2-CB 4.36Å; L260-I356 HydrophobicContact CD2-CG1 4.31Å; L260-I356 HydrophobicContact CD2-CG2 3.97Å; L260-L359 HydrophobicContact CD2-CB 4.21Å; L260-L359 HydrophobicContact CD2-CD1 4.33Å; L260-L359 HydrophobicContact CG-CB 4.29Å; L260-L359 HydrophobicContact CG-CD1 4.36Å; L260-M363 HydrophobicContact CD1-CE 4.39Å
261	F	83.7	Confident	83.9	Confident	90 Å²	90	39.5 Å²	39.5	40%	0.395	21%	0.206	S	C	.	.			trans	-87.3	99.3	176.7	-177.2	-98.6	0	0	0	111	V259 P263 E337 L359	V259-F261 WeakPolarHBondContact CG1-O 3.45Å; F261-P263 HydrophobicContact CE1-CG 3.99Å; F261-P263 HydrophobicContact CZ-CG 4.06Å; F261-E337 WeakPolarHBondContact CB-OE1 3.36Å; F261-E337 PolarHBondContact N-OE2 3.01Å; F261-L359 HydrophobicContact CB-CD1 4.22Å; F261-L359 HydrophobicContact CD2-CD1 4.19Å; F261-L359 HydrophobicContact CD2-CD2 4.31Å
262	C	84.8	Confident	85.6	Confident	11 Å²	11	36.3 Å²	36.3	7%	0.074	19%	0.191	C	C	.	.			trans	-136	105.9	170.7	-170.3	0	0	0	0	110.7	I233 L260 Q264 R265	I233-C262 HydrophobicContact CG2-CB 4.43Å; I233-C262 WeakPolarHBondContact CG2-SG 3.47Å; L260-C262 PolarHBondContact O-N 2.96Å; C262-Q264 PolarHBondContact O-N 3.11Å; C262-Q264 VanDerWaalsContact O-N 3.14Å; C262-R265 HydrophobicContact CB-CB 4.27Å; C262-R265 WeakPolarHBondContact O-CB 3.49Å; C262-R265 PolarHBondContact O-N 3.06Å
263	P	83	Confident	87	Confident	78 Å²	78	32.9 Å²	32.9	51%	0.506	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.2	-32.7	-178	-26.6	34	0	0	0	113.8	F261 R265 P267	F261-P263 HydrophobicContact CE1-CG 3.99Å; F261-P263 HydrophobicContact CZ-CG 4.06Å; P263-R265 VanDerWaalsContact C-N 3.25Å; P263-R265 PolarHBondContact O-N 3.35Å; P263-P267 WeakPolarHBondContact O-CD 3.34Å
264	Q	87.2	Confident	88.1	Confident	77 Å²	77	33.5 Å²	33.5	36%	0.36	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-23.4	179.6	-65	173.8	-8.4	0	0	113.2	C262 L268	C262-Q264 PolarHBondContact O-N 3.11Å; C262-Q264 VanDerWaalsContact O-N 3.14Å; Q264-L268 WeakPolarHBondContact O-CG 3.42Å
265	R	90.6	Very high	89.1	Confident	15 Å²	15	31.9 Å²	31.9	6%	0.057	16%	0.158	C	C	.	.	H	α-helix	trans	-75.1	-37.1	-174.5	-167.1	179.4	-63.6	112.9	-3	112.3	I233 E257 V259 L260 C262 P263 L268 L269 S315	I233-R265 HydrophobicContact CD1-CB 4.09Å; I233-R265 HydrophobicContact CD1-CG 4.11Å; E257-R265 PolarHBondContact O-NH2 3.13Å; V259-R265 VanDerWaalsContact O-CZ 3.24Å; V259-R265 PolarHBondContact O-NH1 3.33Å; V259-R265 PolarHBondContact O-NH2 3.24Å; L260-R265 PolarHBondContact O-NH1 3.39Å; C262-R265 HydrophobicContact CB-CB 4.27Å; C262-R265 WeakPolarHBondContact O-CB 3.49Å; C262-R265 PolarHBondContact O-N 3.06Å; P263-R265 VanDerWaalsContact C-N 3.25Å; P263-R265 PolarHBondContact O-N 3.35Å; R265-L268 PolarHBondContact O-N 2.99Å; R265-L269 PolarHBondContact O-N 3.49Å; R265-S315 PolarHBondContact NH1-OG 3.43Å
266	R	91.6	Very high	90.3	Very high	103 Å²	103	29.1 Å²	29.1	39%	0.389	14%	0.136	S	C	.	.	H	α-helix	trans	-62.1	-48.2	-175	-179.3	-179.2	-179.3	-137.6	2.4	112.8	D178 L268 L269 I270 Q362 E366	D178-R266 IonicContact OD1-NH1 2.8Å; R266-L268 VanDerWaalsContact C-N 3.28Å; R266-L268 PolarHBondContact O-N 2.71Å; R266-L269 PolarHBondContact O-N 3.46Å; R266-L269 VanDerWaalsContact O-N 3.15Å; R266-I270 HydrophobicContact CG-CD1 4.01Å; R266-I270 HydrophobicContact CG-CG1 4.48Å; R266-I270 WeakPolarHBondContact O-CG1 3.45Å; R266-I270 PolarHBondContact O-N 2.99Å; R266-Q362 VanDerWaalsContact NE-NE2 3.11Å; R266-E366 IonicContact NE-OE1 3.53Å; R266-E366 PolarHBondContact NE-OE1 3.37Å
267	P	93.7	Very high	91.3	Very high	9 Å²	9	28.5 Å²	28.5	6%	0.058	14%	0.135	C	C	.	.	H	α-helix	trans	-54.1	-42.4	172.5	-29.4	37	0	0	0	113.3	Y172 L175 P263 I270 M271	Y172-P267 HydrophobicContact CD2-CB 4.02Å; Y172-P267 HydrophobicContact CE2-CB 3.8Å; L175-P267 HydrophobicContact CB-CB 3.75Å; L175-P267 HydrophobicContact CB-CG 4.47Å; L175-P267 WeakPolarHBondContact CD1-O 3.32Å; P263-P267 WeakPolarHBondContact O-CD 3.34Å; P267-I270 PolarHBondContact O-N 3.43Å; P267-M271 WeakPolarHBondContact O-CB 3.09Å; P267-M271 PolarHBondContact O-N 3.32Å
268	L	95.6	Very high	92.1	Very high	2 Å²	2	28.3 Å²	28.3	1%	0.01	13%	0.133	C	C	.	.	H	α-helix	trans	-66.7	-39.4	178.8	-59.1	172.2	0	0	0	111.8	F168 Y172 L226 Q229 L230 I233 Q264 R265 R266 M271 T272	F168-L268 HydrophobicContact CZ-CD2 4.01Å; Y172-L268 HydrophobicContact CD2-CD2 3.65Å; Y172-L268 HydrophobicContact CD2-CG 4.37Å; Y172-L268 HydrophobicContact CE2-CD2 3.53Å; Y172-L268 HydrophobicContact CE2-CG 3.85Å; L226-L268 HydrophobicContact CD1-CB 4.04Å; L226-L268 HydrophobicContact CD1-CD2 3.86Å; Q229-L268 HydrophobicContact CB-CD1 4.16Å; Q229-L268 HydrophobicContact CB-CD2 3.83Å; L230-L268 HydrophobicContact CD2-CB 3.83Å; L230-L268 HydrophobicContact CD2-CD1 3.72Å; L230-L268 HydrophobicContact CD2-CG 4.41Å; L230-L268 HydrophobicContact CG-CB 4.37Å; L230-L268 HydrophobicContact CG-CD1 4.1Å; I233-L268 HydrophobicContact CD1-CD1 4.02Å; I233-L268 HydrophobicContact CG1-CD1 4.1Å; Q264-L268 WeakPolarHBondContact O-CG 3.42Å; R265-L268 PolarHBondContact O-N 2.99Å; R266-L268 VanDerWaalsContact C-N 3.28Å; R266-L268 PolarHBondContact O-N 2.71Å; L268-M271 PolarHBondContact O-N 2.93Å; L268-T272 WeakPolarHBondContact O-CB 3.39Å; L268-T272 PolarHBondContact O-N 2.64Å; L268-T272 PolarHBondContact O-OG1 3.19Å
269	L	95.5	Very high	92.4	Very high	8 Å²	8	27.8 Å²	27.8	4%	0.042	13%	0.134	C	C	.	.	H	α-helix	trans	-64.7	-45.1	174.7	178.7	52.8	0	0	0	111.4	R265 R266 M271 T272 I273 L312 E366 L367 L370	R265-L269 PolarHBondContact O-N 3.49Å; R266-L269 PolarHBondContact O-N 3.46Å; R266-L269 VanDerWaalsContact O-N 3.15Å; L269-M271 PolarHBondContact O-N 3.21Å; L269-T272 CarbonylContact O-C 3.59Å; L269-T272 WeakPolarHBondContact O-CA 3.36Å; L269-T272 WeakPolarHBondContact O-CB 3.22Å; L269-T272 PolarHBondContact O-N 2.71Å; L269-T272 VanDerWaalsContact O-N 3.14Å; L269-I273 HydrophobicContact CD1-CD1 4.43Å; L269-I273 HydrophobicContact CD1-CG1 4.45Å; L269-I273 HydrophobicContact CG-CD1 4.28Å; L269-I273 WeakPolarHBondContact O-CG1 3.48Å; L269-I273 PolarHBondContact O-N 3.36Å; L269-L312 HydrophobicContact CB-CD2 4.16Å; L269-L312 HydrophobicContact CD1-CD1 4.07Å; L269-L312 HydrophobicContact CD1-CD2 4.14Å; L269-E366 HydrophobicContact CD2-CB 3.66Å; L269-E366 WeakPolarHBondContact CD2-OE2 3.48Å; L269-E366 HydrophobicContact CG-CB 4.15Å; L269-L367 HydrophobicContact CD1-CD2 4.1Å; L269-L367 HydrophobicContact CD2-CD2 4.49Å; L269-L370 HydrophobicContact CD1-CD2 4.07Å
270	I	95.5	Very high	92.7	Very high	34 Å²	34	27.4 Å²	27.4	17%	0.174	13%	0.132	C	C	.	.	H	α-helix	trans	-60.9	-45	176.4	-65.6	170.8	0	0	0	111	L175 R266 P267 T272 I273 W274	L175-I270 HydrophobicContact CD1-CB 4.38Å; L175-I270 HydrophobicContact CD1-CG2 4.22Å; L175-I270 HydrophobicContact CD2-CB 4.29Å; L175-I270 HydrophobicContact CD2-CG2 3.64Å; R266-I270 HydrophobicContact CG-CD1 4.01Å; R266-I270 HydrophobicContact CG-CG1 4.48Å; R266-I270 WeakPolarHBondContact O-CG1 3.45Å; R266-I270 PolarHBondContact O-N 2.99Å; P267-I270 PolarHBondContact O-N 3.43Å; I270-T272 VanDerWaalsContact C-N 3.27Å; I270-T272 PolarHBondContact O-N 3.43Å; I270-I273 WeakPolarHBondContact O-CA 3.44Å; I270-I273 WeakPolarHBondContact O-CB 3.28Å; I270-I273 PolarHBondContact O-N 2.9Å; I270-I273 VanDerWaalsContact O-N 3.08Å; I270-W274 HydrophobicContact CG2-CD2 4.45Å; I270-W274 HydrophobicContact CG2-CZ2 3.99Å; I270-W274 PolarHBondContact O-N 2.71Å
271	M	95.9	Very high	93	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-60.6	-39.5	175.6	-168.3	176.4	-170.8	0	0	111.6	F168 V171 L175 F190 L222 P267 L268 L269 W274 L275	F168-M271 HydrophobicContact CD2-CE 3.4Å; F168-M271 HydrophobicContact CD2-SD 3.75Å; F168-M271 HydrophobicContact CE2-CE 3.72Å; F168-M271 HydrophobicContact CE2-SD 3.38Å; F168-M271 WeakPolarHBondContact CE2-SD 3.32Å; F168-M271 HydrophobicContact CG-CE 4.12Å; F168-M271 HydrophobicContact CZ-SD 3.94Å; V171-M271 HydrophobicContact CB-CE 4.11Å; V171-M271 HydrophobicContact CG1-CE 3.93Å; V171-M271 HydrophobicContact CG1-CG 4.22Å; V171-M271 HydrophobicContact CG1-SD 4.18Å; L175-M271 HydrophobicContact CD1-CB 3.97Å; F190-M271 HydrophobicContact CZ-CE 4.14Å; L222-M271 HydrophobicContact CD1-CE 4.05Å; P267-M271 WeakPolarHBondContact O-CB 3.09Å; P267-M271 PolarHBondContact O-N 3.32Å; L268-M271 PolarHBondContact O-N 2.93Å; L269-M271 PolarHBondContact O-N 3.21Å; M271-W274 PolarHBondContact O-N 2.86Å; M271-L275 HydrophobicContact CG-CD1 4.36Å; M271-L275 WeakPolarHBondContact O-CG 3.46Å; M271-L275 PolarHBondContact O-N 3.43Å
272	T	97.4	Very high	93.6	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-62.8	-41.6	173.6	-49.4	0	0	0	0	111.5	L226 L268 L269 I270 W274 L275 S276 L285 L308 L312 L370	L226-T272 HydrophobicContact CD2-CG2 4.48Å; L226-T272 WeakPolarHBondContact CD2-OG1 3.32Å; L268-T272 WeakPolarHBondContact O-CB 3.39Å; L268-T272 PolarHBondContact O-N 2.64Å; L268-T272 PolarHBondContact O-OG1 3.19Å; L269-T272 CarbonylContact O-C 3.59Å; L269-T272 WeakPolarHBondContact O-CA 3.36Å; L269-T272 WeakPolarHBondContact O-CB 3.22Å; L269-T272 PolarHBondContact O-N 2.71Å; L269-T272 VanDerWaalsContact O-N 3.14Å; I270-T272 VanDerWaalsContact C-N 3.27Å; I270-T272 PolarHBondContact O-N 3.43Å; T272-W274 VanDerWaalsContact C-N 3.31Å; T272-W274 PolarHBondContact O-N 3.23Å; T272-L275 PolarHBondContact O-N 3.06Å; T272-S276 WeakPolarHBondContact O-CB 3.33Å; T272-S276 PolarHBondContact O-N 3.23Å; T272-L285 HydrophobicContact CG2-CD1 3.98Å; T272-L285 HydrophobicContact CG2-CD2 3.84Å; T272-L308 HydrophobicContact CG2-CD2 3.89Å; T272-L312 HydrophobicContact CG2-CD1 3.72Å; T272-L370 HydrophobicContact CG2-CD1 3.77Å; T272-L370 HydrophobicContact CG2-CD2 4Å
273	I	97.8	Very high	94.2	Very high	18 Å²	18	22 Å²	22	9%	0.092	11%	0.107	C	C	.	.	H	α-helix	trans	-59.9	-42	175.6	-69.9	164.8	0	0	0	110.5	L269 I270 S276 E366 T369 L370 N373	L269-I273 HydrophobicContact CD1-CD1 4.43Å; L269-I273 HydrophobicContact CD1-CG1 4.45Å; L269-I273 HydrophobicContact CG-CD1 4.28Å; L269-I273 WeakPolarHBondContact O-CG1 3.48Å; L269-I273 PolarHBondContact O-N 3.36Å; I270-I273 WeakPolarHBondContact O-CA 3.44Å; I270-I273 WeakPolarHBondContact O-CB 3.28Å; I270-I273 PolarHBondContact O-N 2.9Å; I270-I273 VanDerWaalsContact O-N 3.08Å; I273-S276 PolarHBondContact O-N 2.83Å; I273-S276 PolarHBondContact O-OG 3.33Å; I273-E366 HydrophobicContact CD1-CB 3.97Å; I273-E366 HydrophobicContact CD1-CG 4.5Å; I273-E366 WeakPolarHBondContact CD1-O 3.47Å; I273-T369 HydrophobicContact CG2-CG2 3.86Å; I273-L370 HydrophobicContact CG1-CB 3.86Å; I273-N373 PolarHBondContact O-ND2 2.93Å
274	W	96.4	Very high	94.8	Very high	13 Å²	13	18.4 Å²	18.4	5%	0.049	8%	0.083	C	C	.	.	H	α-helix	trans	-64.2	-47.4	176.9	-64.6	-1.2	0	0	0	111.6	V171 L175 I183 I186 Q187 F190 I270 M271 T272 S276 K277	V171-W274 HydrophobicContact CG1-CE3 4.23Å; V171-W274 HydrophobicContact CG1-CZ3 3.85Å; L175-W274 HydrophobicContact CD1-CH2 4.42Å; L175-W274 HydrophobicContact CD1-CZ3 4.36Å; L175-W274 HydrophobicContact CD2-CH2 3.65Å; L175-W274 HydrophobicContact CD2-CZ2 3.8Å; L175-W274 HydrophobicContact CD2-CZ3 4.38Å; L175-W274 HydrophobicContact CG-CH2 4.22Å; I183-W274 HydrophobicContact CG2-CH2 4.05Å; I183-W274 HydrophobicContact CG2-CZ2 3.91Å; I186-W274 HydrophobicContact CG2-CZ3 4.34Å; Q187-W274 HydrophobicContact CB-CH2 3.58Å; Q187-W274 HydrophobicContact CB-CZ2 3.59Å; Q187-W274 HydrophobicContact CB-CZ3 4.09Å; Q187-W274 HydrophobicContact CG-CD2 4.01Å; Q187-W274 HydrophobicContact CG-CE3 4.38Å; Q187-W274 HydrophobicContact CG-CH2 4.03Å; Q187-W274 HydrophobicContact CG-CZ2 3.64Å; Q187-W274 HydrophobicContact CG-CZ3 4.38Å; F190-W274 HydrophobicContact CD1-CB 4.27Å; F190-W274 AromaticContact CD1-CE3 3.82Å; F190-W274 HydrophobicContact CD1-CE3 3.82Å; F190-W274 HydrophobicContact CE1-CB 4.29Å; F190-W274 HydrophobicContact CE1-CE3 4.36Å; I270-W274 HydrophobicContact CG2-CD2 4.45Å; I270-W274 HydrophobicContact CG2-CZ2 3.99Å; I270-W274 PolarHBondContact O-N 2.71Å; M271-W274 PolarHBondContact O-N 2.86Å; T272-W274 VanDerWaalsContact C-N 3.31Å; T272-W274 PolarHBondContact O-N 3.23Å; W274-S276 VanDerWaalsContact C-N 3.27Å; W274-S276 PolarHBondContact O-N 3.05Å; W274-K277 PolarHBondContact O-N 2.9Å
275	L	96.4	Very high	95.4	Very high	0 Å²	0	14.7 Å²	14.7	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-61.8	-32.9	176.9	-70.7	167.9	0	0	0	112.5	F190 L194 L222 L226 M271 T272 K277 Y278 T281 L285	F190-L275 HydrophobicContact CE1-CD2 4.01Å; F190-L275 HydrophobicContact CE1-CG 4.24Å; F190-L275 HydrophobicContact CZ-CD2 3.85Å; F190-L275 HydrophobicContact CZ-CG 4.4Å; L194-L275 HydrophobicContact CD1-CD2 3.99Å; L194-L275 HydrophobicContact CD2-CD2 4.43Å; L222-L275 HydrophobicContact CD2-CD2 4.08Å; L226-L275 HydrophobicContact CD2-CD1 3.75Å; M271-L275 HydrophobicContact CG-CD1 4.36Å; M271-L275 WeakPolarHBondContact O-CG 3.46Å; M271-L275 PolarHBondContact O-N 3.43Å; T272-L275 PolarHBondContact O-N 3.06Å; L275-K277 PolarHBondContact O-N 3.31Å; L275-K277 VanDerWaalsContact O-N 3.13Å; L275-Y278 PolarHBondContact O-N 3.32Å; L275-T281 HydrophobicContact CD2-CG2 3.6Å; L275-T281 VanDerWaalsContact O-CB 3.3Å; L275-T281 WeakPolarHBondContact O-CB 3.4Å; L275-T281 PolarHBondContact O-OG1 3.43Å; L275-L285 HydrophobicContact CB-CD1 3.99Å
276	S	96.9	Very high	95.7	Very high	0 Å²	0	14 Å²	14	0%	0	6%	0.063	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-13.4	-177.6	71.9	0	0	0	0	115.4	T272 I273 W274 Y278 N373 V377	T272-S276 WeakPolarHBondContact O-CB 3.33Å; T272-S276 PolarHBondContact O-N 3.23Å; I273-S276 PolarHBondContact O-N 2.83Å; I273-S276 PolarHBondContact O-OG 3.33Å; W274-S276 VanDerWaalsContact C-N 3.27Å; W274-S276 PolarHBondContact O-N 3.05Å; S276-Y278 VanDerWaalsContact C-N 3.29Å; S276-Y278 PolarHBondContact O-N 3.38Å; S276-N373 WeakPolarHBondContact OG-CB 3.42Å; S276-N373 PolarHBondContact OG-ND2 3.48Å; S276-V377 WeakPolarHBondContact O-CG2 3.47Å
277	K	95.6	Very high	95.9	Very high	61 Å²	61	11.8 Å²	11.8	27%	0.265	6%	0.057	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.5	-17.5	-179.1	-61.1	176.9	-169.4	166	0	113.6	D191 W274 L275 V377	D191-K277 IonicContact OD1-NZ 3.66Å; D191-K277 PolarHBondContact OD1-NZ 3.3Å; D191-K277 IonicContact OD2-NZ 2.96Å; D191-K277 PolarHBondContact OD2-NZ 3.44Å; D191-K277 VanDerWaalsContact OD2-NZ 3.13Å; W274-K277 PolarHBondContact O-N 2.9Å; L275-K277 PolarHBondContact O-N 3.31Å; L275-K277 VanDerWaalsContact O-N 3.13Å; K277-V377 VanDerWaalsContact O-CG2 3.26Å; K277-V377 WeakPolarHBondContact O-CG2 3.44Å
278	Y	94.7	Very high	96	Very high	31 Å²	31	13.4 Å²	13.4	12%	0.122	7%	0.065	C	C	.	.	S	Bend	trans	-117.3	145.5	-171.1	-52.9	-83.7	0	0	0	112	D191 L194 S195 L275 S276 V280 T281 A282	D191-Y278 WeakPolarHBondContact CA-OH 3.35Å; D191-Y278 VanDerWaalsContact CB-OH 3.23Å; D191-Y278 WeakPolarHBondContact CB-OH 3.32Å; D191-Y278 PolarHBondContact O-OH 3.31Å; D191-Y278 PolarHBondContact OD1-OH 2.87Å; L194-Y278 HydrophobicContact CB-CD1 4.28Å; L194-Y278 HydrophobicContact CB-CD2 3.74Å; L194-Y278 HydrophobicContact CB-CE1 4.27Å; L194-Y278 HydrophobicContact CB-CE2 3.71Å; L194-Y278 HydrophobicContact CB-CG 4.05Å; L194-Y278 HydrophobicContact CD1-CD2 3.62Å; L194-Y278 HydrophobicContact CD1-CE2 3.62Å; L194-Y278 HydrophobicContact CG-CD2 4.32Å; L194-Y278 HydrophobicContact CG-CE2 4.33Å; S195-Y278 VanDerWaalsContact OG-CE1 3.25Å; S195-Y278 WeakPolarHBondContact OG-CE1 3.49Å; L275-Y278 PolarHBondContact O-N 3.32Å; S276-Y278 VanDerWaalsContact C-N 3.29Å; S276-Y278 PolarHBondContact O-N 3.38Å; Y278-V280 PolarHBondContact O-N 3.37Å; Y278-T281 WeakPolarHBondContact CB-OG1 3.36Å; Y278-T281 PolarHBondContact O-OG1 3.27Å; Y278-T281 VanDerWaalsContact O-OG1 3.13Å; Y278-A282 WeakPolarHBondContact O-CB 3.36Å; Y278-A282 PolarHBondContact O-N 3.34Å
279	A	93.2	Very high	96	Very high	14 Å²	14	13.3 Å²	13.3	12%	0.116	7%	0.065	C	C	.	.	H	α-helix	trans	-62.6	-47.2	-170.8	0	0	0	0	0	114.1	L202 A282 Q283 V377 I384	L202-A279 HydrophobicContact CD1-CB 3.94Å; A279-A282 PolarHBondContact O-N 3.24Å; A279-Q283 WeakPolarHBondContact O-CB 3.06Å; A279-Q283 PolarHBondContact O-N 3.35Å; A279-V377 HydrophobicContact CB-CG1 4.12Å; A279-I384 HydrophobicContact CB-CD1 3.71Å; A279-I384 VanDerWaalsContact O-CD1 3.25Å; A279-I384 WeakPolarHBondContact O-CD1 3.37Å
280	V	93.2	Very high	96	Very high	0 Å²	0	14.6 Å²	14.6	0%	0	7%	0.07	C	C	.	.	H	α-helix	trans	-63.3	-48	-176.6	178.8	0	0	0	0	110.9	V198 L202 C211 A215 L216 L219 Y278 Q283 L284	V198-V280 HydrophobicContact CG2-CB 4.22Å; V198-V280 HydrophobicContact CG2-CG2 3.98Å; L202-V280 HydrophobicContact CD1-CG2 4.42Å; L202-V280 HydrophobicContact CD2-CG2 4.38Å; L202-V280 HydrophobicContact CG-CG2 4.49Å; C211-V280 HydrophobicContact CB-CG2 4.31Å; A215-V280 HydrophobicContact CB-CG1 4.21Å; A215-V280 HydrophobicContact CB-CG2 4.14Å; A215-V280 VanDerWaalsContact O-CG1 3.31Å; A215-V280 WeakPolarHBondContact O-CG1 3.3Å; L216-V280 HydrophobicContact CD2-CG1 3.97Å; L219-V280 HydrophobicContact CD1-CB 4.48Å; L219-V280 HydrophobicContact CD1-CG1 4.15Å; Y278-V280 PolarHBondContact O-N 3.37Å; V280-Q283 PolarHBondContact O-N 3.07Å; V280-L284 WeakPolarHBondContact O-CG 3.47Å; V280-L284 PolarHBondContact O-N 3.38Å; V280-L284 VanDerWaalsContact O-N 3.13Å
281	T	94.9	Very high	95.9	Very high	0 Å²	0	13.4 Å²	13.4	0%	0	6%	0.064	C	C	.	.	H	α-helix	trans	-71.3	-40.1	178.8	44.2	0	0	0	0	111.8	L194 L219 L275 Y278 Q283 L284 L285	L194-T281 HydrophobicContact CD2-CG2 4.2Å; L219-T281 HydrophobicContact CB-CG2 4.32Å; L219-T281 HydrophobicContact CD1-CG2 3.52Å; L275-T281 HydrophobicContact CD2-CG2 3.6Å; L275-T281 VanDerWaalsContact O-CB 3.3Å; L275-T281 WeakPolarHBondContact O-CB 3.4Å; L275-T281 PolarHBondContact O-OG1 3.43Å; Y278-T281 WeakPolarHBondContact CB-OG1 3.36Å; Y278-T281 PolarHBondContact O-OG1 3.27Å; Y278-T281 VanDerWaalsContact O-OG1 3.13Å; T281-Q283 VanDerWaalsContact C-N 3.29Å; T281-Q283 PolarHBondContact O-N 3.44Å; T281-L284 PolarHBondContact O-N 2.84Å; T281-L285 WeakPolarHBondContact O-CB 3.38Å; T281-L285 WeakPolarHBondContact O-CG 3.42Å; T281-L285 PolarHBondContact O-N 3.32Å
282	A	96.8	Very high	95.5	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-57	-43.2	173.4	0	0	0	0	0	111.7	Y278 A279 L285 I286 L374 V377 I384	Y278-A282 WeakPolarHBondContact O-CB 3.36Å; Y278-A282 PolarHBondContact O-N 3.34Å; A279-A282 PolarHBondContact O-N 3.24Å; A282-L285 PolarHBondContact O-N 3.05Å; A282-I286 WeakPolarHBondContact O-CD1 3.24Å; A282-I286 VanDerWaalsContact O-CG1 3.26Å; A282-I286 WeakPolarHBondContact O-CG1 3.06Å; A282-I286 PolarHBondContact O-N 2.94Å; A282-I286 VanDerWaalsContact O-N 3.15Å; A282-L374 HydrophobicContact CB-CD2 3.6Å; A282-V377 HydrophobicContact CB-CB 4.45Å; A282-V377 HydrophobicContact CB-CG1 3.95Å; A282-I384 HydrophobicContact CB-CG2 4.31Å
283	Q	96.6	Very high	94.9	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-60.4	-49.9	174.6	179.2	172.2	-21.5	0	0	111.4	S210 C211 L216 A279 V280 T281 L285 I286 E287 Y383 I384 L387	S210-Q283 PolarHBondContact OG-NE2 3.4Å; C211-Q283 VanDerWaalsContact CB-OE1 3.3Å; C211-Q283 PolarHBondContact SG-OE1 2.7Å; L216-Q283 HydrophobicContact CD2-CB 4.35Å; L216-Q283 HydrophobicContact CD2-CG 4.23Å; A279-Q283 WeakPolarHBondContact O-CB 3.06Å; A279-Q283 PolarHBondContact O-N 3.35Å; V280-Q283 PolarHBondContact O-N 3.07Å; T281-Q283 VanDerWaalsContact C-N 3.29Å; T281-Q283 PolarHBondContact O-N 3.44Å; Q283-L285 VanDerWaalsContact C-N 3.34Å; Q283-L285 PolarHBondContact O-N 3.31Å; Q283-I286 PolarHBondContact O-N 3.16Å; Q283-E287 HydrophobicContact CG-CG 4.22Å; Q283-E287 WeakPolarHBondContact CG-OE1 3.34Å; Q283-E287 PolarHBondContact NE2-OE1 3.1Å; Q283-E287 WeakPolarHBondContact O-CG 3.03Å; Q283-E287 PolarHBondContact O-N 3.12Å; Q283-Y383 HydrophobicContact CG-CE1 4.32Å; Q283-I384 HydrophobicContact CB-CG1 4.43Å; Q283-L387 HydrophobicContact CG-CD2 4.17Å
284	L	96.4	Very high	94.5	Very high	1 Å²	1	26.7 Å²	26.7	1%	0.005	13%	0.128	C	C	.	.	H	α-helix	trans	-59.7	-42.1	178.1	-71	169.6	0	0	0	112.8	L216 L219 R220 V223 V280 T281 I286 E287 L288	L216-L284 HydrophobicContact CB-CD2 4.24Å; L216-L284 HydrophobicContact CD2-CD1 4.33Å; L216-L284 HydrophobicContact CD2-CD2 3.8Å; L216-L284 HydrophobicContact CD2-CG 3.68Å; L219-L284 HydrophobicContact CB-CD1 4.04Å; R220-L284 HydrophobicContact CB-CD1 4.36Å; R220-L284 HydrophobicContact CB-CD2 4.16Å; R220-L284 HydrophobicContact CG-CD2 4.43Å; V223-L284 HydrophobicContact CB-CB 4.31Å; V223-L284 HydrophobicContact CG1-CB 4.25Å; V223-L284 HydrophobicContact CG2-CB 4.06Å; V223-L284 HydrophobicContact CG2-CD1 3.96Å; V280-L284 WeakPolarHBondContact O-CG 3.47Å; V280-L284 PolarHBondContact O-N 3.38Å; V280-L284 VanDerWaalsContact O-N 3.13Å; T281-L284 PolarHBondContact O-N 2.84Å; L284-I286 VanDerWaalsContact C-N 3.29Å; L284-I286 PolarHBondContact O-N 3.43Å; L284-E287 PolarHBondContact O-N 2.85Å; L284-L288 VanDerWaalsContact O-CB 3.32Å; L284-L288 WeakPolarHBondContact O-CB 3.5Å; L284-L288 VanDerWaalsContact O-CG 3.3Å; L284-L288 WeakPolarHBondContact O-CG 3.35Å; L284-L288 PolarHBondContact O-N 3.22Å
285	L	97.8	Very high	93.9	Very high	0 Å²	0	32 Å²	32	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-58.4	-42.4	177.6	-70.7	174.4	0	0	0	111.2	V223 L226 T272 L275 T281 A282 Q283 S289 L308	V223-L285 HydrophobicContact CG1-CD2 3.71Å; V223-L285 HydrophobicContact CG1-CG 4.38Å; L226-L285 HydrophobicContact CD2-CD2 4.1Å; T272-L285 HydrophobicContact CG2-CD1 3.98Å; T272-L285 HydrophobicContact CG2-CD2 3.84Å; L275-L285 HydrophobicContact CB-CD1 3.99Å; T281-L285 WeakPolarHBondContact O-CB 3.38Å; T281-L285 WeakPolarHBondContact O-CG 3.42Å; T281-L285 PolarHBondContact O-N 3.32Å; A282-L285 PolarHBondContact O-N 3.05Å; Q283-L285 VanDerWaalsContact C-N 3.34Å; Q283-L285 PolarHBondContact O-N 3.31Å; L285-S289 PolarHBondContact O-N 3.3Å; L285-S289 PolarHBondContact O-OG 3.44Å; L285-L308 HydrophobicContact CD2-CD1 3.56Å; L285-L308 HydrophobicContact CD2-CD2 3.61Å; L285-L308 HydrophobicContact CD2-CG 4.25Å
286	I	97.5	Very high	93.3	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-75.7	-43.7	179.8	-58.1	159.5	0	0	0	110.8	A282 Q283 L284 L288 S289 F290 L309 L374 I384 L387 L388 W391	A282-I286 WeakPolarHBondContact O-CD1 3.24Å; A282-I286 VanDerWaalsContact O-CG1 3.26Å; A282-I286 WeakPolarHBondContact O-CG1 3.06Å; A282-I286 PolarHBondContact O-N 2.94Å; A282-I286 VanDerWaalsContact O-N 3.15Å; Q283-I286 PolarHBondContact O-N 3.16Å; L284-I286 VanDerWaalsContact C-N 3.29Å; L284-I286 PolarHBondContact O-N 3.43Å; I286-L288 VanDerWaalsContact C-N 3.33Å; I286-L288 PolarHBondContact O-N 3.27Å; I286-S289 WeakPolarHBondContact O-CA 3.44Å; I286-S289 VanDerWaalsContact O-CB 3.28Å; I286-S289 WeakPolarHBondContact O-CB 3.41Å; I286-S289 PolarHBondContact O-N 2.89Å; I286-F290 HydrophobicContact CG2-CE2 3.94Å; I286-F290 VanDerWaalsContact O-CD2 3.31Å; I286-F290 WeakPolarHBondContact O-CD2 3.35Å; I286-L309 HydrophobicContact CG1-CD1 4.42Å; I286-L374 HydrophobicContact CD1-CD2 4.45Å; I286-L374 HydrophobicContact CG1-CD1 4.4Å; I286-I384 HydrophobicContact CD1-CG2 3.76Å; I286-L387 HydrophobicContact CB-CD2 4Å; I286-L387 HydrophobicContact CB-CG 4.32Å; I286-L387 HydrophobicContact CG2-CB 4.44Å; I286-L387 HydrophobicContact CG2-CD2 3.93Å; I286-L387 HydrophobicContact CG2-CG 3.68Å; I286-L388 HydrophobicContact CD1-CB 3.9Å; I286-L388 HydrophobicContact CD1-CD1 4.28Å; I286-L388 HydrophobicContact CG1-CD1 4.21Å; I286-W391 HydrophobicContact CG2-CB 4.29Å
287	E	95.6	Very high	92.6	Very high	57 Å²	57	38.2 Å²	38.2	27%	0.266	22%	0.219	S	C	.	.	H	α-helix	trans	-57	-45.6	177.5	-76.2	-178.7	179.4	0	0	111.9	R220 Q283 L284 S289 F290 L387	R220-E287 IonicContact NH2-OE2 3.4Å; Q283-E287 HydrophobicContact CG-CG 4.22Å; Q283-E287 WeakPolarHBondContact CG-OE1 3.34Å; Q283-E287 PolarHBondContact NE2-OE1 3.1Å; Q283-E287 WeakPolarHBondContact O-CG 3.03Å; Q283-E287 PolarHBondContact O-N 3.12Å; L284-E287 PolarHBondContact O-N 2.85Å; E287-S289 PolarHBondContact O-N 3.14Å; E287-S289 VanDerWaalsContact O-N 3.14Å; E287-F290 PolarHBondContact O-N 2.98Å; E287-L387 HydrophobicContact CG-CD2 3.94Å
288	L	95.6	Very high	92.1	Very high	43 Å²	43	39.3 Å²	39.3	23%	0.225	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-0.2	177.4	-67.6	171.2	0	0	0	113.6	V223 N224 L227 L284 I286 G307 L308	V223-L288 HydrophobicContact CB-CD1 4.08Å; V223-L288 HydrophobicContact CG1-CD1 3.56Å; N224-L288 WeakPolarHBondContact OD1-CD1 3.42Å; L227-L288 HydrophobicContact CD2-CB 4.34Å; L227-L288 HydrophobicContact CD2-CD2 4.49Å; L284-L288 VanDerWaalsContact O-CB 3.32Å; L284-L288 WeakPolarHBondContact O-CB 3.5Å; L284-L288 VanDerWaalsContact O-CG 3.3Å; L284-L288 WeakPolarHBondContact O-CG 3.35Å; L284-L288 PolarHBondContact O-N 3.22Å; I286-L288 VanDerWaalsContact C-N 3.33Å; I286-L288 PolarHBondContact O-N 3.27Å; L288-G307 WeakPolarHBondContact O-CA 3.49Å; L288-L308 HydrophobicContact CB-CB 4.44Å; L288-L308 PolarHBondContact O-N 3.47Å; L288-L308 VanDerWaalsContact O-N 3.12Å
289	S	96.7	Very high	91.7	Very high	0 Å²	0	40 Å²	40	0%	0	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.2	-13.6	175.5	-61	0	0	0	0	113.7	L285 I286 E287 L309 W391	L285-S289 PolarHBondContact O-N 3.3Å; L285-S289 PolarHBondContact O-OG 3.44Å; I286-S289 WeakPolarHBondContact O-CA 3.44Å; I286-S289 VanDerWaalsContact O-CB 3.28Å; I286-S289 WeakPolarHBondContact O-CB 3.41Å; I286-S289 PolarHBondContact O-N 2.89Å; E287-S289 PolarHBondContact O-N 3.14Å; E287-S289 VanDerWaalsContact O-N 3.14Å; S289-L309 WeakPolarHBondContact OG-CB 3.44Å; S289-L309 WeakPolarHBondContact OG-CG 3.34Å; S289-L309 PolarHBondContact OG-N 2.98Å; S289-W391 PolarHBondContact O-NE1 3.14Å
290	F	95.9	Very high	91.4	Very high	35 Å²	35	42.8 Å²	42.8	15%	0.154	25%	0.246	C	C	.	.	S	Bend	trans	-76.7	148	176.6	-76.2	-83.5	0	0	0	112.2	I286 E287 F294 L387 K390 W391	I286-F290 HydrophobicContact CG2-CE2 3.94Å; I286-F290 VanDerWaalsContact O-CD2 3.31Å; I286-F290 WeakPolarHBondContact O-CD2 3.35Å; E287-F290 PolarHBondContact O-N 2.98Å; F290-F294 HydrophobicContact CB-CB 4.35Å; F290-F294 HydrophobicContact CD1-CB 4.31Å; F290-F294 AromaticContact CD1-CD1 3.42Å; F290-F294 HydrophobicContact CD1-CD1 3.42Å; F290-F294 VanDerWaalsContact CD1-CD1 3.42Å; F290-F294 HydrophobicContact CD1-CD2 4.08Å; F290-F294 AromaticContact CD1-CE1 3.6Å; F290-F294 HydrophobicContact CD1-CE1 3.6Å; F290-F294 HydrophobicContact CD1-CE2 4.26Å; F290-F294 AromaticContact CD1-CG 3.67Å; F290-F294 HydrophobicContact CD1-CG 3.67Å; F290-F294 HydrophobicContact CD1-CZ 4.04Å; F290-F294 AromaticContact CE1-CD1 3.75Å; F290-F294 HydrophobicContact CE1-CD1 3.75Å; F290-F294 AromaticContact CE1-CE1 3.42Å; F290-F294 HydrophobicContact CE1-CE1 3.42Å; F290-F294 VanDerWaalsContact CE1-CE1 3.42Å; F290-F294 HydrophobicContact CE1-CE2 4.39Å; F290-F294 HydrophobicContact CE1-CG 4.35Å; F290-F294 AromaticContact CE1-CZ 3.79Å; F290-F294 HydrophobicContact CE1-CZ 3.79Å; F290-F294 HydrophobicContact CG-CD1 4.32Å; F290-F294 HydrophobicContact CZ-CE1 4.48Å; F290-L387 HydrophobicContact CE2-CD1 3.69Å; F290-L387 HydrophobicContact CE2-CG 4.09Å; F290-L387 HydrophobicContact CZ-CD1 4.13Å; F290-K390 HydrophobicContact CE1-CG 4.36Å; F290-K390 HydrophobicContact CZ-CB 4.28Å; F290-K390 HydrophobicContact CZ-CG 4.33Å; F290-W391 AromaticContact CD1-CD1 3.95Å; F290-W391 HydrophobicContact CE1-CB 3.91Å; F290-W391 HydrophobicContact CE1-CG 4.39Å; F290-W391 HydrophobicContact CE2-CB 4.08Å; F290-W391 HydrophobicContact CZ-CB 3.57Å; F290-W391 HydrophobicContact CZ-CG 4.32Å
291	P	93	Very high	91.2	Very high	9 Å²	9	43.9 Å²	43.9	6%	0.058	25%	0.253	C	S	.	.			trans	-55.3	144.4	163.9	-23.6	33.4	0	0	0	111.4	N293 F294 F299 E303 F304	P291-N293 PolarHBondContact O-N 3.36Å; P291-F294 HydrophobicContact CB-CB 4.32Å; P291-F294 HydrophobicContact CG-CD2 4.48Å; P291-F294 VanDerWaalsContact O-CB 3.23Å; P291-F294 WeakPolarHBondContact O-CB 3.28Å; P291-F294 PolarHBondContact O-N 3.11Å; P291-F294 VanDerWaalsContact O-N 3.08Å; P291-F299 HydrophobicContact CB-CB 3.8Å; P291-F299 HydrophobicContact CB-CD2 4.39Å; P291-F299 HydrophobicContact CB-CG 4.08Å; P291-F299 HydrophobicContact CG-CB 4.43Å; P291-F299 HydrophobicContact CG-CD2 4.11Å; P291-F299 HydrophobicContact CG-CG 4.26Å; P291-E303 HydrophobicContact CB-CB 3.94Å; P291-E303 HydrophobicContact CG-CB 4.1Å; P291-F304 HydrophobicContact CG-CD1 4.45Å; P291-F304 HydrophobicContact CG-CD2 3.88Å; P291-F304 HydrophobicContact CG-CE1 4.37Å; P291-F304 HydrophobicContact CG-CE2 3.79Å; P291-F304 HydrophobicContact CG-CG 4.22Å; P291-F304 HydrophobicContact CG-CZ 4.03Å
292	Q	86.7	Confident	90.9	Very high	172 Å²	172	43.9 Å²	43.9	80%	0.804	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	-37.6	-175.1	-69.5	-176.1	-8.2	0	0	112.8
293	N	86.2	Confident	90.7	Very high	84 Å²	84	45.9 Å²	45.9	45%	0.449	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.1	20.9	-177.2	-70.8	-26.4	0	0	0	113	P291 S295 S296 G297 S298	P291-N293 PolarHBondContact O-N 3.36Å; N293-S295 VanDerWaalsContact C-N 3.3Å; N293-S295 PolarHBondContact O-N 3.31Å; N293-S296 WeakPolarHBondContact CB-OG 3.48Å; N293-S296 PolarHBondContact O-N 3.49Å; N293-S296 PolarHBondContact O-OG 3.08Å; N293-G297 PolarHBondContact O-N 2.88Å; N293-S298 WeakPolarHBondContact CB-O 3.2Å
294	F	87.7	Confident	90.6	Very high	41 Å²	41	45.9 Å²	45.9	18%	0.18	26%	0.262	C	S	.	.	G	3₁₀ helix	trans	-55.5	-42.3	-176.4	-177.2	-106.9	0	0	0	113.2	F290 P291 S296 G297 F299 F304 K390	F290-F294 HydrophobicContact CB-CB 4.35Å; F290-F294 HydrophobicContact CD1-CB 4.31Å; F290-F294 AromaticContact CD1-CD1 3.42Å; F290-F294 HydrophobicContact CD1-CD1 3.42Å; F290-F294 VanDerWaalsContact CD1-CD1 3.42Å; F290-F294 HydrophobicContact CD1-CD2 4.08Å; F290-F294 AromaticContact CD1-CE1 3.6Å; F290-F294 HydrophobicContact CD1-CE1 3.6Å; F290-F294 HydrophobicContact CD1-CE2 4.26Å; F290-F294 AromaticContact CD1-CG 3.67Å; F290-F294 HydrophobicContact CD1-CG 3.67Å; F290-F294 HydrophobicContact CD1-CZ 4.04Å; F290-F294 AromaticContact CE1-CD1 3.75Å; F290-F294 HydrophobicContact CE1-CD1 3.75Å; F290-F294 AromaticContact CE1-CE1 3.42Å; F290-F294 HydrophobicContact CE1-CE1 3.42Å; F290-F294 VanDerWaalsContact CE1-CE1 3.42Å; F290-F294 HydrophobicContact CE1-CE2 4.39Å; F290-F294 HydrophobicContact CE1-CG 4.35Å; F290-F294 AromaticContact CE1-CZ 3.79Å; F290-F294 HydrophobicContact CE1-CZ 3.79Å; F290-F294 HydrophobicContact CG-CD1 4.32Å; F290-F294 HydrophobicContact CZ-CE1 4.48Å; P291-F294 HydrophobicContact CB-CB 4.32Å; P291-F294 HydrophobicContact CG-CD2 4.48Å; P291-F294 VanDerWaalsContact O-CB 3.23Å; P291-F294 WeakPolarHBondContact O-CB 3.28Å; P291-F294 PolarHBondContact O-N 3.11Å; P291-F294 VanDerWaalsContact O-N 3.08Å; F294-S296 VanDerWaalsContact C-N 3.26Å; F294-S296 PolarHBondContact O-N 3.01Å; F294-G297 PolarHBondContact O-N 2.73Å; F294-F299 HydrophobicContact CB-CD1 4.49Å; F294-F299 HydrophobicContact CD2-CD1 4.1Å; F294-F299 AromaticContact CD2-CE1 3.51Å; F294-F299 HydrophobicContact CD2-CE1 3.51Å; F294-F299 HydrophobicContact CD2-CE2 4.39Å; F294-F299 AromaticContact CD2-CZ 3.69Å; F294-F299 HydrophobicContact CD2-CZ 3.69Å; F294-F299 HydrophobicContact CE2-CE1 4.03Å; F294-F299 AromaticContact CE2-CZ 3.86Å; F294-F299 HydrophobicContact CE2-CZ 3.86Å; F294-F299 HydrophobicContact CG-CE1 4.35Å; F294-F304 HydrophobicContact CD2-CZ 4.08Å; F294-F304 AromaticContact CE2-CZ 3.85Å; F294-F304 HydrophobicContact CE2-CZ 3.85Å; F294-K390 HydrophobicContact CE1-CD 4.26Å; F294-K390 HydrophobicContact CE1-CG 4.18Å; F294-K390 HydrophobicContact CZ-CG 4.42Å
295	S	84.3	Confident	90.4	Very high	124 Å²	124	45.9 Å²	45.9	87%	0.867	26%	0.262	S	S	*	.	G	3₁₀ helix	trans	-64.4	-27.6	178.4	52.5	0	0	0	0	113.8	N293	N293-S295 VanDerWaalsContact C-N 3.3Å; N293-S295 PolarHBondContact O-N 3.31Å
296	S	83.6	Confident	90.1	Very high	77 Å²	77	46 Å²	46	54%	0.538	26%	0.264	S	S	.	.	G	3₁₀ helix	trans	-85.3	-11.3	178.2	73.7	0	0	0	0	113.6	N293 F294 S298	N293-S296 WeakPolarHBondContact CB-OG 3.48Å; N293-S296 PolarHBondContact O-N 3.49Å; N293-S296 PolarHBondContact O-OG 3.08Å; F294-S296 VanDerWaalsContact C-N 3.26Å; F294-S296 PolarHBondContact O-N 3.01Å; S296-S298 PolarHBondContact O-N 3.43Å; S296-S298 PolarHBondContact OG-N 3.41Å
297	G	81.8	Confident	89.9	Confident	54 Å²	54	46.2 Å²	46.2	56%	0.557	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.1	-6.4	-171.4	0	0	0	0	0	114.8	N293 F294 F299	N293-G297 PolarHBondContact O-N 2.88Å; F294-G297 PolarHBondContact O-N 2.73Å; G297-F299 PolarHBondContact O-N 3.15Å
298	S	86	Confident	89.9	Confident	84 Å²	84	43.5 Å²	43.5	59%	0.587	25%	0.253	S	S	*	.			trans	-91.2	71.5	-178.9	179.3	0	0	0	0	111.7	N293 S296	N293-S298 WeakPolarHBondContact CB-O 3.2Å; S296-S298 PolarHBondContact O-N 3.43Å; S296-S298 PolarHBondContact OG-N 3.41Å
299	F	87.1	Confident	89.9	Confident	46 Å²	46	41.5 Å²	41.5	20%	0.202	24%	0.242	C	C	.	.			trans	-138.3	156.8	176.6	60	-91.5	0	0	0	111.1	P291 F294 G297 F304 A398	P291-F299 HydrophobicContact CB-CB 3.8Å; P291-F299 HydrophobicContact CB-CD2 4.39Å; P291-F299 HydrophobicContact CB-CG 4.08Å; P291-F299 HydrophobicContact CG-CB 4.43Å; P291-F299 HydrophobicContact CG-CD2 4.11Å; P291-F299 HydrophobicContact CG-CG 4.26Å; F294-F299 HydrophobicContact CB-CD1 4.49Å; F294-F299 HydrophobicContact CD2-CD1 4.1Å; F294-F299 AromaticContact CD2-CE1 3.51Å; F294-F299 HydrophobicContact CD2-CE1 3.51Å; F294-F299 HydrophobicContact CD2-CE2 4.39Å; F294-F299 AromaticContact CD2-CZ 3.69Å; F294-F299 HydrophobicContact CD2-CZ 3.69Å; F294-F299 HydrophobicContact CE2-CE1 4.03Å; F294-F299 AromaticContact CE2-CZ 3.86Å; F294-F299 HydrophobicContact CE2-CZ 3.86Å; F294-F299 HydrophobicContact CG-CE1 4.35Å; G297-F299 PolarHBondContact O-N 3.15Å; F299-F304 HydrophobicContact CD2-CE2 4.14Å; F299-F304 AromaticContact CE2-CE2 3.66Å; F299-F304 HydrophobicContact CE2-CE2 3.66Å; F299-F304 HydrophobicContact CE2-CZ 4.43Å; F299-F304 HydrophobicContact CZ-CE2 4.39Å; F299-A398 HydrophobicContact CE2-CB 3.91Å
300	R	86.6	Confident	89.9	Confident	72 Å²	72	41.5 Å²	41.5	27%	0.272	24%	0.242	S	C	.	.			trans	-89.3	148.7	171.9	-50.3	-166.8	-36.4	-153.3	-2.1	111.8	K250 D302 E303	K250-R300 PolarHBondContact O-NH1 3.32Å; K250-R300 VanDerWaalsContact O-NH1 3.12Å; K250-R300 PolarHBondContact O-NH2 3.44Å; R300-D302 VanDerWaalsContact C-N 3.29Å; R300-D302 WeakPolarHBondContact CB-OD1 3.46Å; R300-D302 IonicContact CZ-OD1 3.21Å; R300-D302 VanDerWaalsContact CZ-OD1 3.26Å; R300-D302 IonicContact CZ-OD2 3.74Å; R300-D302 IonicContact NE-OD1 2.75Å; R300-D302 PolarHBondContact NE-OD1 3.11Å; R300-D302 IonicContact NE-OD2 3.59Å; R300-D302 IonicContact NH2-OD1 2.67Å; R300-D302 PolarHBondContact NH2-OD1 3.13Å; R300-D302 IonicContact NH2-OD2 2.95Å; R300-D302 PolarHBondContact NH2-OD2 3.46Å; R300-D302 PolarHBondContact O-N 2.89Å; R300-E303 HydrophobicContact CB-CG 4.16Å; R300-E303 PolarHBondContact N-OE1 3.46Å; R300-E303 VanDerWaalsContact O-CB 3.3Å; R300-E303 WeakPolarHBondContact O-CB 3.38Å; R300-E303 PolarHBondContact O-N 2.82Å
301	P	88.2	Confident	89.8	Confident	22 Å²	22	40.7 Å²	40.7	14%	0.143	24%	0.238	C	C	.	.	G	3₁₀ helix	trans	-58.7	-34.5	179	-26.6	35.2	0	0	0	114.9	E303 F304 A398 T422 L423	P301-E303 PolarHBondContact O-N 3.05Å; P301-F304 PolarHBondContact O-N 2.75Å; P301-A398 HydrophobicContact CB-CB 3.9Å; P301-A398 WeakPolarHBondContact CB-O 3.21Å; P301-A398 HydrophobicContact CG-CB 4.16Å; P301-A398 WeakPolarHBondContact CG-O 3.45Å; P301-T422 WeakPolarHBondContact CB-O 3.45Å; P301-T422 VanDerWaalsContact CD-O 3.28Å; P301-T422 WeakPolarHBondContact CD-O 3.42Å; P301-L423 HydrophobicContact CB-CD2 4.27Å; P301-L423 HydrophobicContact CG-CD2 4.12Å
302	D	88.4	Confident	89.9	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	24%	0.236	C	C	.	.	G	3₁₀ helix	trans	-71	-13.4	177.1	75.8	-58.8	0	0	0	113.8	R300 F304 E305 T422	R300-D302 VanDerWaalsContact C-N 3.29Å; R300-D302 WeakPolarHBondContact CB-OD1 3.46Å; R300-D302 IonicContact CZ-OD1 3.21Å; R300-D302 VanDerWaalsContact CZ-OD1 3.26Å; R300-D302 IonicContact CZ-OD2 3.74Å; R300-D302 IonicContact NE-OD1 2.75Å; R300-D302 PolarHBondContact NE-OD1 3.11Å; R300-D302 IonicContact NE-OD2 3.59Å; R300-D302 IonicContact NH2-OD1 2.67Å; R300-D302 PolarHBondContact NH2-OD1 3.13Å; R300-D302 IonicContact NH2-OD2 2.95Å; R300-D302 PolarHBondContact NH2-OD2 3.46Å; R300-D302 PolarHBondContact O-N 2.89Å; D302-F304 PolarHBondContact O-N 2.8Å; D302-E305 VanDerWaalsContact O-CB 3.26Å; D302-E305 WeakPolarHBondContact O-CB 3.42Å; D302-E305 WeakPolarHBondContact O-CG 3.29Å; D302-E305 PolarHBondContact O-N 2.66Å; D302-T422 PolarHBondContact N-O 3.42Å
303	E	92.2	Very high	90.3	Very high	42 Å²	42	32.2 Å²	32.2	20%	0.196	20%	0.198	C	C	.	.	G	3₁₀ helix	trans	-65.3	-21.6	175.8	-69.8	176.5	-144.9	0	0	113	P291 R300 P301 E305 G306	P291-E303 HydrophobicContact CB-CB 3.94Å; P291-E303 HydrophobicContact CG-CB 4.1Å; R300-E303 HydrophobicContact CB-CG 4.16Å; R300-E303 PolarHBondContact N-OE1 3.46Å; R300-E303 VanDerWaalsContact O-CB 3.3Å; R300-E303 WeakPolarHBondContact O-CB 3.38Å; R300-E303 PolarHBondContact O-N 2.82Å; P301-E303 PolarHBondContact O-N 3.05Å; E303-E305 PolarHBondContact O-N 3.19Å; E303-G306 PolarHBondContact O-N 3.24Å
304	F	94.5	Very high	90.7	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	18%	0.178	C	C	.	.	G	3₁₀ helix	trans	-60.4	-28.1	172	-84	-87.1	0	0	0	112.7	P291 F294 F299 P301 D302 G306 G310 W391 C395 A398 F428	P291-F304 HydrophobicContact CG-CD1 4.45Å; P291-F304 HydrophobicContact CG-CD2 3.88Å; P291-F304 HydrophobicContact CG-CE1 4.37Å; P291-F304 HydrophobicContact CG-CE2 3.79Å; P291-F304 HydrophobicContact CG-CG 4.22Å; P291-F304 HydrophobicContact CG-CZ 4.03Å; F294-F304 HydrophobicContact CD2-CZ 4.08Å; F294-F304 AromaticContact CE2-CZ 3.85Å; F294-F304 HydrophobicContact CE2-CZ 3.85Å; F299-F304 HydrophobicContact CD2-CE2 4.14Å; F299-F304 AromaticContact CE2-CE2 3.66Å; F299-F304 HydrophobicContact CE2-CE2 3.66Å; F299-F304 HydrophobicContact CE2-CZ 4.43Å; F299-F304 HydrophobicContact CZ-CE2 4.39Å; P301-F304 PolarHBondContact O-N 2.75Å; D302-F304 PolarHBondContact O-N 2.8Å; F304-G306 PolarHBondContact O-N 3.13Å; F304-G310 VanDerWaalsContact O-CA 3.25Å; F304-G310 WeakPolarHBondContact O-CA 3.25Å; F304-W391 AromaticContact CD1-CE2 3.92Å; F304-W391 HydrophobicContact CD1-CZ2 4.28Å; F304-W391 AromaticContact CD1-NE1 3.51Å; F304-W391 AromaticContact CE1-CD1 3.88Å; F304-W391 HydrophobicContact CE1-CG 4.49Å; F304-W391 AromaticContact CE1-NE1 3.79Å; F304-C395 HydrophobicContact CD1-CB 3.77Å; F304-C395 HydrophobicContact CE1-CB 3.92Å; F304-C395 HydrophobicContact CG-CB 4.15Å; F304-C395 HydrophobicContact CZ-CB 4.43Å; F304-A398 HydrophobicContact CD2-CB 4.25Å; F304-A398 HydrophobicContact CE2-CB 3.87Å; F304-F428 HydrophobicContact CB-CZ 4.4Å
305	E	93.5	Very high	90.9	Very high	1 Å²	1	26.6 Å²	26.6	1%	0.005	17%	0.17	C	C	.	.	G	3₁₀ helix	trans	-71	-23.8	175.6	-58.4	-173.5	152	0	0	112.3	V253 R258 D302 E303 G310 R311 V314 A424 G425 F428	V253-E305 HydrophobicContact CG2-CB 3.85Å; V253-E305 WeakPolarHBondContact CG2-O 3.27Å; R258-E305 IonicContact CZ-OE1 3.7Å; R258-E305 IonicContact CZ-OE2 2.94Å; R258-E305 VanDerWaalsContact NH1-CD 3.29Å; R258-E305 IonicContact NH1-OE1 3.44Å; R258-E305 PolarHBondContact NH1-OE1 3.37Å; R258-E305 IonicContact NH1-OE2 3.73Å; R258-E305 PolarHBondContact NH1-OE2 2.99Å; R258-E305 IonicContact NH2-OE1 3.04Å; R258-E305 IonicContact NH2-OE2 2.79Å; R258-E305 PolarHBondContact NH2-OE2 3.13Å; D302-E305 VanDerWaalsContact O-CB 3.26Å; D302-E305 WeakPolarHBondContact O-CB 3.42Å; D302-E305 WeakPolarHBondContact O-CG 3.29Å; D302-E305 PolarHBondContact O-N 2.66Å; E303-E305 PolarHBondContact O-N 3.19Å; E305-G310 CarbonylContact O-C 3.49Å; E305-G310 VanDerWaalsContact O-C 3.3Å; E305-R311 WeakPolarHBondContact O-CG 3.43Å; E305-R311 PolarHBondContact O-N 3.3Å; E305-V314 HydrophobicContact CB-CG1 3.67Å; E305-V314 HydrophobicContact CG-CG1 3.97Å; E305-A424 HydrophobicContact CG-CB 4.22Å; E305-G425 PolarHBondContact OE1-N 3.34Å; E305-F428 HydrophobicContact CG-CB 4.23Å; E305-F428 HydrophobicContact CG-CD1 4.06Å; E305-F428 HydrophobicContact CG-CD2 4.2Å; E305-F428 HydrophobicContact CG-CG 3.88Å; E305-F428 WeakPolarHBondContact OE1-CB 3.26Å
306	G	90.8	Very high	91.3	Very high	3 Å²	3	20.9 Å²	20.9	3%	0.031	13%	0.13	C	C	.	.	G	3₁₀ helix	trans	-76.8	-20.9	-178	0	0	0	0	0	115.5	L252 E303 F304 R311	L252-G306 VanDerWaalsContact CD2-CA 3.42Å; E303-G306 PolarHBondContact O-N 3.24Å; F304-G306 PolarHBondContact O-N 3.13Å; G306-R311 PolarHBondContact O-NE 2.89Å
307	G	92.9	Very high	91.7	Very high	4 Å²	4	17.6 Å²	17.6	4%	0.041	11%	0.106	C	C	.	.	S	Bend	trans	-71.9	169.5	177.5	0	0	0	0	0	112.7	L288 G310 R311	L288-G307 WeakPolarHBondContact O-CA 3.49Å; G307-G310 WeakPolarHBondContact O-CA 3.3Å; G307-G310 PolarHBondContact O-N 3.45Å; G307-R311 WeakPolarHBondContact O-CG 3.31Å; G307-R311 PolarHBondContact O-N 3.02Å
308	L	95.7	Very high	92.2	Very high	0 Å²	0	15.5 Å²	15.5	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-60.1	-54.1	-176.9	-170.3	154.1	0	0	0	112.7	V223 L226 L227 L230 T272 L285 L288 G310 R311 L312	V223-L308 HydrophobicContact CG1-CD1 3.75Å; L226-L308 HydrophobicContact CD2-CD1 4.05Å; L226-L308 HydrophobicContact CG-CD1 4.28Å; L227-L308 HydrophobicContact CB-CD1 4.31Å; L227-L308 HydrophobicContact CD1-CB 4.1Å; L230-L308 HydrophobicContact CD1-CD2 4.48Å; L230-L308 HydrophobicContact CD1-CG 4.01Å; T272-L308 HydrophobicContact CG2-CD2 3.89Å; L285-L308 HydrophobicContact CD2-CD1 3.56Å; L285-L308 HydrophobicContact CD2-CD2 3.61Å; L285-L308 HydrophobicContact CD2-CG 4.25Å; L288-L308 HydrophobicContact CB-CB 4.44Å; L288-L308 PolarHBondContact O-N 3.47Å; L288-L308 VanDerWaalsContact O-N 3.12Å; L308-G310 VanDerWaalsContact C-N 3.26Å; L308-G310 PolarHBondContact O-N 3.47Å; L308-R311 PolarHBondContact O-N 2.75Å; L308-L312 HydrophobicContact CD2-CD1 4.05Å; L308-L312 PolarHBondContact O-N 3.33Å
309	L	97	Very high	92.1	Very high	1 Å²	1	13.7 Å²	13.7	1%	0.005	7%	0.065	C	C	.	.	H	α-helix	trans	-64	-35.3	175.7	-65.4	174.2	0	0	0	111.2	I286 S289 L312 L313 L370 F371 L374 L388 W391	I286-L309 HydrophobicContact CG1-CD1 4.42Å; S289-L309 WeakPolarHBondContact OG-CB 3.44Å; S289-L309 WeakPolarHBondContact OG-CG 3.34Å; S289-L309 PolarHBondContact OG-N 2.98Å; L309-L312 PolarHBondContact O-N 3.08Å; L309-L313 WeakPolarHBondContact O-CG 3.16Å; L309-L313 PolarHBondContact O-N 2.95Å; L309-L313 VanDerWaalsContact O-N 3.14Å; L309-L370 HydrophobicContact CD2-CD2 3.96Å; L309-F371 HydrophobicContact CB-CZ 4.36Å; L309-F371 HydrophobicContact CD1-CE1 4.02Å; L309-F371 HydrophobicContact CD1-CZ 4.35Å; L309-F371 HydrophobicContact CD2-CE1 4.25Å; L309-F371 HydrophobicContact CD2-CZ 4.03Å; L309-F371 HydrophobicContact CG-CZ 4.47Å; L309-L374 HydrophobicContact CD1-CD1 4.36Å; L309-L374 HydrophobicContact CD2-CD1 4.26Å; L309-L388 HydrophobicContact CD1-CD1 4.45Å; L309-W391 HydrophobicContact CB-CH2 4Å; L309-W391 HydrophobicContact CB-CZ2 4.03Å; L309-W391 HydrophobicContact CB-CZ3 4.47Å; L309-W391 HydrophobicContact CD1-CD2 4.49Å; L309-W391 HydrophobicContact CD1-CE3 4.32Å; L309-W391 HydrophobicContact CD1-CZ3 4.44Å
310	G	95.4	Very high	91.8	Very high	0 Å²	0	14.9 Å²	14.9	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-53.3	-53.7	172.2	0	0	0	0	0	112.7	F304 E305 G307 L308 L312 L313 V314	F304-G310 VanDerWaalsContact O-CA 3.25Å; F304-G310 WeakPolarHBondContact O-CA 3.25Å; E305-G310 CarbonylContact O-C 3.49Å; E305-G310 VanDerWaalsContact O-C 3.3Å; G307-G310 WeakPolarHBondContact O-CA 3.3Å; G307-G310 PolarHBondContact O-N 3.45Å; L308-G310 VanDerWaalsContact C-N 3.26Å; L308-G310 PolarHBondContact O-N 3.47Å; G310-L312 PolarHBondContact O-N 2.95Å; G310-L313 CarbonylContact O-C 3.56Å; G310-L313 WeakPolarHBondContact O-CA 3.2Å; G310-L313 PolarHBondContact O-N 3.05Å; G310-V314 WeakPolarHBondContact O-CG1 3.39Å; G310-V314 PolarHBondContact O-N 3.28Å
311	R	93.5	Very high	91.4	Very high	19 Å²	19	12.7 Å²	12.7	7%	0.072	7%	0.074	C	C	.	.	H	α-helix	trans	-65.9	-22.5	-178.5	-75.3	-176.6	165.9	-95.9	-1.5	114.4	L230 E257 E305 G306 G307 L308 V314	L230-R311 HydrophobicContact CB-CB 4.24Å; L230-R311 PolarHBondContact O-NH1 2.61Å; E257-R311 IonicContact OE1-CZ 2.78Å; E257-R311 VanDerWaalsContact OE1-CZ 3.29Å; E257-R311 IonicContact OE1-NH1 3.37Å; E257-R311 PolarHBondContact OE1-NH1 2.68Å; E257-R311 IonicContact OE1-NH2 3.45Å; E257-R311 PolarHBondContact OE1-NH2 3.49Å; E257-R311 IonicContact OE2-NH1 3.6Å; E257-R311 IonicContact OE2-NH2 2.65Å; E305-R311 WeakPolarHBondContact O-CG 3.43Å; E305-R311 PolarHBondContact O-N 3.3Å; G306-R311 PolarHBondContact O-NE 2.89Å; G307-R311 WeakPolarHBondContact O-CG 3.31Å; G307-R311 PolarHBondContact O-N 3.02Å; L308-R311 PolarHBondContact O-N 2.75Å; R311-V314 VanDerWaalsContact O-CG2 3.29Å; R311-V314 WeakPolarHBondContact O-CG2 3.19Å
312	L	95.2	Very high	90.9	Very high	3 Å²	3	13.3 Å²	13.3	2%	0.016	8%	0.075	C	C	.	.	H	α-helix	trans	-78.9	-30.6	171.1	-65	173.3	0	0	0	111.8	L230 L269 T272 L308 L309 G310 L367 L370	L230-L312 HydrophobicContact CD1-CD2 4.13Å; L230-L312 HydrophobicContact CD1-CG 4.25Å; L230-L312 HydrophobicContact CD2-CD2 3.67Å; L269-L312 HydrophobicContact CB-CD2 4.16Å; L269-L312 HydrophobicContact CD1-CD1 4.07Å; L269-L312 HydrophobicContact CD1-CD2 4.14Å; T272-L312 HydrophobicContact CG2-CD1 3.72Å; L308-L312 HydrophobicContact CD2-CD1 4.05Å; L308-L312 PolarHBondContact O-N 3.33Å; L309-L312 PolarHBondContact O-N 3.08Å; G310-L312 PolarHBondContact O-N 2.95Å; L312-L367 HydrophobicContact CB-CD2 4.22Å; L312-L370 HydrophobicContact CD1-CD2 3.78Å
313	L	96.2	Very high	90.4	Very high	0 Å²	0	15 Å²	15	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-86.7	-18	-178.5	-72.4	167.4	0	0	0	114.2	L309 G310 S315 L367 F371 W391 F428 N431 F432 V435	L309-L313 WeakPolarHBondContact O-CG 3.16Å; L309-L313 PolarHBondContact O-N 2.95Å; L309-L313 VanDerWaalsContact O-N 3.14Å; G310-L313 CarbonylContact O-C 3.56Å; G310-L313 WeakPolarHBondContact O-CA 3.2Å; G310-L313 PolarHBondContact O-N 3.05Å; L313-S315 VanDerWaalsContact C-N 3.29Å; L313-S315 PolarHBondContact O-N 3.45Å; L313-L367 HydrophobicContact CD2-CD1 3.87Å; L313-L367 HydrophobicContact CD2-CD2 4.21Å; L313-F371 HydrophobicContact CD1-CE2 4.41Å; L313-F371 HydrophobicContact CD1-CZ 4.07Å; L313-F371 HydrophobicContact CD2-CE2 4.33Å; L313-W391 HydrophobicContact CD1-CH2 3.83Å; L313-W391 HydrophobicContact CD1-CZ3 4.44Å; L313-F428 HydrophobicContact CB-CD2 3.48Å; L313-F428 VanDerWaalsContact CB-CD2 3.48Å; L313-F428 HydrophobicContact CB-CE2 3.65Å; L313-F428 HydrophobicContact CD1-CD2 4.44Å; L313-F428 HydrophobicContact CD1-CE2 3.79Å; L313-F428 HydrophobicContact CG-CE2 4.39Å; L313-F428 WeakPolarHBondContact O-CA 3.46Å; L313-N431 HydrophobicContact CD2-CB 3.97Å; L313-N431 PolarHBondContact O-ND2 3.35Å; L313-F432 HydrophobicContact CD1-CD2 4.18Å; L313-V435 HydrophobicContact CD2-CG2 4.13Å
314	V	93.6	Very high	89.7	Confident	3 Å²	3	15 Å²	15	2%	0.018	10%	0.096	C	C	.	.			trans	-71.4	-15.9	-177.5	-70.7	0	0	0	0	115.4	V253 R258 E305 G310 R311 S316 F428	V253-V314 HydrophobicContact CG1-CB 4.37Å; V253-V314 HydrophobicContact CG1-CG1 4.24Å; V253-V314 HydrophobicContact CG1-CG2 4.15Å; R258-V314 HydrophobicContact CG-CB 4.37Å; E305-V314 HydrophobicContact CB-CG1 3.67Å; E305-V314 HydrophobicContact CG-CG1 3.97Å; G310-V314 WeakPolarHBondContact O-CG1 3.39Å; G310-V314 PolarHBondContact O-N 3.28Å; R311-V314 VanDerWaalsContact O-CG2 3.29Å; R311-V314 WeakPolarHBondContact O-CG2 3.19Å; V314-S316 PolarHBondContact O-N 2.83Å; V314-S316 VanDerWaalsContact O-N 3.17Å; V314-F428 HydrophobicContact CG1-CB 4.21Å; V314-F428 HydrophobicContact CG1-CD2 4.24Å
315	S	92.4	Very high	88.8	Confident	3 Å²	3	21 Å²	21	2%	0.021	12%	0.124	C	C	.	.			trans	-63.1	111.3	-176.5	178.9	0	0	0	0	111.6	R258 L260 R265 L313 N431	R258-S315 WeakPolarHBondContact O-CA 3.33Å; L260-S315 PolarHBondContact O-OG 3.46Å; R265-S315 PolarHBondContact NH1-OG 3.43Å; L313-S315 VanDerWaalsContact C-N 3.29Å; L313-S315 PolarHBondContact O-N 3.45Å; S315-N431 PolarHBondContact O-ND2 3.47Å
316	S	92.6	Very high	87.9	Confident	5 Å²	5	22.6 Å²	22.6	4%	0.035	13%	0.134	C	C	.	.			trans	-163.4	153.4	-177.4	-171.5	0	0	0	0	112.3	R258 V314 L318 G427	R258-S316 PolarHBondContact O-N 2.73Å; V314-S316 PolarHBondContact O-N 2.83Å; V314-S316 VanDerWaalsContact O-N 3.17Å; S316-L318 VanDerWaalsContact C-N 3.27Å; S316-L318 WeakPolarHBondContact OG-CB 3.2Å; S316-L318 PolarHBondContact OG-N 3.13Å; S316-L318 VanDerWaalsContact OG-N 3.14Å; S316-G427 VanDerWaalsContact OG-CA 3.31Å; S316-G427 WeakPolarHBondContact OG-CA 3.41Å
317	H	92	Very high	87.2	Confident	7 Å²	7	22.4 Å²	22.4	3%	0.032	13%	0.132	C	C	.	.	S	Bend	trans	-77.6	-11.3	168.6	64.9	-69.7	0	0	0	113	L260 H319 F338 I356 E570	L260-H317 HydrophobicContact CD2-CB 4.28Å; H317-H319 PolarHBondContact O-CE1 3.25Å; H317-H319 PolarHBondContact O-ND1 3.15Å; H317-F338 HydrophobicContact CB-CD2 3.9Å; H317-F338 HydrophobicContact CB-CE2 4.29Å; H317-I356 HydrophobicContact CB-CD1 4.24Å; H317-I356 HydrophobicContact CB-CG1 4.43Å; H317-I356 HydrophobicContact CB-CG2 4.49Å; H317-I356 WeakPolarHBondContact ND1-CG2 3.44Å; H317-E570 PolarHBondContact CD2-O 3.03Å; H317-E570 PolarHBondContact NE2-O 2.92Å; H317-E570 WeakPolarHBondContact O-CG 3.29Å
318	L	91.4	Very high	86.5	Confident	11 Å²	11	27.8 Å²	27.8	6%	0.058	16%	0.155	C	C	.	.			trans	-76.1	126.3	-178.1	-69	174	0	0	0	112.3	S316 D426 L523 E570 Q571	S316-L318 VanDerWaalsContact C-N 3.27Å; S316-L318 WeakPolarHBondContact OG-CB 3.2Å; S316-L318 PolarHBondContact OG-N 3.13Å; S316-L318 VanDerWaalsContact OG-N 3.14Å; L318-D426 HydrophobicContact CB-CB 4.35Å; L318-D426 HydrophobicContact CD1-CB 3.88Å; L318-L523 HydrophobicContact CD1-CD1 4.42Å; L318-L523 HydrophobicContact CD1-CD2 3.95Å; L318-E570 HydrophobicContact CD2-CB 4.13Å; L318-E570 WeakPolarHBondContact CD2-O 3.46Å; L318-Q571 HydrophobicContact CD2-CG 4.3Å
319	H	85.1	Confident	85.6	Confident	45 Å²	45	33.5 Å²	33.5	21%	0.208	19%	0.185	C	C	.	.			trans	-115.5	149.8	172.2	-61.2	80.6	0	0	0	112	H317 R567 E570	H317-H319 PolarHBondContact O-CE1 3.25Å; H317-H319 PolarHBondContact O-ND1 3.15Å; H319-R567 WeakPolarHBondContact O-CD 3.43Å; H319-E570 IonicContact CG-OE2 3.64Å; H319-E570 PolarHBondContact N-OE2 3.48Å; H319-E570 IonicContact ND1-OE1 3.19Å; H319-E570 PolarHBondContact ND1-OE1 3.29Å; H319-E570 IonicContact ND1-OE2 2.98Å; H319-E570 PolarHBondContact ND1-OE2 2.98Å
320	S	80.1	Confident	84.6	Confident	72 Å²	72	34.6 Å²	34.6	50%	0.503	19%	0.191	S	C	.	.	P	Polyproline II helix	trans	-66.8	133.3	171.9	-171.6	0	0	0	0	109.9	Q322	S320-Q322 PolarHBondContact O-N 3.24Å
321	P	78.9	Confident	83.7	Confident	26 Å²	26	39.6 Å²	39.6	17%	0.169	22%	0.218	C	C	.	.	P	Polyproline II helix	trans	-61	135.2	173	-14.5	25.4	0	0	0	110.5	R526 R564 R567	P321-R526 VanDerWaalsContact CD-NH1 3.29Å; P321-R564 VanDerWaalsContact CB-NH1 3.3Å; P321-R567 HydrophobicContact CB-CG 4.38Å
322	Q	77.4	Confident	82.6	Confident	35 Å²	35	42.9 Å²	42.9	16%	0.164	23%	0.234	C	C	.	.	P	Polyproline II helix	trans	-80.7	153.5	178.6	-65.1	-162.5	-19.3	0	0	112.9	S320 I327 E563 R564	S320-Q322 PolarHBondContact O-N 3.24Å; Q322-I327 HydrophobicContact CB-CD1 4.09Å; Q322-I327 HydrophobicContact CB-CG1 4.03Å; Q322-E563 PolarHBondContact N-OE1 3.11Å; Q322-E563 VanDerWaalsContact N-OE1 3.12Å; Q322-R564 PolarHBondContact O-NH2 3.06Å
323	A	77.3	Confident	81.2	Confident	35 Å²	35	43.7 Å²	43.7	29%	0.289	24%	0.241	S	C	.	.	P	Polyproline II helix	trans	-68.2	145.1	170.4	0	0	0	0	0	110.3	E325 T326 I327	A323-E325 PolarHBondContact O-N 2.83Å; A323-T326 WeakPolarHBondContact O-CB 3.37Å; A323-T326 PolarHBondContact O-N 3.22Å; A323-I327 PolarHBondContact O-N 2.96Å
324	A	77.4	Confident	79.8	Confident	42 Å²	42	45.3 Å²	45.3	35%	0.347	25%	0.252	S	S	.	.	H	α-helix	trans	-53.9	-40.7	177.2	0	0	0	0	0	111.9	T326 I327 F328 F556 F560	A324-T326 VanDerWaalsContact C-N 3.32Å; A324-T326 PolarHBondContact O-N 3.24Å; A324-I327 PolarHBondContact O-N 3.06Å; A324-F328 WeakPolarHBondContact O-CB 3.42Å; A324-F328 PolarHBondContact O-N 3.33Å; A324-F556 HydrophobicContact CB-CZ 4.13Å; A324-F556 WeakPolarHBondContact O-CE2 3.19Å; A324-F560 HydrophobicContact CB-CE1 4.25Å; A324-F560 HydrophobicContact CB-CZ 4.17Å
325	E	75.6	Confident	78.5	Confident	126 Å²	126	47.3 Å²	47.3	59%	0.589	26%	0.262	S	S	*	.	H	α-helix	trans	-58.9	-40.7	176.8	-62.7	171.3	-173	0	0	112.2	A323 F328 L329	A323-E325 PolarHBondContact O-N 2.83Å; E325-F328 PolarHBondContact O-N 3.49Å; E325-L329 WeakPolarHBondContact O-CB 3.27Å; E325-L329 VanDerWaalsContact O-CG 3.27Å; E325-L329 WeakPolarHBondContact O-CG 3.38Å; E325-L329 PolarHBondContact O-N 3.19Å
326	T	74.5	Confident	77.7	Confident	34 Å²	34	47.8 Å²	47.8	21%	0.209	27%	0.268	C	S	.	.	H	α-helix	trans	-65.4	-46.3	179.4	-51.3	0	0	0	0	111.1	A323 A324 F328 L329 T330	A323-T326 WeakPolarHBondContact O-CB 3.37Å; A323-T326 PolarHBondContact O-N 3.22Å; A324-T326 VanDerWaalsContact C-N 3.32Å; A324-T326 PolarHBondContact O-N 3.24Å; T326-F328 VanDerWaalsContact C-N 3.28Å; T326-F328 PolarHBondContact O-N 3.04Å; T326-L329 PolarHBondContact O-N 3.28Å; T326-T330 HydrophobicContact CG2-CG2 4.24Å; T326-T330 WeakPolarHBondContact O-CG2 3.34Å; T326-T330 PolarHBondContact O-N 2.93Å; T326-T330 PolarHBondContact O-OG1 3.44Å; T326-T330 VanDerWaalsContact O-OG1 3.07Å
327	I	76.6	Confident	77.1	Confident	0 Å²	0	50 Å²	50	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-64.6	-37.6	179.7	-64	168.9	0	0	0	110.8	Q322 A323 A324 T330 N331 F556 R559 F560 E563	Q322-I327 HydrophobicContact CB-CD1 4.09Å; Q322-I327 HydrophobicContact CB-CG1 4.03Å; A323-I327 PolarHBondContact O-N 2.96Å; A324-I327 PolarHBondContact O-N 3.06Å; I327-T330 PolarHBondContact O-OG1 2.99Å; I327-N331 PolarHBondContact O-N 2.99Å; I327-F556 HydrophobicContact CB-CE2 4.29Å; I327-F556 HydrophobicContact CG2-CD2 4.45Å; I327-F556 HydrophobicContact CG2-CE2 4.17Å; I327-R559 HydrophobicContact CG2-CB 4.33Å; I327-F560 HydrophobicContact CD1-CD2 3.45Å; I327-F560 VanDerWaalsContact CD1-CD2 3.45Å; I327-F560 HydrophobicContact CD1-CE2 3.94Å; I327-F560 HydrophobicContact CD1-CG 4.46Å; I327-E563 HydrophobicContact CD1-CB 4.02Å; I327-E563 HydrophobicContact CD1-CG 3.98Å
328	F	77.9	Confident	76.9	Confident	117 Å²	117	50.7 Å²	50.7	51%	0.513	28%	0.28	S	S	.	.	H	α-helix	trans	-62	-47.7	175.7	-175.5	-98.4	0	0	0	111.3	A324 E325 T326 F556	A324-F328 WeakPolarHBondContact O-CB 3.42Å; A324-F328 PolarHBondContact O-N 3.33Å; E325-F328 PolarHBondContact O-N 3.49Å; T326-F328 VanDerWaalsContact C-N 3.28Å; T326-F328 PolarHBondContact O-N 3.04Å; F328-F556 HydrophobicContact CB-CD2 3.88Å; F328-F556 HydrophobicContact CB-CE2 3.65Å; F328-F556 HydrophobicContact CB-CZ 4.44Å; F328-F556 HydrophobicContact CD2-CB 4.36Å; F328-F556 AromaticContact CD2-CD2 3.76Å; F328-F556 HydrophobicContact CD2-CD2 3.76Å; F328-F556 HydrophobicContact CD2-CE2 4.23Å; F328-F556 AromaticContact CD2-CG 3.97Å; F328-F556 HydrophobicContact CD2-CG 3.97Å; F328-F556 HydrophobicContact CG-CD2 4.33Å; F328-F556 HydrophobicContact CG-CE2 4.46Å
329	L	77.9	Confident	76.9	Confident	120 Å²	120	50.4 Å²	50.4	63%	0.628	28%	0.279	S	S	*	.	H	α-helix	trans	-71	-39.2	-177	-70.4	170.6	0	0	0	113.6	E325 T326 N331	E325-L329 WeakPolarHBondContact O-CB 3.27Å; E325-L329 VanDerWaalsContact O-CG 3.27Å; E325-L329 WeakPolarHBondContact O-CG 3.38Å; E325-L329 PolarHBondContact O-N 3.19Å; T326-L329 PolarHBondContact O-N 3.28Å; L329-N331 VanDerWaalsContact C-N 3.3Å; L329-N331 PolarHBondContact O-N 2.87Å
330	T	76.3	Confident	76.9	Confident	24 Å²	24	51.3 Å²	51.3	15%	0.147	29%	0.287	C	S	.	.	H	α-helix	trans	-77.8	-16.7	-176.3	58.6	0	0	0	0	113.1	V244 T326 I327 Q332	V244-T330 HydrophobicContact CB-CG2 4.39Å; T326-T330 HydrophobicContact CG2-CG2 4.24Å; T326-T330 WeakPolarHBondContact O-CG2 3.34Å; T326-T330 PolarHBondContact O-N 2.93Å; T326-T330 PolarHBondContact O-OG1 3.44Å; T326-T330 VanDerWaalsContact O-OG1 3.07Å; I327-T330 PolarHBondContact O-OG1 2.99Å; T330-Q332 PolarHBondContact O-N 2.88Å; T330-Q332 PolarHBondContact OG1-N 3.08Å; T330-Q332 PolarHBondContact OG1-O 2.89Å
331	N	75.5	Confident	77	Confident	105 Å²	105	51.3 Å²	51.3	56%	0.561	28%	0.279	S	S	*	.	S	Bend	trans	53.5	16	-168.2	-80.8	-45.1	0	0	0	114.2	I327 L329 R559	I327-N331 PolarHBondContact O-N 2.99Å; L329-N331 VanDerWaalsContact C-N 3.3Å; L329-N331 PolarHBondContact O-N 2.87Å; N331-R559 VanDerWaalsContact CA-NH1 3.35Å; N331-R559 PolarHBondContact O-NH1 3.1Å; N331-R559 PolarHBondContact OD1-NH1 3.5Å
332	Q	70.3	Confident	76.9	Confident	88 Å²	88	57.1 Å²	57.1	41%	0.411	30%	0.304	S	S	.	.			trans	-133.7	134.1	-177.8	-70.2	-178.1	-9.7	0	0	109	T330 P334	T330-Q332 PolarHBondContact O-N 2.88Å; T330-Q332 PolarHBondContact OG1-N 3.08Å; T330-Q332 PolarHBondContact OG1-O 2.89Å; Q332-P334 WeakPolarHBondContact O-CD 3.3Å
333	A	66.4	Low	77.2	Confident	20 Å²	20	61 Å²	61	17%	0.165	33%	0.33	C	S	.	.			trans	-92	102.5	162.7	0	0	0	0	0	106.8	I335 E563	A333-I335 WeakPolarHBondContact O-CG1 3.5Å; A333-I335 PolarHBondContact O-N 3.47Å; A333-E563 HydrophobicContact CB-CB 4.1Å
334	P	65.7	Low	77.4	Confident	33 Å²	33	60.9 Å²	60.9	21%	0.214	33%	0.326	C	S	.	.			trans	-68.5	108.8	176.2	25.5	-29.7	0	0	0	108.9	Q332	Q332-P334 WeakPolarHBondContact O-CD 3.3Å
335	I	66.8	Low	77.8	Confident	45 Å²	45	63.8 Å²	63.8	23%	0.231	34%	0.335	C	S	.	.			trans	-91.5	146.1	178.6	-53.8	148.5	0	0	0	108.1	A333 T340 R562 A566	A333-I335 WeakPolarHBondContact O-CG1 3.5Å; A333-I335 PolarHBondContact O-N 3.47Å; I335-T340 HydrophobicContact CG2-CG2 4.05Å; I335-R562 VanDerWaalsContact CD1-NH2 3.28Å; I335-A566 HydrophobicContact CG2-CB 4.27Å
336	G	75.5	Confident	78.5	Confident	14 Å²	14	62.1 Å²	62.1	14%	0.144	33%	0.326	C	S	.	.			trans	-69.1	-166	-179.8	0	0	0	0	0	112.6	F338 T340	G336-F338 VanDerWaalsContact C-N 3.29Å; G336-T340 WeakPolarHBondContact O-CG2 3.33Å
337	E	80.8	Confident	79.2	Confident	51 Å²	51	64.4 Å²	64.4	24%	0.238	34%	0.344	C	S	.	.	S	Bend	trans	-67.4	-30.2	174.4	175.6	171	-138.8	0	0	112.9	V259 F261	V259-E337 WeakPolarHBondContact CG1-OE2 3.47Å; F261-E337 WeakPolarHBondContact CB-OE1 3.36Å; F261-E337 PolarHBondContact N-OE2 3.01Å
338	F	88.3	Confident	79.9	Confident	21 Å²	21	66.1 Å²	66.1	9%	0.092	35%	0.354	C	S	.	.	S	Bend	trans	-117.5	166	-176.7	-57.9	-83.1	0	0	0	110.7	L260 H317 G336 T340 E352 I356	L260-F338 HydrophobicContact CB-CE2 4.31Å; L260-F338 HydrophobicContact CD2-CE2 4.27Å; H317-F338 HydrophobicContact CB-CD2 3.9Å; H317-F338 HydrophobicContact CB-CE2 4.29Å; G336-F338 VanDerWaalsContact C-N 3.29Å; F338-T340 VanDerWaalsContact C-N 3.27Å; F338-T340 PolarHBondContact O-N 3.31Å; F338-E352 HydrophobicContact CD1-CB 4.28Å; F338-E352 HydrophobicContact CD1-CG 4.31Å; F338-I356 HydrophobicContact CB-CD1 3.98Å; F338-I356 HydrophobicContact CD1-CD1 4.06Å; F338-I356 HydrophobicContact CD1-CG1 4.01Å; F338-I356 HydrophobicContact CD2-CD1 3.94Å; F338-I356 HydrophobicContact CD2-CG1 3.94Å; F338-I356 HydrophobicContact CE1-CG1 4.03Å; F338-I356 HydrophobicContact CE2-CD1 4.48Å; F338-I356 HydrophobicContact CE2-CG1 3.96Å; F338-I356 HydrophobicContact CG-CD1 3.72Å; F338-I356 HydrophobicContact CG-CG1 3.97Å; F338-I356 HydrophobicContact CZ-CG1 4.01Å
339	F	90.2	Very high	80.6	Confident	6 Å²	6	61.1 Å²	61.1	3%	0.026	33%	0.333	C	S	.	.			trans	56.6	41.5	179.8	-46.1	-64.5	0	0	0	112.2	V349 E352 Q353 I356 L569 E570 T573	F339-V349 HydrophobicContact CD1-CG1 4.42Å; F339-V349 HydrophobicContact CD1-CG2 4.37Å; F339-V349 HydrophobicContact CE1-CB 4.47Å; F339-V349 HydrophobicContact CE1-CG1 3.96Å; F339-E352 VanDerWaalsContact CA-OE2 3.24Å; F339-E352 WeakPolarHBondContact CA-OE2 3.29Å; F339-E352 HydrophobicContact CD1-CB 4.5Å; F339-E352 WeakPolarHBondContact CD1-OE2 3.39Å; F339-E352 HydrophobicContact CE1-CB 3.96Å; F339-E352 WeakPolarHBondContact CE1-OE2 3.3Å; F339-E352 HydrophobicContact CZ-CB 4.42Å; F339-E352 PolarHBondContact N-OE1 3.43Å; F339-E352 PolarHBondContact N-OE2 3.08Å; F339-Q353 HydrophobicContact CE1-CG 4.42Å; F339-Q353 HydrophobicContact CZ-CG 4.24Å; F339-I356 HydrophobicContact CE2-CD1 3.74Å; F339-I356 HydrophobicContact CZ-CD1 3.71Å; F339-L569 HydrophobicContact CB-CB 4.39Å; F339-L569 HydrophobicContact CB-CD1 4.12Å; F339-L569 HydrophobicContact CD1-CB 3.93Å; F339-L569 HydrophobicContact CD1-CD1 3.91Å; F339-L569 HydrophobicContact CD2-CB 3.93Å; F339-L569 HydrophobicContact CE1-CB 4.22Å; F339-L569 HydrophobicContact CE2-CB 4.2Å; F339-L569 HydrophobicContact CG-CB 3.79Å; F339-L569 HydrophobicContact CG-CD1 4.1Å; F339-L569 HydrophobicContact CZ-CB 4.35Å; F339-E570 HydrophobicContact CD2-CG 3.77Å; F339-E570 HydrophobicContact CE2-CG 4.09Å; F339-T573 HydrophobicContact CZ-CG2 4.43Å; F339-T573 WeakPolarHBondContact CZ-OG1 3.43Å
340	T	85.4	Confident	81.3	Confident	64 Å²	64	58.5 Å²	58.5	39%	0.393	32%	0.318	S	S	.	.			trans	-80.5	-17.4	-173.6	60.1	0	0	0	0	114.1	I335 G336 F338 R562	I335-T340 HydrophobicContact CG2-CG2 4.05Å; G336-T340 WeakPolarHBondContact O-CG2 3.33Å; F338-T340 VanDerWaalsContact C-N 3.27Å; F338-T340 PolarHBondContact O-N 3.31Å; T340-R562 PolarHBondContact O-NH2 2.83Å
341	E	82.2	Confident	82.1	Confident	72 Å²	72	59.8 Å²	59.8	34%	0.336	33%	0.328	S	S	.	.			trans	-60.4	145.8	-179.6	-64.3	-169.1	158.6	0	0	112.3	L345	E341-L345 PolarHBondContact OE2-N 3.12Å
342	E	77.3	Confident	83	Confident	148 Å²	148	56.4 Å²	56.4	69%	0.692	31%	0.309	S	S	*	.	S	Bend	trans	-66.4	-39.7	174.9	-85.1	-175.7	177.3	0	0	112.6	R562	E342-R562 IonicContact OE1-CZ 2.71Å; E342-R562 IonicContact OE1-NH1 3.44Å; E342-R562 PolarHBondContact OE1-NH1 2.92Å
343	V	82.8	Confident	84.1	Confident	116 Å²	116	53.5 Å²	53.5	70%	0.703	30%	0.295	S	S	*	.	S	Bend	trans	-127.4	95.2	176.4	-177.4	0	0	0	0	106.4	L345	V343-L345 PolarHBondContact O-N 3.46Å; V343-L345 VanDerWaalsContact O-N 3.13Å
344	P	81.6	Confident	85.5	Confident	32 Å²	32	59.3 Å²	59.3	21%	0.208	31%	0.313	C	S	.	.			trans	-66.1	114.6	-172.4	22.1	-30.1	0	0	0	110.9	V349 T565 L569	P344-V349 HydrophobicContact CB-CG2 3.63Å; P344-T565 HydrophobicContact CG-CG2 3.9Å; P344-L569 HydrophobicContact CB-CD1 3.96Å; P344-L569 HydrophobicContact CG-CD1 3.87Å
345	L	87.2	Confident	86.9	Confident	103 Å²	103	60.7 Å²	60.7	54%	0.539	32%	0.321	S	S	.	.			trans	-72.8	137.2	175.1	-66	174.4	0	0	0	110	E341 V343 S347 V348 V349	E341-L345 PolarHBondContact OE2-N 3.12Å; V343-L345 PolarHBondContact O-N 3.46Å; V343-L345 VanDerWaalsContact O-N 3.13Å; L345-S347 VanDerWaalsContact C-N 3.27Å; L345-S347 PolarHBondContact O-N 3.05Å; L345-S347 VanDerWaalsContact O-N 3.15Å; L345-V348 HydrophobicContact CB-CB 4.45Å; L345-V348 HydrophobicContact CB-CG2 4.07Å; L345-V348 PolarHBondContact O-N 3.22Å; L345-V349 PolarHBondContact O-N 3.43Å
346	K	88.7	Confident	88.3	Confident	91 Å²	91	58.6 Å²	58.6	40%	0.396	31%	0.31	S	S	.	.	H	α-helix	trans	-51	-44.1	-177.4	-175.7	171.2	175.7	165.7	0	113.3	V348 V349 E350 L715	K346-V348 VanDerWaalsContact C-N 3.31Å; K346-V348 PolarHBondContact O-N 3.21Å; K346-V349 PolarHBondContact O-N 2.86Å; K346-E350 WeakPolarHBondContact CE-OE1 3.26Å; K346-E350 WeakPolarHBondContact O-CG 3.22Å; K346-E350 PolarHBondContact O-N 3.3Å; K346-L715 HydrophobicContact CB-CD2 3.78Å; K346-L715 HydrophobicContact CD-CD2 3.94Å; K346-L715 HydrophobicContact CG-CD2 4.04Å; K346-L715 PolarHBondContact NZ-O 3.11Å
347	S	90.6	Very high	89.2	Confident	83 Å²	83	60.7 Å²	60.7	58%	0.58	31%	0.313	S	S	*	.	H	α-helix	trans	-65	-32.4	179.6	54.6	0	0	0	0	113.7	L345 S351	L345-S347 VanDerWaalsContact C-N 3.27Å; L345-S347 PolarHBondContact O-N 3.05Å; L345-S347 VanDerWaalsContact O-N 3.15Å; S347-S351 PolarHBondContact O-N 3.38Å
348	V	91.2	Very high	89.9	Confident	35 Å²	35	64.6 Å²	64.6	21%	0.212	33%	0.331	C	S	.	.	H	α-helix	trans	-75.6	-44.1	177.3	-180	0	0	0	0	109.8	L345 K346 E350 S351 E352	L345-V348 HydrophobicContact CB-CB 4.45Å; L345-V348 HydrophobicContact CB-CG2 4.07Å; L345-V348 PolarHBondContact O-N 3.22Å; K346-V348 VanDerWaalsContact C-N 3.31Å; K346-V348 PolarHBondContact O-N 3.21Å; V348-E350 VanDerWaalsContact C-N 3.3Å; V348-E350 PolarHBondContact O-N 3.01Å; V348-S351 PolarHBondContact O-N 3.09Å; V348-S351 VanDerWaalsContact O-N 3.15Å; V348-S351 PolarHBondContact O-OG 2.83Å; V348-E352 HydrophobicContact CG1-CG 4.45Å; V348-E352 WeakPolarHBondContact O-CG 3.47Å; V348-E352 PolarHBondContact O-N 3.33Å
349	V	92.2	Very high	90.2	Very high	13 Å²	13	65.7 Å²	65.7	8%	0.079	34%	0.338	C	S	.	.	H	α-helix	trans	-56.6	-45.9	174.2	174.4	0	0	0	0	111	F339 P344 L345 K346 S351 E352 Q353 L569	F339-V349 HydrophobicContact CD1-CG1 4.42Å; F339-V349 HydrophobicContact CD1-CG2 4.37Å; F339-V349 HydrophobicContact CE1-CB 4.47Å; F339-V349 HydrophobicContact CE1-CG1 3.96Å; P344-V349 HydrophobicContact CB-CG2 3.63Å; L345-V349 PolarHBondContact O-N 3.43Å; K346-V349 PolarHBondContact O-N 2.86Å; V349-S351 VanDerWaalsContact C-N 3.35Å; V349-S351 PolarHBondContact O-N 3.07Å; V349-E352 PolarHBondContact O-N 3.03Å; V349-Q353 HydrophobicContact CG1-CG 4.39Å; V349-Q353 VanDerWaalsContact O-CB 3.29Å; V349-Q353 WeakPolarHBondContact O-CB 3.43Å; V349-Q353 WeakPolarHBondContact O-CG 3.47Å; V349-Q353 PolarHBondContact O-N 3.4Å; V349-L569 HydrophobicContact CG1-CD2 3.94Å; V349-L569 HydrophobicContact CG2-CD1 4Å
350	E	92.2	Very high	90.4	Very high	64 Å²	64	65.7 Å²	65.7	30%	0.299	34%	0.339	S	S	.	.	H	α-helix	trans	-65.5	-34.3	178.7	-74.3	176.6	-170.8	0	0	113	K346 V348 R354	K346-E350 WeakPolarHBondContact CE-OE1 3.26Å; K346-E350 WeakPolarHBondContact O-CG 3.22Å; K346-E350 PolarHBondContact O-N 3.3Å; V348-E350 VanDerWaalsContact C-N 3.3Å; V348-E350 PolarHBondContact O-N 3.01Å; E350-R354 WeakPolarHBondContact O-CG 3.18Å; E350-R354 PolarHBondContact O-N 3.37Å; E350-R354 VanDerWaalsContact O-N 3.15Å; E350-R354 IonicContact OE2-NH2 3.09Å
351	S	94	Very high	90.9	Very high	52 Å²	52	67.7 Å²	67.7	36%	0.364	34%	0.343	S	S	.	.	H	α-helix	trans	-73.3	-42.2	177.7	70.9	0	0	0	0	111.9	S347 V348 V349 Q353 R354 T355	S347-S351 PolarHBondContact O-N 3.38Å; V348-S351 PolarHBondContact O-N 3.09Å; V348-S351 VanDerWaalsContact O-N 3.15Å; V348-S351 PolarHBondContact O-OG 2.83Å; V349-S351 VanDerWaalsContact C-N 3.35Å; V349-S351 PolarHBondContact O-N 3.07Å; S351-Q353 VanDerWaalsContact C-N 3.35Å; S351-R354 PolarHBondContact O-N 2.97Å; S351-T355 PolarHBondContact O-N 2.65Å; S351-T355 VanDerWaalsContact O-N 3.1Å; S351-T355 PolarHBondContact O-OG1 3Å
352	E	93.8	Very high	91.4	Very high	34 Å²	34	67.9 Å²	67.9	16%	0.159	35%	0.345	C	S	.	.	H	α-helix	trans	-62.8	-42.1	173.2	-71.3	-172.6	151.3	0	0	110.9	F338 F339 V348 V349 R354 T355 I356	F338-E352 HydrophobicContact CD1-CB 4.28Å; F338-E352 HydrophobicContact CD1-CG 4.31Å; F339-E352 VanDerWaalsContact CA-OE2 3.24Å; F339-E352 WeakPolarHBondContact CA-OE2 3.29Å; F339-E352 HydrophobicContact CD1-CB 4.5Å; F339-E352 WeakPolarHBondContact CD1-OE2 3.39Å; F339-E352 HydrophobicContact CE1-CB 3.96Å; F339-E352 WeakPolarHBondContact CE1-OE2 3.3Å; F339-E352 HydrophobicContact CZ-CB 4.42Å; F339-E352 PolarHBondContact N-OE1 3.43Å; F339-E352 PolarHBondContact N-OE2 3.08Å; V348-E352 HydrophobicContact CG1-CG 4.45Å; V348-E352 WeakPolarHBondContact O-CG 3.47Å; V348-E352 PolarHBondContact O-N 3.33Å; V349-E352 PolarHBondContact O-N 3.03Å; E352-R354 PolarHBondContact O-N 3.26Å; E352-T355 WeakPolarHBondContact O-CB 3.49Å; E352-T355 PolarHBondContact O-N 2.91Å; E352-I356 VanDerWaalsContact O-CG1 3.31Å; E352-I356 WeakPolarHBondContact O-CG1 3.35Å; E352-I356 PolarHBondContact O-N 3.09Å
353	Q	94.2	Very high	92.2	Very high	26 Å²	26	61.7 Å²	61.7	12%	0.121	32%	0.316	C	S	.	.	H	α-helix	trans	-55.3	-49.7	174.4	-83	177	-6.1	0	0	112.6	F339 V349 S351 T355 I356 W357 T573	F339-Q353 HydrophobicContact CE1-CG 4.42Å; F339-Q353 HydrophobicContact CZ-CG 4.24Å; V349-Q353 HydrophobicContact CG1-CG 4.39Å; V349-Q353 VanDerWaalsContact O-CB 3.29Å; V349-Q353 WeakPolarHBondContact O-CB 3.43Å; V349-Q353 WeakPolarHBondContact O-CG 3.47Å; V349-Q353 PolarHBondContact O-N 3.4Å; S351-Q353 VanDerWaalsContact C-N 3.35Å; Q353-T355 VanDerWaalsContact C-N 3.29Å; Q353-T355 PolarHBondContact O-N 3.48Å; Q353-I356 PolarHBondContact O-N 3.12Å; Q353-W357 HydrophobicContact CB-CH2 4.33Å; Q353-W357 HydrophobicContact CB-CZ2 4.22Å; Q353-W357 VanDerWaalsContact O-CG 3.25Å; Q353-W357 PolarHBondContact O-N 2.92Å; Q353-T573 HydrophobicContact CB-CG2 4.27Å; Q353-T573 HydrophobicContact CG-CG2 3.78Å; Q353-T573 VanDerWaalsContact CG-OG1 3.27Å; Q353-T573 WeakPolarHBondContact CG-OG1 3.42Å; Q353-T573 PolarHBondContact NE2-OG1 3.19Å
354	R	94.5	Very high	92.9	Very high	143 Å²	143	56.4 Å²	56.4	54%	0.54	28%	0.283	S	S	.	.	H	α-helix	trans	-60.8	-40.5	177.8	-70.3	175.1	-156.1	144.3	9.8	111.8	E350 S351 E352 W357 Q358	E350-R354 WeakPolarHBondContact O-CG 3.18Å; E350-R354 PolarHBondContact O-N 3.37Å; E350-R354 VanDerWaalsContact O-N 3.15Å; E350-R354 IonicContact OE2-NH2 3.09Å; S351-R354 PolarHBondContact O-N 2.97Å; E352-R354 PolarHBondContact O-N 3.26Å; R354-W357 PolarHBondContact O-N 3.34Å; R354-Q358 WeakPolarHBondContact O-CG 3.5Å; R354-Q358 PolarHBondContact O-N 2.87Å
355	T	95.2	Very high	93.5	Very high	62 Å²	62	60.2 Å²	60.2	38%	0.38	30%	0.302	S	S	.	.	H	α-helix	trans	-63.8	-47.5	178	-54.3	0	0	0	0	111	S351 E352 Q353 W357 Q358 L359	S351-T355 PolarHBondContact O-N 2.65Å; S351-T355 VanDerWaalsContact O-N 3.1Å; S351-T355 PolarHBondContact O-OG1 3Å; E352-T355 WeakPolarHBondContact O-CB 3.49Å; E352-T355 PolarHBondContact O-N 2.91Å; Q353-T355 VanDerWaalsContact C-N 3.29Å; Q353-T355 PolarHBondContact O-N 3.48Å; T355-W357 VanDerWaalsContact C-N 3.32Å; T355-W357 PolarHBondContact O-N 3.48Å; T355-Q358 PolarHBondContact O-N 2.94Å; T355-L359 HydrophobicContact CG2-CD1 4.3Å; T355-L359 WeakPolarHBondContact O-CG 3.49Å; T355-L359 PolarHBondContact O-N 3.47Å; T355-L359 VanDerWaalsContact O-N 3.09Å
356	I	95.8	Very high	94	Very high	0 Å²	0	56.6 Å²	56.6	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-58.1	-45.7	176.3	-70.3	163.5	0	0	0	110.4	L260 H317 F338 F339 E352 Q353 L359 T360 T573	L260-I356 HydrophobicContact CD2-CB 4.36Å; L260-I356 HydrophobicContact CD2-CG1 4.31Å; L260-I356 HydrophobicContact CD2-CG2 3.97Å; H317-I356 HydrophobicContact CB-CD1 4.24Å; H317-I356 HydrophobicContact CB-CG1 4.43Å; H317-I356 HydrophobicContact CB-CG2 4.49Å; H317-I356 WeakPolarHBondContact ND1-CG2 3.44Å; F338-I356 HydrophobicContact CB-CD1 3.98Å; F338-I356 HydrophobicContact CD1-CD1 4.06Å; F338-I356 HydrophobicContact CD1-CG1 4.01Å; F338-I356 HydrophobicContact CD2-CD1 3.94Å; F338-I356 HydrophobicContact CD2-CG1 3.94Å; F338-I356 HydrophobicContact CE1-CG1 4.03Å; F338-I356 HydrophobicContact CE2-CD1 4.48Å; F338-I356 HydrophobicContact CE2-CG1 3.96Å; F338-I356 HydrophobicContact CG-CD1 3.72Å; F338-I356 HydrophobicContact CG-CG1 3.97Å; F338-I356 HydrophobicContact CZ-CG1 4.01Å; F339-I356 HydrophobicContact CE2-CD1 3.74Å; F339-I356 HydrophobicContact CZ-CD1 3.71Å; E352-I356 VanDerWaalsContact O-CG1 3.31Å; E352-I356 WeakPolarHBondContact O-CG1 3.35Å; E352-I356 PolarHBondContact O-N 3.09Å; Q353-I356 PolarHBondContact O-N 3.12Å; I356-L359 PolarHBondContact O-N 3.3Å; I356-T360 VanDerWaalsContact O-CB 3.25Å; I356-T360 WeakPolarHBondContact O-CB 3.33Å; I356-T360 PolarHBondContact O-N 3Å; I356-T360 PolarHBondContact O-OG1 3.15Å; I356-T573 HydrophobicContact CB-CG2 3.96Å; I356-T573 HydrophobicContact CD1-CG2 3.85Å; I356-T573 HydrophobicContact CG2-CG2 3.71Å
357	W	95.6	Very high	94.4	Very high	58 Å²	58	52.3 Å²	52.3	22%	0.22	26%	0.263	C	S	.	.	H	α-helix	trans	-64	-42.7	179.6	-65.5	-21.9	0	0	0	113	Q353 R354 T355 T360 E361 T573	Q353-W357 HydrophobicContact CB-CH2 4.33Å; Q353-W357 HydrophobicContact CB-CZ2 4.22Å; Q353-W357 VanDerWaalsContact O-CG 3.25Å; Q353-W357 PolarHBondContact O-N 2.92Å; R354-W357 PolarHBondContact O-N 3.34Å; T355-W357 VanDerWaalsContact C-N 3.32Å; T355-W357 PolarHBondContact O-N 3.48Å; W357-T360 PolarHBondContact O-N 2.95Å; W357-E361 VanDerWaalsContact O-CB 3.31Å; W357-E361 WeakPolarHBondContact O-CB 3.5Å; W357-E361 PolarHBondContact O-N 3.42Å; W357-T573 PolarHBondContact NE1-O 3.32Å
358	Q	95.3	Very high	94.7	Very high	133 Å²	133	50 Å²	50	62%	0.621	24%	0.244	S	C	*	.	H	α-helix	trans	-59.8	-47.6	176.6	-75.4	176.5	-13.2	0	0	111.9	R354 T355 T360 E361 Q362	R354-Q358 WeakPolarHBondContact O-CG 3.5Å; R354-Q358 PolarHBondContact O-N 2.87Å; T355-Q358 PolarHBondContact O-N 2.94Å; Q358-T360 VanDerWaalsContact C-N 3.35Å; Q358-T360 PolarHBondContact O-N 3.49Å; Q358-E361 PolarHBondContact O-N 3.06Å; Q358-Q362 PolarHBondContact O-N 2.69Å; Q358-Q362 VanDerWaalsContact O-N 3.11Å
359	L	94.2	Very high	95	Very high	44 Å²	44	50.9 Å²	50.9	23%	0.23	25%	0.25	C	S	.	.	H	α-helix	trans	-64	-41.3	177.9	-67	175.4	0	0	0	111.9	L260 F261 T355 I356 M363	L260-L359 HydrophobicContact CD2-CB 4.21Å; L260-L359 HydrophobicContact CD2-CD1 4.33Å; L260-L359 HydrophobicContact CG-CB 4.29Å; L260-L359 HydrophobicContact CG-CD1 4.36Å; F261-L359 HydrophobicContact CB-CD1 4.22Å; F261-L359 HydrophobicContact CD2-CD1 4.19Å; F261-L359 HydrophobicContact CD2-CD2 4.31Å; T355-L359 HydrophobicContact CG2-CD1 4.3Å; T355-L359 WeakPolarHBondContact O-CG 3.49Å; T355-L359 PolarHBondContact O-N 3.47Å; T355-L359 VanDerWaalsContact O-N 3.09Å; I356-L359 PolarHBondContact O-N 3.3Å; L359-M363 WeakPolarHBondContact O-CB 3.22Å; L359-M363 PolarHBondContact O-N 3.46Å
360	T	95.2	Very high	95.3	Very high	7 Å²	7	50.3 Å²	50.3	4%	0.043	25%	0.246	C	C	.	.	H	α-helix	trans	-65.3	-42.8	179	-58	0	0	0	0	111.3	I356 W357 Q358 M363 D364	I356-T360 VanDerWaalsContact O-CB 3.25Å; I356-T360 WeakPolarHBondContact O-CB 3.33Å; I356-T360 PolarHBondContact O-N 3Å; I356-T360 PolarHBondContact O-OG1 3.15Å; W357-T360 PolarHBondContact O-N 2.95Å; Q358-T360 VanDerWaalsContact C-N 3.35Å; Q358-T360 PolarHBondContact O-N 3.49Å; T360-M363 PolarHBondContact O-N 3.13Å; T360-D364 WeakPolarHBondContact O-CB 3.28Å; T360-D364 PolarHBondContact O-N 2.91Å
361	E	94.9	Very high	95.5	Very high	105 Å²	105	47.3 Å²	47.3	49%	0.491	23%	0.232	S	C	.	.	H	α-helix	trans	-65.1	-42.8	179.3	-178.9	172.3	-153.7	0	0	112	W357 Q358 D364 L365	W357-E361 VanDerWaalsContact O-CB 3.31Å; W357-E361 WeakPolarHBondContact O-CB 3.5Å; W357-E361 PolarHBondContact O-N 3.42Å; Q358-E361 PolarHBondContact O-N 3.06Å; E361-D364 PolarHBondContact O-N 3.44Å; E361-L365 PolarHBondContact O-N 3.3Å
362	Q	93.5	Very high	95.7	Very high	77 Å²	77	46.4 Å²	46.4	36%	0.36	23%	0.225	S	C	.	.	H	α-helix	trans	-60.4	-47.5	174.6	-176.6	-177.5	-13.9	0	0	111	R266 Q358 D364 L365 E366	R266-Q362 VanDerWaalsContact NE-NE2 3.11Å; Q358-Q362 PolarHBondContact O-N 2.69Å; Q358-Q362 VanDerWaalsContact O-N 3.11Å; Q362-D364 VanDerWaalsContact C-N 3.31Å; Q362-D364 PolarHBondContact O-N 3.15Å; Q362-L365 WeakPolarHBondContact O-CB 3.44Å; Q362-L365 PolarHBondContact O-N 3.41Å; Q362-E366 PolarHBondContact NE2-OE1 3.06Å; Q362-E366 VanDerWaalsContact NE2-OE1 3.1Å; Q362-E366 PolarHBondContact O-N 2.82Å; Q362-E366 VanDerWaalsContact O-N 3.14Å
363	M	94.5	Very high	95.9	Very high	18 Å²	18	45.4 Å²	45.4	9%	0.089	22%	0.221	C	C	.	.	H	α-helix	trans	-60.2	-41.5	177.2	-178.1	-178.4	64.9	0	0	111.5	L260 L359 T360 L365 E366 L367 N431	L260-M363 HydrophobicContact CD1-CE 4.39Å; L359-M363 WeakPolarHBondContact O-CB 3.22Å; L359-M363 PolarHBondContact O-N 3.46Å; T360-M363 PolarHBondContact O-N 3.13Å; M363-L365 VanDerWaalsContact C-N 3.3Å; M363-L365 PolarHBondContact O-N 3.25Å; M363-E366 PolarHBondContact O-N 3.36Å; M363-L367 HydrophobicContact CG-CD1 3.73Å; M363-L367 HydrophobicContact CG-CG 4.14Å; M363-L367 WeakPolarHBondContact O-CB 3.25Å; M363-L367 VanDerWaalsContact O-CG 3.28Å; M363-L367 WeakPolarHBondContact O-CG 3.45Å; M363-L367 PolarHBondContact O-N 3.44Å; M363-L367 HydrophobicContact SD-CD1 4.35Å; M363-N431 WeakPolarHBondContact CE-ND2 3.46Å
364	D	95.7	Very high	96.1	Very high	4 Å²	4	44.1 Å²	44.1	2%	0.021	22%	0.215	C	C	.	.	H	α-helix	trans	-63.5	-35.3	178.2	-72.8	-18	0	0	0	112.3	T360 E361 Q362 N368 R580	T360-D364 WeakPolarHBondContact O-CB 3.28Å; T360-D364 PolarHBondContact O-N 2.91Å; E361-D364 PolarHBondContact O-N 3.44Å; Q362-D364 VanDerWaalsContact C-N 3.31Å; Q362-D364 PolarHBondContact O-N 3.15Å; D364-N368 WeakPolarHBondContact O-CB 3.44Å; D364-N368 PolarHBondContact O-N 2.99Å; D364-R580 IonicContact OD1-CZ 3.14Å; D364-R580 IonicContact OD1-NE 2.75Å; D364-R580 IonicContact OD1-NH2 2.86Å; D364-R580 PolarHBondContact OD1-NH2 3.14Å; D364-R580 WeakPolarHBondContact OD2-CG 3.37Å; D364-R580 IonicContact OD2-CZ 3.44Å; D364-R580 IonicContact OD2-NE 3.95Å; D364-R580 PolarHBondContact OD2-NE 3.31Å; D364-R580 IonicContact OD2-NH2 2.65Å; D364-R580 PolarHBondContact OD2-NH2 3.01Å
365	L	95.7	Very high	96.1	Very high	113 Å²	113	38.2 Å²	38.2	59%	0.592	19%	0.194	S	C	*	.	H	α-helix	trans	-66.3	-46	175.6	-168	84.6	0	0	0	111.4	E361 Q362 M363 N368 T369	E361-L365 PolarHBondContact O-N 3.3Å; Q362-L365 WeakPolarHBondContact O-CB 3.44Å; Q362-L365 PolarHBondContact O-N 3.41Å; M363-L365 VanDerWaalsContact C-N 3.3Å; M363-L365 PolarHBondContact O-N 3.25Å; L365-N368 PolarHBondContact O-N 3.1Å; L365-T369 PolarHBondContact O-N 3.06Å; L365-T369 PolarHBondContact O-OG1 3.13Å
366	E	96.3	Very high	96.1	Very high	27 Å²	27	42.2 Å²	42.2	13%	0.126	20%	0.202	C	C	.	.	H	α-helix	trans	-66.7	-46.9	-179.7	-70	175	-178	0	0	110.9	R266 L269 I273 Q362 M363 N368 T369 L370	R266-E366 IonicContact NE-OE1 3.53Å; R266-E366 PolarHBondContact NE-OE1 3.37Å; L269-E366 HydrophobicContact CD2-CB 3.66Å; L269-E366 WeakPolarHBondContact CD2-OE2 3.48Å; L269-E366 HydrophobicContact CG-CB 4.15Å; I273-E366 HydrophobicContact CD1-CB 3.97Å; I273-E366 HydrophobicContact CD1-CG 4.5Å; I273-E366 WeakPolarHBondContact CD1-O 3.47Å; Q362-E366 PolarHBondContact NE2-OE1 3.06Å; Q362-E366 VanDerWaalsContact NE2-OE1 3.1Å; Q362-E366 PolarHBondContact O-N 2.82Å; Q362-E366 VanDerWaalsContact O-N 3.14Å; M363-E366 PolarHBondContact O-N 3.36Å; E366-N368 PolarHBondContact O-N 3.32Å; E366-T369 WeakPolarHBondContact O-CB 3.48Å; E366-T369 PolarHBondContact O-N 3.09Å; E366-L370 PolarHBondContact O-N 3.47Å
367	L	97.6	Very high	96.1	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-61.3	-44.5	174.5	-71.6	173.1	0	0	0	111.8	L269 L312 L313 M363 T369 L370 F371 V435	L269-L367 HydrophobicContact CD1-CD2 4.1Å; L269-L367 HydrophobicContact CD2-CD2 4.49Å; L312-L367 HydrophobicContact CB-CD2 4.22Å; L313-L367 HydrophobicContact CD2-CD1 3.87Å; L313-L367 HydrophobicContact CD2-CD2 4.21Å; M363-L367 HydrophobicContact CG-CD1 3.73Å; M363-L367 HydrophobicContact CG-CG 4.14Å; M363-L367 WeakPolarHBondContact O-CB 3.25Å; M363-L367 VanDerWaalsContact O-CG 3.28Å; M363-L367 WeakPolarHBondContact O-CG 3.45Å; M363-L367 PolarHBondContact O-N 3.44Å; M363-L367 HydrophobicContact SD-CD1 4.35Å; L367-T369 PolarHBondContact O-N 2.67Å; L367-L370 WeakPolarHBondContact O-CB 3.42Å; L367-L370 PolarHBondContact O-N 3.35Å; L367-F371 VanDerWaalsContact O-CD2 3.28Å; L367-F371 WeakPolarHBondContact O-CD2 3.38Å; L367-F371 PolarHBondContact O-N 3.14Å; L367-V435 HydrophobicContact CB-CG2 3.88Å; L367-V435 HydrophobicContact CD1-CG2 4.35Å
368	N	96.9	Very high	95.9	Very high	34 Å²	34	39.9 Å²	39.9	18%	0.182	19%	0.194	C	C	.	.	H	α-helix	trans	-60.5	-38.4	176.9	-175.6	50.7	0	0	0	111.7	D364 L365 E366 T372 R438	D364-N368 WeakPolarHBondContact O-CB 3.44Å; D364-N368 PolarHBondContact O-N 2.99Å; L365-N368 PolarHBondContact O-N 3.1Å; E366-N368 PolarHBondContact O-N 3.32Å; N368-T372 WeakPolarHBondContact O-CB 3.49Å; N368-T372 PolarHBondContact O-N 3.21Å; N368-T372 PolarHBondContact O-OG1 2.95Å; N368-R438 HydrophobicContact CB-CG 4.39Å; N368-R438 VanDerWaalsContact CG-CD 3.48Å
369	T	97.4	Very high	95.6	Very high	55 Å²	55	42.2 Å²	42.2	34%	0.337	20%	0.202	S	C	.	.	H	α-helix	trans	-63.5	-45.7	175.7	-57.6	0	0	0	0	111.4	I273 L365 E366 L367 T372 N373	I273-T369 HydrophobicContact CG2-CG2 3.86Å; L365-T369 PolarHBondContact O-N 3.06Å; L365-T369 PolarHBondContact O-OG1 3.13Å; E366-T369 WeakPolarHBondContact O-CB 3.48Å; E366-T369 PolarHBondContact O-N 3.09Å; L367-T369 PolarHBondContact O-N 2.67Å; T369-T372 PolarHBondContact O-N 3.19Å; T369-N373 WeakPolarHBondContact O-CB 3.28Å; T369-N373 VanDerWaalsContact O-CG 3.26Å; T369-N373 PolarHBondContact O-N 3.26Å; T369-N373 PolarHBondContact O-ND2 2.82Å
370	L	98.3	Very high	95.4	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-54.7	-57.3	175.1	168.5	57.4	0	0	0	111.4	L269 T272 I273 L309 L312 E366 L367 T372 N373 L374	L269-L370 HydrophobicContact CD1-CD2 4.07Å; T272-L370 HydrophobicContact CG2-CD1 3.77Å; T272-L370 HydrophobicContact CG2-CD2 4Å; I273-L370 HydrophobicContact CG1-CB 3.86Å; L309-L370 HydrophobicContact CD2-CD2 3.96Å; L312-L370 HydrophobicContact CD1-CD2 3.78Å; E366-L370 PolarHBondContact O-N 3.47Å; L367-L370 WeakPolarHBondContact O-CB 3.42Å; L367-L370 PolarHBondContact O-N 3.35Å; L370-T372 VanDerWaalsContact C-N 3.34Å; L370-T372 PolarHBondContact O-N 3.23Å; L370-N373 WeakPolarHBondContact O-CB 3.42Å; L370-N373 PolarHBondContact O-N 2.96Å; L370-L374 HydrophobicContact CD1-CD1 4.37Å; L370-L374 HydrophobicContact CD1-CG 4.43Å; L370-L374 WeakPolarHBondContact O-CG 3.33Å; L370-L374 PolarHBondContact O-N 2.8Å; L370-L374 VanDerWaalsContact O-N 3.07Å
371	F	98.2	Very high	95.2	Very high	1 Å²	1	49.7 Å²	49.7	0%	0.004	23%	0.226	C	C	.	.	H	α-helix	trans	-69.4	-32.6	-176.4	-75.4	-80.5	0	0	0	112.6	L309 L313 L367 N373 L374 L375 L388 W391 F392 V435 L439	L309-F371 HydrophobicContact CB-CZ 4.36Å; L309-F371 HydrophobicContact CD1-CE1 4.02Å; L309-F371 HydrophobicContact CD1-CZ 4.35Å; L309-F371 HydrophobicContact CD2-CE1 4.25Å; L309-F371 HydrophobicContact CD2-CZ 4.03Å; L309-F371 HydrophobicContact CG-CZ 4.47Å; L313-F371 HydrophobicContact CD1-CE2 4.41Å; L313-F371 HydrophobicContact CD1-CZ 4.07Å; L313-F371 HydrophobicContact CD2-CE2 4.33Å; L367-F371 VanDerWaalsContact O-CD2 3.28Å; L367-F371 WeakPolarHBondContact O-CD2 3.38Å; L367-F371 PolarHBondContact O-N 3.14Å; F371-N373 VanDerWaalsContact C-N 3.32Å; F371-N373 PolarHBondContact O-N 3.39Å; F371-L374 HydrophobicContact CD1-CD1 4.13Å; F371-L374 HydrophobicContact CE1-CD1 4.45Å; F371-L374 PolarHBondContact O-N 3.5Å; F371-L375 WeakPolarHBondContact O-CG 3.23Å; F371-L375 PolarHBondContact O-N 2.76Å; F371-L388 HydrophobicContact CD1-CD1 4.37Å; F371-L388 HydrophobicContact CE1-CD1 4.34Å; F371-W391 HydrophobicContact CE1-CZ3 4.34Å; F371-W391 HydrophobicContact CZ-CZ3 4.46Å; F371-F392 AromaticContact CD1-CE1 3.89Å; F371-F392 HydrophobicContact CD1-CE1 3.89Å; F371-F392 AromaticContact CD1-CZ 3.7Å; F371-F392 HydrophobicContact CD1-CZ 3.7Å; F371-F392 AromaticContact CE1-CE1 3.64Å; F371-F392 HydrophobicContact CE1-CE1 3.64Å; F371-F392 AromaticContact CE1-CZ 3.96Å; F371-F392 HydrophobicContact CE1-CZ 3.96Å; F371-V435 HydrophobicContact CB-CG1 3.97Å; F371-V435 HydrophobicContact CD1-CG1 4.39Å; F371-V435 HydrophobicContact CD2-CB 4.44Å; F371-V435 HydrophobicContact CD2-CG1 3.44Å; F371-V435 VanDerWaalsContact CD2-CG1 3.44Å; F371-V435 HydrophobicContact CD2-CG2 4.15Å; F371-V435 HydrophobicContact CE2-CG1 3.98Å; F371-V435 HydrophobicContact CE2-CG2 4.3Å; F371-V435 HydrophobicContact CG-CG1 3.68Å; F371-L439 HydrophobicContact CB-CD1 3.89Å; F371-L439 HydrophobicContact CB-CD2 3.95Å; F371-L439 HydrophobicContact CB-CG 4.39Å
372	T	97.2	Very high	95	Very high	34 Å²	34	45.9 Å²	45.9	21%	0.209	21%	0.211	C	C	.	.	H	α-helix	trans	-63	-39.2	172.5	-62.4	0	0	0	0	111.4	N368 T369 L370 L375 R376	N368-T372 WeakPolarHBondContact O-CB 3.49Å; N368-T372 PolarHBondContact O-N 3.21Å; N368-T372 PolarHBondContact O-OG1 2.95Å; T369-T372 PolarHBondContact O-N 3.19Å; L370-T372 VanDerWaalsContact C-N 3.34Å; L370-T372 PolarHBondContact O-N 3.23Å; T372-L375 PolarHBondContact O-N 2.99Å; T372-R376 VanDerWaalsContact O-CG 3.3Å; T372-R376 WeakPolarHBondContact O-CG 3.21Å; T372-R376 PolarHBondContact O-N 2.98Å
373	N	97.6	Very high	94.9	Very high	12 Å²	12	45.4 Å²	45.4	6%	0.064	21%	0.206	C	C	.	.	H	α-helix	trans	-64.4	-44.5	174.5	-73.2	-16.7	0	0	0	111.5	I273 S276 T369 L370 F371 L375 R376 V377	I273-N373 PolarHBondContact O-ND2 2.93Å; S276-N373 WeakPolarHBondContact OG-CB 3.42Å; S276-N373 PolarHBondContact OG-ND2 3.48Å; T369-N373 WeakPolarHBondContact O-CB 3.28Å; T369-N373 VanDerWaalsContact O-CG 3.26Å; T369-N373 PolarHBondContact O-N 3.26Å; T369-N373 PolarHBondContact O-ND2 2.82Å; L370-N373 WeakPolarHBondContact O-CB 3.42Å; L370-N373 PolarHBondContact O-N 2.96Å; F371-N373 VanDerWaalsContact C-N 3.32Å; F371-N373 PolarHBondContact O-N 3.39Å; N373-L375 VanDerWaalsContact C-N 3.29Å; N373-L375 PolarHBondContact O-N 2.83Å; N373-R376 WeakPolarHBondContact O-CB 3.49Å; N373-R376 PolarHBondContact O-N 3.45Å; N373-R376 VanDerWaalsContact O-N 3.12Å; N373-R376 PolarHBondContact OD1-NH1 3.38Å; N373-V377 WeakPolarHBondContact O-CG2 3.41Å; N373-V377 PolarHBondContact O-N 3.41Å
374	L	97.9	Very high	94.9	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-59.3	-39.9	174.9	-63.3	177.1	0	0	0	111.8	A282 I286 L309 L370 F371 V377 G378 L388	A282-L374 HydrophobicContact CB-CD2 3.6Å; I286-L374 HydrophobicContact CD1-CD2 4.45Å; I286-L374 HydrophobicContact CG1-CD1 4.4Å; L309-L374 HydrophobicContact CD1-CD1 4.36Å; L309-L374 HydrophobicContact CD2-CD1 4.26Å; L370-L374 HydrophobicContact CD1-CD1 4.37Å; L370-L374 HydrophobicContact CD1-CG 4.43Å; L370-L374 WeakPolarHBondContact O-CG 3.33Å; L370-L374 PolarHBondContact O-N 2.8Å; L370-L374 VanDerWaalsContact O-N 3.07Å; F371-L374 HydrophobicContact CD1-CD1 4.13Å; F371-L374 HydrophobicContact CE1-CD1 4.45Å; F371-L374 PolarHBondContact O-N 3.5Å; L374-V377 PolarHBondContact O-N 2.89Å; L374-G378 PolarHBondContact O-N 2.72Å; L374-L388 HydrophobicContact CB-CD2 3.96Å; L374-L388 HydrophobicContact CD1-CD1 4.23Å
375	L	95.7	Very high	94.8	Very high	18 Å²	18	45.7 Å²	45.7	9%	0.094	21%	0.207	C	C	.	.	H	α-helix	trans	-66.1	-41.2	173.6	-70.6	-176.5	0	0	0	112.8	F371 T372 N373 V377 G378 K379 L388 F389 L439 L504 L508	F371-L375 WeakPolarHBondContact O-CG 3.23Å; F371-L375 PolarHBondContact O-N 2.76Å; T372-L375 PolarHBondContact O-N 2.99Å; N373-L375 VanDerWaalsContact C-N 3.29Å; N373-L375 PolarHBondContact O-N 2.83Å; L375-V377 VanDerWaalsContact C-N 3.32Å; L375-V377 PolarHBondContact O-N 3.15Å; L375-G378 CarbonylContact O-C 3.3Å; L375-G378 PolarHBondContact O-N 2.8Å; L375-K379 PolarHBondContact O-N 2.79Å; L375-L388 HydrophobicContact CD2-CD2 3.85Å; L375-L388 HydrophobicContact CG-CD2 4.43Å; L375-F389 HydrophobicContact CD2-CE2 3.58Å; L375-F389 HydrophobicContact CD2-CZ 4.16Å; L375-L439 HydrophobicContact CD1-CB 4.34Å; L375-L439 HydrophobicContact CD1-CD1 4.14Å; L375-L439 HydrophobicContact CD1-CD2 3.82Å; L375-L439 HydrophobicContact CD1-CG 4.3Å; L375-L504 HydrophobicContact CD2-CD1 4.32Å; L375-L508 HydrophobicContact CD1-CD1 4.12Å
376	R	95.6	Very high	94.6	Very high	147 Å²	147	45.7 Å²	45.7	56%	0.555	20%	0.202	S	C	*	.	H	α-helix	trans	-62.3	-41.3	176.1	-74.7	171.8	-174.4	151.8	-1.4	111.3	T372 N373 K379 R380	T372-R376 VanDerWaalsContact O-CG 3.3Å; T372-R376 WeakPolarHBondContact O-CG 3.21Å; T372-R376 PolarHBondContact O-N 2.98Å; N373-R376 WeakPolarHBondContact O-CB 3.49Å; N373-R376 PolarHBondContact O-N 3.45Å; N373-R376 VanDerWaalsContact O-N 3.12Å; N373-R376 PolarHBondContact OD1-NH1 3.38Å; R376-K379 PolarHBondContact O-N 3.31Å; R376-R380 PolarHBondContact O-N 2.88Å
377	V	94.4	Very high	94.5	Very high	7 Å²	7	45.5 Å²	45.5	4%	0.042	20%	0.202	C	C	.	.	H	α-helix	trans	-64.6	-45.9	173	172	0	0	0	0	110.2	S276 K277 A279 A282 N373 L374 L375 K379 R380 R381 I384	S276-V377 WeakPolarHBondContact O-CG2 3.47Å; K277-V377 VanDerWaalsContact O-CG2 3.26Å; K277-V377 WeakPolarHBondContact O-CG2 3.44Å; A279-V377 HydrophobicContact CB-CG1 4.12Å; A282-V377 HydrophobicContact CB-CB 4.45Å; A282-V377 HydrophobicContact CB-CG1 3.95Å; N373-V377 WeakPolarHBondContact O-CG2 3.41Å; N373-V377 PolarHBondContact O-N 3.41Å; L374-V377 PolarHBondContact O-N 2.89Å; L375-V377 VanDerWaalsContact C-N 3.32Å; L375-V377 PolarHBondContact O-N 3.15Å; V377-K379 VanDerWaalsContact C-N 3.25Å; V377-K379 PolarHBondContact O-N 2.92Å; V377-R380 CarbonylContact O-C 3.44Å; V377-R380 WeakPolarHBondContact O-CA 3.33Å; V377-R380 WeakPolarHBondContact O-CB 3.44Å; V377-R380 PolarHBondContact O-N 3.16Å; V377-R381 PolarHBondContact O-N 3.11Å; V377-I384 HydrophobicContact CG1-CB 4.49Å; V377-I384 HydrophobicContact CG1-CD1 3.53Å; V377-I384 HydrophobicContact CG1-CG2 4.12Å
378	G	91.5	Very high	94.4	Very high	1 Å²	1	45.5 Å²	45.5	1%	0.01	20%	0.202	C	C	.	.	H	α-helix	trans	-59.2	-32.5	176.1	0	0	0	0	0	113.9	L374 L375 R380 R381	L374-G378 PolarHBondContact O-N 2.72Å; L375-G378 CarbonylContact O-C 3.3Å; L375-G378 PolarHBondContact O-N 2.8Å; G378-R380 VanDerWaalsContact C-N 3.32Å; G378-R381 CarbonylContact C-O 3.49Å; G378-R381 WeakPolarHBondContact CA-O 3.47Å; G378-R381 CarbonylContact O-C 3.54Å; G378-R381 PolarHBondContact O-N 3.33Å
379	K	89.6	Confident	94.3	Very high	182 Å²	182	44 Å²	44	79%	0.791	19%	0.193	S	C	*	.	H	α-helix	trans	-66.8	-32.8	172.8	-173.1	177.6	179.9	179.6	0	112.5	L375 R376 V377	L375-K379 PolarHBondContact O-N 2.79Å; R376-K379 PolarHBondContact O-N 3.31Å; V377-K379 VanDerWaalsContact C-N 3.25Å; V377-K379 PolarHBondContact O-N 2.92Å
380	R	90.1	Very high	94.1	Very high	195 Å²	195	45.6 Å²	45.6	74%	0.736	20%	0.196	S	C	*	.	H	α-helix	trans	-81.3	-32.9	175.6	-62.7	175.3	-177	178.6	-0.2	111.8	R376 V377 G378	R376-R380 PolarHBondContact O-N 2.88Å; V377-R380 CarbonylContact O-C 3.44Å; V377-R380 WeakPolarHBondContact O-CA 3.33Å; V377-R380 WeakPolarHBondContact O-CB 3.44Å; V377-R380 PolarHBondContact O-N 3.16Å; G378-R380 VanDerWaalsContact C-N 3.32Å
381	R	91.7	Very high	94	Very high	13 Å²	13	45.6 Å²	45.6	5%	0.049	20%	0.196	C	C	.	.			trans	-129.3	98.7	177	-91.1	-157.9	157.6	171.6	-4	111.7	V205 S206 I207 C211 V377 G378 Y383 I384	V205-R381 PolarHBondContact O-NH2 2.93Å; S206-R381 PolarHBondContact O-NH2 3.43Å; I207-R381 HydrophobicContact CB-CG 4.07Å; I207-R381 HydrophobicContact CG2-CG 4.23Å; C211-R381 PolarHBondContact SG-NH1 2.83Å; V377-R381 PolarHBondContact O-N 3.11Å; G378-R381 CarbonylContact C-O 3.49Å; G378-R381 WeakPolarHBondContact CA-O 3.47Å; G378-R381 CarbonylContact O-C 3.54Å; G378-R381 PolarHBondContact O-N 3.33Å; R381-Y383 PolarHBondContact O-N 2.93Å; R381-Y383 VanDerWaalsContact O-N 3.1Å; R381-I384 HydrophobicContact CB-CD1 4.1Å; R381-I384 HydrophobicContact CB-CG1 4.32Å; R381-I384 PolarHBondContact O-N 2.78Å
382	P	90.6	Very high	93.9	Very high	25 Å²	25	45.5 Å²	45.5	16%	0.162	20%	0.195	C	C	.	.	H	α-helix	trans	-55.3	-30.1	-178.2	-28	35	0	0	0	114.7	I207 L208 I384 K385 K386	I207-P382 WeakPolarHBondContact O-CD 2.89Å; L208-P382 HydrophobicContact CD2-CB 4.01Å; L208-P382 HydrophobicContact CD2-CG 4.11Å; P382-I384 VanDerWaalsContact C-N 3.3Å; P382-I384 PolarHBondContact O-N 2.65Å; P382-K385 WeakPolarHBondContact O-CB 3.18Å; P382-K385 PolarHBondContact O-N 3.29Å; P382-K386 WeakPolarHBondContact O-CG 3.43Å; P382-K386 PolarHBondContact O-N 3.28Å
383	Y	91.7	Very high	93.7	Very high	67 Å²	67	44 Å²	44	26%	0.263	19%	0.186	S	C	.	.	H	α-helix	trans	-54.9	-44.7	174.4	179	-97.7	0	0	0	112.5	Q283 R381 K386 L387	Q283-Y383 HydrophobicContact CG-CE1 4.32Å; R381-Y383 PolarHBondContact O-N 2.93Å; R381-Y383 VanDerWaalsContact O-N 3.1Å; Y383-K386 PolarHBondContact O-N 3.29Å; Y383-L387 HydrophobicContact CE1-CD2 4.41Å; Y383-L387 WeakPolarHBondContact O-CB 3.44Å; Y383-L387 PolarHBondContact O-N 3.01Å
384	I	94.1	Very high	93.5	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-68.9	-38.1	-178.7	-64	174.8	0	0	0	110.5	A279 A282 Q283 I286 V377 R381 P382 L387 L388	A279-I384 HydrophobicContact CB-CD1 3.71Å; A279-I384 VanDerWaalsContact O-CD1 3.25Å; A279-I384 WeakPolarHBondContact O-CD1 3.37Å; A282-I384 HydrophobicContact CB-CG2 4.31Å; Q283-I384 HydrophobicContact CB-CG1 4.43Å; I286-I384 HydrophobicContact CD1-CG2 3.76Å; V377-I384 HydrophobicContact CG1-CB 4.49Å; V377-I384 HydrophobicContact CG1-CD1 3.53Å; V377-I384 HydrophobicContact CG1-CG2 4.12Å; R381-I384 HydrophobicContact CB-CD1 4.1Å; R381-I384 HydrophobicContact CB-CG1 4.32Å; R381-I384 PolarHBondContact O-N 2.78Å; P382-I384 VanDerWaalsContact C-N 3.3Å; P382-I384 PolarHBondContact O-N 2.65Å; I384-L387 PolarHBondContact O-N 3.15Å; I384-L388 WeakPolarHBondContact O-CB 3.39Å; I384-L388 PolarHBondContact O-N 3.12Å
385	K	92.9	Very high	93.3	Very high	29 Å²	29	43.8 Å²	43.8	13%	0.126	19%	0.187	C	C	.	.	H	α-helix	trans	-58.4	-52.6	171.5	179.9	-165.7	167.2	-163.8	0	110	P382 L387 L388 F389 E507	P382-K385 WeakPolarHBondContact O-CB 3.18Å; P382-K385 PolarHBondContact O-N 3.29Å; K385-L387 VanDerWaalsContact C-N 3.28Å; K385-L387 PolarHBondContact O-N 3.04Å; K385-L388 PolarHBondContact O-N 2.82Å; K385-F389 HydrophobicContact CG-CD2 3.91Å; K385-F389 HydrophobicContact CG-CE2 3.92Å; K385-F389 WeakPolarHBondContact O-CB 3.25Å; K385-F389 WeakPolarHBondContact O-CD2 3.24Å; K385-F389 PolarHBondContact O-N 2.88Å; K385-E507 WeakPolarHBondContact CE-OE2 3.37Å; K385-E507 IonicContact NZ-OE1 3.67Å; K385-E507 IonicContact NZ-OE2 3.81Å; K385-E507 PolarHBondContact NZ-OE2 3.3Å
386	K	91.5	Very high	93.2	Very high	113 Å²	113	43.4 Å²	43.4	49%	0.491	19%	0.185	S	C	.	.	H	α-helix	trans	-56.7	-43.1	179.3	-71.5	-177.1	179.9	-172.7	0	111.5	P382 Y383 F389 K390	P382-K386 WeakPolarHBondContact O-CG 3.43Å; P382-K386 PolarHBondContact O-N 3.28Å; Y383-K386 PolarHBondContact O-N 3.29Å; K386-F389 PolarHBondContact O-N 3.15Å; K386-K390 VanDerWaalsContact O-CB 3.3Å; K386-K390 WeakPolarHBondContact O-CB 3.3Å; K386-K390 PolarHBondContact O-N 2.88Å
387	L	94	Very high	93	Very high	22 Å²	22	39.7 Å²	39.7	12%	0.115	17%	0.174	C	C	.	.	H	α-helix	trans	-63.7	-44.9	177.7	-171.1	67.3	0	0	0	112.4	Q283 I286 E287 F290 Y383 I384 K385 K390 W391	Q283-L387 HydrophobicContact CG-CD2 4.17Å; I286-L387 HydrophobicContact CB-CD2 4Å; I286-L387 HydrophobicContact CB-CG 4.32Å; I286-L387 HydrophobicContact CG2-CB 4.44Å; I286-L387 HydrophobicContact CG2-CD2 3.93Å; I286-L387 HydrophobicContact CG2-CG 3.68Å; E287-L387 HydrophobicContact CG-CD2 3.94Å; F290-L387 HydrophobicContact CE2-CD1 3.69Å; F290-L387 HydrophobicContact CE2-CG 4.09Å; F290-L387 HydrophobicContact CZ-CD1 4.13Å; Y383-L387 HydrophobicContact CE1-CD2 4.41Å; Y383-L387 WeakPolarHBondContact O-CB 3.44Å; Y383-L387 PolarHBondContact O-N 3.01Å; I384-L387 PolarHBondContact O-N 3.15Å; K385-L387 VanDerWaalsContact C-N 3.28Å; K385-L387 PolarHBondContact O-N 3.04Å; L387-K390 PolarHBondContact O-N 2.86Å; L387-W391 PolarHBondContact O-N 2.99Å; L387-W391 VanDerWaalsContact O-N 3.08Å
388	L	95.9	Very high	92.9	Very high	1 Å²	1	40.2 Å²	40.2	1%	0.005	18%	0.179	C	C	.	.	H	α-helix	trans	-62.8	-44.2	176.8	-179.4	63.6	0	0	0	111.7	I286 L309 F371 L374 L375 I384 K385 K390 W391 F392	I286-L388 HydrophobicContact CD1-CB 3.9Å; I286-L388 HydrophobicContact CD1-CD1 4.28Å; I286-L388 HydrophobicContact CG1-CD1 4.21Å; L309-L388 HydrophobicContact CD1-CD1 4.45Å; F371-L388 HydrophobicContact CD1-CD1 4.37Å; F371-L388 HydrophobicContact CE1-CD1 4.34Å; L374-L388 HydrophobicContact CB-CD2 3.96Å; L374-L388 HydrophobicContact CD1-CD1 4.23Å; L375-L388 HydrophobicContact CD2-CD2 3.85Å; L375-L388 HydrophobicContact CG-CD2 4.43Å; I384-L388 WeakPolarHBondContact O-CB 3.39Å; I384-L388 PolarHBondContact O-N 3.12Å; K385-L388 PolarHBondContact O-N 2.82Å; L388-K390 VanDerWaalsContact C-N 3.32Å; L388-K390 PolarHBondContact O-N 3.37Å; L388-W391 WeakPolarHBondContact O-CB 3.39Å; L388-W391 PolarHBondContact O-N 3.19Å; L388-W391 VanDerWaalsContact O-N 3.09Å; L388-F392 HydrophobicContact CD1-CE1 3.94Å; L388-F392 HydrophobicContact CD1-CE2 4.17Å; L388-F392 HydrophobicContact CD1-CZ 3.76Å; L388-F392 HydrophobicContact CD2-CE2 3.9Å; L388-F392 HydrophobicContact CD2-CZ 3.99Å; L388-F392 HydrophobicContact CG-CD2 4.2Å; L388-F392 HydrophobicContact CG-CE1 4.35Å; L388-F392 HydrophobicContact CG-CE2 3.68Å; L388-F392 HydrophobicContact CG-CZ 3.78Å; L388-F392 PolarHBondContact O-N 3.42Å
389	F	94.7	Very high	92.9	Very high	1 Å²	1	40.1 Å²	40.1	0%	0.004	18%	0.178	C	C	.	.	H	α-helix	trans	-69	-34.2	-179.1	-82.9	-120.6	0	0	0	111.3	L375 K385 K386 W391 F392 G393 V469 L504 E507 L508 L511	L375-F389 HydrophobicContact CD2-CE2 3.58Å; L375-F389 HydrophobicContact CD2-CZ 4.16Å; K385-F389 HydrophobicContact CG-CD2 3.91Å; K385-F389 HydrophobicContact CG-CE2 3.92Å; K385-F389 WeakPolarHBondContact O-CB 3.25Å; K385-F389 WeakPolarHBondContact O-CD2 3.24Å; K385-F389 PolarHBondContact O-N 2.88Å; K386-F389 PolarHBondContact O-N 3.15Å; F389-W391 VanDerWaalsContact C-N 3.29Å; F389-W391 PolarHBondContact O-N 3.11Å; F389-F392 HydrophobicContact CD2-CD2 4.36Å; F389-F392 HydrophobicContact CE2-CE2 4.48Å; F389-F392 PolarHBondContact O-N 3.35Å; F389-G393 PolarHBondContact O-N 3.42Å; F389-V469 HydrophobicContact CB-CG1 4.16Å; F389-V469 HydrophobicContact CB-CG2 3.86Å; F389-V469 HydrophobicContact CD1-CG1 4.14Å; F389-L504 HydrophobicContact CE1-CD1 4.28Å; F389-L504 HydrophobicContact CE2-CD1 4.05Å; F389-L504 HydrophobicContact CZ-CD1 3.44Å; F389-L504 VanDerWaalsContact CZ-CD1 3.44Å; F389-E507 HydrophobicContact CD1-CB 4.05Å; F389-E507 HydrophobicContact CE1-CB 3.48Å; F389-E507 VanDerWaalsContact CE1-CB 3.48Å; F389-E507 HydrophobicContact CE1-CG 4.35Å; F389-L508 HydrophobicContact CE1-CD2 4.36Å; F389-L508 HydrophobicContact CZ-CD2 3.81Å; F389-L508 HydrophobicContact CZ-CG 4.11Å; F389-L511 HydrophobicContact CD1-CD1 3.64Å; F389-L511 HydrophobicContact CE1-CD1 3.6Å; F389-L511 HydrophobicContact CG-CD1 4.4Å; F389-L511 HydrophobicContact CZ-CD1 4.38Å
390	K	93.1	Very high	92.8	Very high	89 Å²	89	35.5 Å²	35.5	39%	0.387	16%	0.158	S	C	.	.	H	α-helix	trans	-61.9	-36.5	169.3	-169.2	-179.5	-165.6	-176.2	0	112	F290 F294 K386 L387 L388 G394	F290-K390 HydrophobicContact CE1-CG 4.36Å; F290-K390 HydrophobicContact CZ-CB 4.28Å; F290-K390 HydrophobicContact CZ-CG 4.33Å; F294-K390 HydrophobicContact CE1-CD 4.26Å; F294-K390 HydrophobicContact CE1-CG 4.18Å; F294-K390 HydrophobicContact CZ-CG 4.42Å; K386-K390 VanDerWaalsContact O-CB 3.3Å; K386-K390 WeakPolarHBondContact O-CB 3.3Å; K386-K390 PolarHBondContact O-N 2.88Å; L387-K390 PolarHBondContact O-N 2.86Å; L388-K390 VanDerWaalsContact C-N 3.32Å; L388-K390 PolarHBondContact O-N 3.37Å; K390-G394 PolarHBondContact O-N 2.9Å
391	W	95.4	Very high	92.5	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-69.4	-47.5	175	-174.4	83	0	0	0	111.8	I286 S289 F290 F304 L309 L313 F371 L387 L388 F389 G393 G394 C395 F428 F432	I286-W391 HydrophobicContact CG2-CB 4.29Å; S289-W391 PolarHBondContact O-NE1 3.14Å; F290-W391 AromaticContact CD1-CD1 3.95Å; F290-W391 HydrophobicContact CE1-CB 3.91Å; F290-W391 HydrophobicContact CE1-CG 4.39Å; F290-W391 HydrophobicContact CE2-CB 4.08Å; F290-W391 HydrophobicContact CZ-CB 3.57Å; F290-W391 HydrophobicContact CZ-CG 4.32Å; F304-W391 AromaticContact CD1-CE2 3.92Å; F304-W391 HydrophobicContact CD1-CZ2 4.28Å; F304-W391 AromaticContact CD1-NE1 3.51Å; F304-W391 AromaticContact CE1-CD1 3.88Å; F304-W391 HydrophobicContact CE1-CG 4.49Å; F304-W391 AromaticContact CE1-NE1 3.79Å; L309-W391 HydrophobicContact CB-CH2 4Å; L309-W391 HydrophobicContact CB-CZ2 4.03Å; L309-W391 HydrophobicContact CB-CZ3 4.47Å; L309-W391 HydrophobicContact CD1-CD2 4.49Å; L309-W391 HydrophobicContact CD1-CE3 4.32Å; L309-W391 HydrophobicContact CD1-CZ3 4.44Å; L313-W391 HydrophobicContact CD1-CH2 3.83Å; L313-W391 HydrophobicContact CD1-CZ3 4.44Å; F371-W391 HydrophobicContact CE1-CZ3 4.34Å; F371-W391 HydrophobicContact CZ-CZ3 4.46Å; L387-W391 PolarHBondContact O-N 2.99Å; L387-W391 VanDerWaalsContact O-N 3.08Å; L388-W391 WeakPolarHBondContact O-CB 3.39Å; L388-W391 PolarHBondContact O-N 3.19Å; L388-W391 VanDerWaalsContact O-N 3.09Å; F389-W391 VanDerWaalsContact C-N 3.29Å; F389-W391 PolarHBondContact O-N 3.11Å; W391-G393 VanDerWaalsContact C-N 3.33Å; W391-G393 PolarHBondContact O-N 3.06Å; W391-G394 PolarHBondContact O-N 3.26Å; W391-C395 WeakPolarHBondContact O-CB 3.17Å; W391-C395 PolarHBondContact O-N 3.1Å; W391-F428 HydrophobicContact CH2-CZ 4.47Å; W391-F432 HydrophobicContact CH2-CD2 4.42Å; W391-F432 HydrophobicContact CH2-CE2 4.34Å; W391-F432 HydrophobicContact CZ3-CD2 4.24Å; W391-F432 AromaticContact CZ3-CE2 3.83Å; W391-F432 HydrophobicContact CZ3-CE2 3.83Å
392	F	96.4	Very high	92.2	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-55.5	-49.7	174	-67.7	-27.7	0	0	0	111.6	F371 L388 F389 C395 I396 F432 L436 L439 L511	F371-F392 AromaticContact CD1-CE1 3.89Å; F371-F392 HydrophobicContact CD1-CE1 3.89Å; F371-F392 AromaticContact CD1-CZ 3.7Å; F371-F392 HydrophobicContact CD1-CZ 3.7Å; F371-F392 AromaticContact CE1-CE1 3.64Å; F371-F392 HydrophobicContact CE1-CE1 3.64Å; F371-F392 AromaticContact CE1-CZ 3.96Å; F371-F392 HydrophobicContact CE1-CZ 3.96Å; L388-F392 HydrophobicContact CD1-CE1 3.94Å; L388-F392 HydrophobicContact CD1-CE2 4.17Å; L388-F392 HydrophobicContact CD1-CZ 3.76Å; L388-F392 HydrophobicContact CD2-CE2 3.9Å; L388-F392 HydrophobicContact CD2-CZ 3.99Å; L388-F392 HydrophobicContact CG-CD2 4.2Å; L388-F392 HydrophobicContact CG-CE1 4.35Å; L388-F392 HydrophobicContact CG-CE2 3.68Å; L388-F392 HydrophobicContact CG-CZ 3.78Å; L388-F392 PolarHBondContact O-N 3.42Å; F389-F392 HydrophobicContact CD2-CD2 4.36Å; F389-F392 HydrophobicContact CE2-CE2 4.48Å; F389-F392 PolarHBondContact O-N 3.35Å; F392-C395 PolarHBondContact O-N 2.96Å; F392-I396 WeakPolarHBondContact O-CG1 3.27Å; F392-I396 PolarHBondContact O-N 3.04Å; F392-F432 HydrophobicContact CB-CZ 4.48Å; F392-F432 AromaticContact CD1-CE2 3.76Å; F392-F432 HydrophobicContact CD1-CE2 3.76Å; F392-F432 HydrophobicContact CD1-CZ 4.24Å; F392-F432 HydrophobicContact CE1-CE2 4.29Å; F392-L436 HydrophobicContact CD1-CD2 4.21Å; F392-L436 HydrophobicContact CD2-CD2 3.89Å; F392-L436 HydrophobicContact CE1-CD2 4.16Å; F392-L436 HydrophobicContact CE2-CD2 3.83Å; F392-L436 HydrophobicContact CG-CD2 4.08Å; F392-L436 HydrophobicContact CZ-CD2 3.96Å; F392-L439 HydrophobicContact CE2-CD1 4.47Å; F392-L439 HydrophobicContact CZ-CD1 4.19Å; F392-L511 HydrophobicContact CB-CD1 4.28Å; F392-L511 HydrophobicContact CB-CD2 4.02Å; F392-L511 HydrophobicContact CD2-CD1 4Å
393	G	93.4	Very high	91.3	Very high	1 Å²	1	27.3 Å²	27.3	1%	0.01	13%	0.134	C	C	.	.	H	α-helix	trans	-61	-48.2	178.6	0	0	0	0	0	114.3	F389 W391 C395 I396 H397 V469	F389-G393 PolarHBondContact O-N 3.42Å; W391-G393 VanDerWaalsContact C-N 3.33Å; W391-G393 PolarHBondContact O-N 3.06Å; G393-C395 VanDerWaalsContact C-N 3.32Å; G393-C395 PolarHBondContact O-N 3.42Å; G393-I396 PolarHBondContact O-N 3.19Å; G393-H397 WeakPolarHBondContact O-CB 3.45Å; G393-H397 PolarHBondContact O-N 3.45Å; G393-V469 WeakPolarHBondContact CA-O 3.39Å
394	G	92.7	Very high	90.2	Very high	8 Å²	8	30.7 Å²	30.7	8%	0.082	15%	0.152	C	C	.	.	H	α-helix	trans	-59	-42.4	176.4	0	0	0	0	0	112.4	K390 W391 A398	K390-G394 PolarHBondContact O-N 2.9Å; W391-G394 PolarHBondContact O-N 3.26Å; G394-A398 VanDerWaalsContact O-CB 3.25Å; G394-A398 WeakPolarHBondContact O-CB 3.27Å; G394-A398 PolarHBondContact O-N 3.48Å
395	C	94.7	Very high	88.6	Confident	0 Å²	0	33 Å²	33	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-62.5	-45.9	177.1	-178.8	0	0	0	0	111.6	F304 W391 F392 G393 N399 F428 F432	F304-C395 HydrophobicContact CD1-CB 3.77Å; F304-C395 HydrophobicContact CE1-CB 3.92Å; F304-C395 HydrophobicContact CG-CB 4.15Å; F304-C395 HydrophobicContact CZ-CB 4.43Å; W391-C395 WeakPolarHBondContact O-CB 3.17Å; W391-C395 PolarHBondContact O-N 3.1Å; F392-C395 PolarHBondContact O-N 2.96Å; G393-C395 VanDerWaalsContact C-N 3.32Å; G393-C395 PolarHBondContact O-N 3.42Å; C395-N399 PolarHBondContact O-N 3.46Å; C395-N399 PolarHBondContact O-ND2 3.3Å; C395-F428 VanDerWaalsContact SG-CE1 3.59Å; C395-F432 HydrophobicContact CB-CZ 4.23Å
396	I	94.2	Very high	86.6	Confident	10 Å²	10	31.9 Å²	31.9	5%	0.051	16%	0.16	C	C	.	.	H	α-helix	trans	-64.4	-49	179.1	-69.9	167.5	0	0	0	110.9	F392 G393 A398 N399 K400 F432 L436 L470 L511 A514 A515 I518	F392-I396 WeakPolarHBondContact O-CG1 3.27Å; F392-I396 PolarHBondContact O-N 3.04Å; G393-I396 PolarHBondContact O-N 3.19Å; I396-A398 VanDerWaalsContact C-N 3.34Å; I396-A398 PolarHBondContact O-N 2.66Å; I396-N399 CarbonylContact O-C 3.56Å; I396-N399 PolarHBondContact O-N 3.47Å; I396-N399 VanDerWaalsContact O-N 3.14Å; I396-K400 PolarHBondContact O-N 3.22Å; I396-K400 VanDerWaalsContact O-N 3.1Å; I396-F432 HydrophobicContact CD1-CE1 4.14Å; I396-F432 HydrophobicContact CD1-CZ 4.29Å; I396-F432 HydrophobicContact CG1-CE1 3.7Å; I396-F432 HydrophobicContact CG1-CZ 4.03Å; I396-L436 HydrophobicContact CD1-CD1 4.27Å; I396-L470 HydrophobicContact CB-CD2 4.43Å; I396-L470 HydrophobicContact CD1-CD2 4.21Å; I396-L470 HydrophobicContact CG2-CD2 3.96Å; I396-L511 HydrophobicContact CD1-CD2 3.65Å; I396-A514 HydrophobicContact CD1-CB 4.16Å; I396-A514 HydrophobicContact CG2-CB 3.86Å; I396-A515 HydrophobicContact CD1-CB 4.45Å; I396-I518 HydrophobicContact CB-CD1 4.21Å; I396-I518 HydrophobicContact CG1-CD1 3.96Å; I396-I518 HydrophobicContact CG2-CD1 4.33Å
397	H	91.1	Very high	84.6	Confident	70 Å²	70	31.7 Å²	31.7	32%	0.324	16%	0.16	S	C	.	.	H	α-helix	trans	-60.7	-43.4	-179.5	-179.6	70.5	0	0	0	111.9	G393 N399 K400 P471 D472	G393-H397 WeakPolarHBondContact O-CB 3.45Å; G393-H397 PolarHBondContact O-N 3.45Å; H397-N399 PolarHBondContact O-N 3.01Å; H397-K400 PolarHBondContact CE1-NZ 3.17Å; H397-K400 WeakPolarHBondContact O-CB 3.37Å; H397-K400 VanDerWaalsContact O-CG 3.29Å; H397-K400 WeakPolarHBondContact O-CG 3.38Å; H397-K400 PolarHBondContact O-N 3.17Å; H397-P471 HydrophobicContact CB-CG 4.33Å; H397-D472 IonicContact CE1-OD1 3.49Å; H397-D472 IonicContact CE1-OD2 3.25Å; H397-D472 PolarHBondContact CE1-OD2 3.18Å; H397-D472 VanDerWaalsContact CE1-OD2 3.32Å; H397-D472 IonicContact CG-OD2 3.1Å; H397-D472 IonicContact ND1-OD1 2.68Å; H397-D472 IonicContact ND1-OD2 3.31Å; H397-D472 PolarHBondContact ND1-OD2 3.1Å
398	A	91.2	Very high	82.4	Confident	17 Å²	17	33.1 Å²	33.1	14%	0.14	17%	0.172	C	C	.	.	H	α-helix	trans	-62.1	-31.9	177.9	0	0	0	0	0	112.5	F299 P301 F304 G394 I396	F299-A398 HydrophobicContact CE2-CB 3.91Å; P301-A398 HydrophobicContact CB-CB 3.9Å; P301-A398 WeakPolarHBondContact CB-O 3.21Å; P301-A398 HydrophobicContact CG-CB 4.16Å; P301-A398 WeakPolarHBondContact CG-O 3.45Å; F304-A398 HydrophobicContact CD2-CB 4.25Å; F304-A398 HydrophobicContact CE2-CB 3.87Å; G394-A398 VanDerWaalsContact O-CB 3.25Å; G394-A398 WeakPolarHBondContact O-CB 3.27Å; G394-A398 PolarHBondContact O-N 3.48Å; I396-A398 VanDerWaalsContact C-N 3.34Å; I396-A398 PolarHBondContact O-N 2.66Å
399	N	91.4	Very high	79.8	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100	11.8	-177.8	-72.1	-77.8	0	0	0	113.9	C395 I396 H397 A401 R402 A424 L429 I518	C395-N399 PolarHBondContact O-N 3.46Å; C395-N399 PolarHBondContact O-ND2 3.3Å; I396-N399 CarbonylContact O-C 3.56Å; I396-N399 PolarHBondContact O-N 3.47Å; I396-N399 VanDerWaalsContact O-N 3.14Å; H397-N399 PolarHBondContact O-N 3.01Å; N399-A401 PolarHBondContact O-N 3.47Å; N399-A401 VanDerWaalsContact O-N 3.14Å; N399-R402 VanDerWaalsContact O-CB 3.3Å; N399-R402 WeakPolarHBondContact O-CB 3.48Å; N399-R402 WeakPolarHBondContact O-CG 3.42Å; N399-R402 PolarHBondContact O-N 3.16Å; N399-A424 VanDerWaalsContact OD1-CB 3.32Å; N399-A424 WeakPolarHBondContact OD1-CB 3.35Å; N399-A424 PolarHBondContact OD1-N 3.46Å; N399-L429 HydrophobicContact CB-CD1 4.47Å; N399-I518 HydrophobicContact CB-CD1 4.01Å; N399-I518 WeakPolarHBondContact O-CG2 3.42Å
400	K	87.7	Confident	77.3	Confident	84 Å²	84	43 Å²	43	37%	0.365	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-30.4	-174.8	71.6	-176.8	177.3	173.4	0	114.8	I396 H397 R402 G403 D472	I396-K400 PolarHBondContact O-N 3.22Å; I396-K400 VanDerWaalsContact O-N 3.1Å; H397-K400 PolarHBondContact CE1-NZ 3.17Å; H397-K400 WeakPolarHBondContact O-CB 3.37Å; H397-K400 VanDerWaalsContact O-CG 3.29Å; H397-K400 WeakPolarHBondContact O-CG 3.38Å; H397-K400 PolarHBondContact O-N 3.17Å; K400-R402 PolarHBondContact O-N 3.43Å; K400-R402 VanDerWaalsContact O-N 3.11Å; K400-G403 PolarHBondContact O-N 3.22Å; K400-D472 WeakPolarHBondContact CD-OD2 3.37Å; K400-D472 IonicContact NZ-OD1 3.82Å; K400-D472 PolarHBondContact NZ-OD1 2.64Å; K400-D472 IonicContact NZ-OD2 3.82Å; K400-D472 PolarHBondContact NZ-OD2 3.08Å
401	A	84.5	Confident	74.6	Confident	42 Å²	42	44.6 Å²	44.6	35%	0.347	24%	0.235	S	C	.	.	H	α-helix	trans	-57.8	-25.2	176.5	0	0	0	0	0	112.6	N399 G403 Q404 L423	N399-A401 PolarHBondContact O-N 3.47Å; N399-A401 VanDerWaalsContact O-N 3.14Å; A401-G403 VanDerWaalsContact C-N 3.33Å; A401-G403 PolarHBondContact O-N 3.02Å; A401-Q404 PolarHBondContact O-N 3.3Å; A401-L423 HydrophobicContact CB-CD2 4.45Å
402	R	84.6	Confident	71.9	Confident	17 Å²	17	50 Å²	50	6%	0.064	26%	0.26	C	S	.	.	H	α-helix	trans	-64.4	-36.8	176	-65.5	-175.4	58.5	102.5	11.3	112.7	N399 K400 Q404 L405 L423 A424 D426 I518 S522	N399-R402 VanDerWaalsContact O-CB 3.3Å; N399-R402 WeakPolarHBondContact O-CB 3.48Å; N399-R402 WeakPolarHBondContact O-CG 3.42Å; N399-R402 PolarHBondContact O-N 3.16Å; K400-R402 PolarHBondContact O-N 3.43Å; K400-R402 VanDerWaalsContact O-N 3.11Å; R402-Q404 PolarHBondContact O-N 3.23Å; R402-L405 VanDerWaalsContact O-CB 3.28Å; R402-L405 WeakPolarHBondContact O-CB 3.46Å; R402-L405 PolarHBondContact O-N 3.05Å; R402-L423 HydrophobicContact CG-CB 4.44Å; R402-L423 HydrophobicContact CG-CD1 3.83Å; R402-L423 HydrophobicContact CG-CG 4.5Å; R402-A424 PolarHBondContact NH1-O 2.95Å; R402-D426 IonicContact CZ-OD1 3.81Å; R402-D426 IonicContact NH1-OD1 2.91Å; R402-D426 PolarHBondContact NH1-OD1 2.67Å; R402-D426 IonicContact NH2-OD1 3.83Å; R402-D426 PolarHBondContact NH2-OD1 3.34Å; R402-I518 HydrophobicContact CB-CB 4.28Å; R402-I518 PolarHBondContact NE-O 3.17Å; R402-S522 VanDerWaalsContact C-OG 3.31Å; R402-S522 PolarHBondContact O-OG 3.11Å
403	G	71.9	Confident	69.2	Low	3 Å²	3	54.7 Å²	54.7	3%	0.031	29%	0.285	C	S	.	.	H	α-helix	trans	-60.2	-29.9	176.1	0	0	0	0	0	113	K400 A401 H407	K400-G403 PolarHBondContact O-N 3.22Å; A401-G403 VanDerWaalsContact C-N 3.33Å; A401-G403 PolarHBondContact O-N 3.02Å; G403-H407 PolarHBondContact O-CD2 2.84Å
404	Q	68.1	Low	66.4	Low	138 Å²	138	59.6 Å²	59.6	65%	0.645	31%	0.31	S	S	*	.	H	α-helix	trans	-76.4	-24.3	177.1	-62.2	176.2	-15.1	0	0	112.8	A401 R402 A406 H407 S408	A401-Q404 PolarHBondContact O-N 3.3Å; R402-Q404 PolarHBondContact O-N 3.23Å; Q404-A406 PolarHBondContact O-N 3.49Å; Q404-H407 PolarHBondContact O-N 3.37Å; Q404-S408 PolarHBondContact O-OG 3.46Å; Q404-S408 VanDerWaalsContact O-OG 3.08Å
405	L	61.2	Low	64	Low	49 Å²	49	61.4 Å²	61.4	26%	0.257	32%	0.318	S	S	.	.	H	α-helix	trans	-64.7	-32	175.8	-59.2	175.1	0	0	0	111.3	R402 H407 S408 L415	R402-L405 VanDerWaalsContact O-CB 3.28Å; R402-L405 WeakPolarHBondContact O-CB 3.46Å; R402-L405 PolarHBondContact O-N 3.05Å; L405-H407 VanDerWaalsContact C-N 3.3Å; L405-H407 PolarHBondContact O-N 3Å; L405-S408 PolarHBondContact O-N 3Å; L405-L415 HydrophobicContact CB-CD2 4.34Å; L405-L415 HydrophobicContact CD1-CD2 3.94Å; L405-L415 HydrophobicContact CD2-CD2 3.86Å; L405-L415 HydrophobicContact CG-CD2 4.26Å
406	A	51.1	Low	61.5	Low	4 Å²	4	64.1 Å²	64.1	3%	0.033	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67	-29.3	179.2	0	0	0	0	0	113.3	Q404 I409 A525	Q404-A406 PolarHBondContact O-N 3.49Å; A406-I409 WeakPolarHBondContact O-CD1 3.46Å; A406-I409 VanDerWaalsContact O-CG1 3.25Å; A406-I409 WeakPolarHBondContact O-CG1 3.45Å; A406-A525 HydrophobicContact CB-CB 4.13Å
407	H	48.6	Very low	58.8	Low	109 Å²	109	72 Å²	72	51%	0.505	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.9	-4.9	-179	-63.4	-71.2	0	0	0	113.7	G403 Q404 L405 I409	G403-H407 PolarHBondContact O-CD2 2.84Å; Q404-H407 PolarHBondContact O-N 3.37Å; L405-H407 VanDerWaalsContact C-N 3.3Å; L405-H407 PolarHBondContact O-N 3Å; H407-I409 VanDerWaalsContact C-N 3.29Å; H407-I409 PolarHBondContact O-N 3.45Å
408	S	49.2	Very low	56.3	Low	52 Å²	52	72.6 Å²	72.6	36%	0.364	38%	0.378	S	S	.	.			trans	-91.4	19.7	-177.5	-58.1	0	0	0	0	113.7	Q404 L405 M410 N411	Q404-S408 PolarHBondContact O-OG 3.46Å; Q404-S408 VanDerWaalsContact O-OG 3.08Å; L405-S408 PolarHBondContact O-N 3Å; S408-M410 PolarHBondContact O-N 3.38Å; S408-N411 PolarHBondContact O-N 3.2Å
409	I	41.6	Very low	54	Low	101 Å²	101	78 Å²	78	52%	0.518	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.9	-13.3	-168.9	-74.5	168.4	0	0	0	114.6	A406 H407 A525	A406-I409 WeakPolarHBondContact O-CD1 3.46Å; A406-I409 VanDerWaalsContact O-CG1 3.25Å; A406-I409 WeakPolarHBondContact O-CG1 3.45Å; H407-I409 VanDerWaalsContact C-N 3.29Å; H407-I409 PolarHBondContact O-N 3.45Å; I409-A525 HydrophobicContact CD1-CB 4.24Å; I409-A525 HydrophobicContact CG1-CB 4.31Å
410	M	41.4	Very low	52.4	Low	108 Å²	108	80.8 Å²	80.8	53%	0.532	42%	0.421	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.1	-11.9	178.9	-66.5	-149	146.9	0	0	116.1	S408 H412 E834 H837	S408-M410 PolarHBondContact O-N 3.38Å; M410-H412 PolarHBondContact O-N 3Å; M410-E834 HydrophobicContact SD-CG 4.34Å; M410-H837 VanDerWaalsContact CE-NE2 3.32Å; M410-H837 WeakPolarHBondContact CE-NE2 3.12Å
411	N	35.6	Very low	51.1	Low	123 Å²	123	79.7 Å²	79.7	66%	0.658	42%	0.423	S	S	*	.			trans	-96.3	93.5	178.9	-81.3	-22.6	0	0	0	111.5	S408 D413 L414	S408-N411 PolarHBondContact O-N 3.2Å; N411-D413 PolarHBondContact O-N 3.17Å; N411-L414 HydrophobicContact CB-CD1 4.37Å
412	H	39.8	Very low	50.8	Low	113 Å²	113	80.4 Å²	80.4	52%	0.523	42%	0.423	S	S	.	.	T	Hydrogen-bonded Turn	trans	-46.3	1.3	-171.6	-126	-103	0	0	0	119.5	M410 R536	M410-H412 PolarHBondContact O-N 3Å; H412-R536 PolarHBondContact CD2-NH2 2.92Å; H412-R536 PolarHBondContact CE1-NE 3.26Å; H412-R536 PolarHBondContact CE1-NH1 3.17Å; H412-R536 PolarHBondContact CE1-NH2 3.43Å; H412-R536 PolarHBondContact ND1-NH1 2.91Å; H412-R536 PolarHBondContact ND1-NH2 2.99Å; H412-R536 PolarHBondContact NE2-NH2 3.22Å
413	D	38.4	Very low	50.9	Low	100 Å²	100	80.6 Å²	80.6	54%	0.535	43%	0.425	S	S	.	.	T	Hydrogen-bonded Turn	trans	-146.1	-1.7	-165.4	-121.6	-3.7	0	0	0	116.8	N411 S416	N411-D413 PolarHBondContact O-N 3.17Å; D413-S416 PolarHBondContact O-OG 3.45Å
414	L	36.4	Very low	51.7	Low	104 Å²	104	80.4 Å²	80.4	55%	0.545	42%	0.424	S	S	.	.	H	α-helix	trans	-80.7	-24	-172.7	-73.9	172.4	0	0	0	114.5	N411	N411-L414 HydrophobicContact CB-CD1 4.37Å
415	L	40.6	Very low	52.7	Low	46 Å²	46	74.8 Å²	74.8	24%	0.241	40%	0.403	C	S	.	.	H	α-helix	trans	-81.7	-17.8	-178.2	-74.8	163.8	0	0	0	113	L405 E529	L405-L415 HydrophobicContact CB-CD2 4.34Å; L405-L415 HydrophobicContact CD1-CD2 3.94Å; L405-L415 HydrophobicContact CD2-CD2 3.86Å; L405-L415 HydrophobicContact CG-CD2 4.26Å; L415-E529 VanDerWaalsContact CD1-CD 3.41Å; L415-E529 HydrophobicContact CD1-CG 4.48Å; L415-E529 WeakPolarHBondContact CD1-OE2 3.41Å
416	S	43.4	Very low	54.1	Low	57 Å²	57	73 Å²	73	40%	0.399	39%	0.393	S	S	.	.	H	α-helix	trans	-87.4	-19.4	-177.6	78.2	0	0	0	0	114.3	D413	D413-S416 PolarHBondContact O-OG 3.45Å
417	R	37.4	Very low	56	Low	175 Å²	175	73 Å²	73	66%	0.66	39%	0.394	S	S	*	.	H	α-helix	trans	-127.4	-15.5	-151.8	-106.1	176.8	142.3	179.5	-7.1	122.2
418	S	38.1	Very low	58.3	Low	82 Å²	82	67.8 Å²	67.8	57%	0.573	37%	0.37	S	S	*	.	S	Bend	trans	-156.2	-22.6	-177.4	53.7	0	0	0	0	122.8
419	N	43.9	Very low	60.5	Low	132 Å²	132	65.3 Å²	65.3	71%	0.706	35%	0.352	S	S	*	.	S	Bend	trans	-132.2	7.4	-170.4	-81.2	-22	0	0	0	117.4
420	T	56.8	Low	63	Low	57 Å²	57	60.7 Å²	60.7	35%	0.35	33%	0.329	S	S	.	.			trans	-80	-21.9	-179.6	51.4	0	0	0	0	117.7	T422 L423	T420-T422 PolarHBondContact O-N 3.01Å; T420-L423 PolarHBondContact O-N 3.23Å; T420-L423 VanDerWaalsContact O-N 3.17Å
421	P	59.7	Low	65.7	Low	62 Å²	62	55.6 Å²	55.6	40%	0.403	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71	-13.9	-166.3	26.8	-33.5	0	0	0	114.2
422	T	78.5	Confident	68.6	Low	57 Å²	57	49.8 Å²	49.8	35%	0.35	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.1	-7.6	179.8	62.8	0	0	0	0	113.8	P301 D302 T420	P301-T422 WeakPolarHBondContact CB-O 3.45Å; P301-T422 VanDerWaalsContact CD-O 3.28Å; P301-T422 WeakPolarHBondContact CD-O 3.42Å; D302-T422 PolarHBondContact N-O 3.42Å; T420-T422 PolarHBondContact O-N 3.01Å
423	L	86.9	Confident	71.4	Confident	20 Å²	20	44.5 Å²	44.5	11%	0.105	25%	0.248	C	C	.	.	S	Bend	trans	-83.5	151.8	178	-62	174.6	0	0	0	110.4	P301 A401 R402 T420	P301-L423 HydrophobicContact CB-CD2 4.27Å; P301-L423 HydrophobicContact CG-CD2 4.12Å; A401-L423 HydrophobicContact CB-CD2 4.45Å; R402-L423 HydrophobicContact CG-CB 4.44Å; R402-L423 HydrophobicContact CG-CD1 3.83Å; R402-L423 HydrophobicContact CG-CG 4.5Å; T420-L423 PolarHBondContact O-N 3.23Å; T420-L423 VanDerWaalsContact O-N 3.17Å
424	A	89.8	Confident	74.2	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	23%	0.228	C	C	.	.	P	Polyproline II helix	trans	-65.6	148.6	176	0	0	0	0	0	111.1	E305 N399 R402 F428 L429	E305-A424 HydrophobicContact CG-CB 4.22Å; N399-A424 VanDerWaalsContact OD1-CB 3.32Å; N399-A424 WeakPolarHBondContact OD1-CB 3.35Å; N399-A424 PolarHBondContact OD1-N 3.46Å; R402-A424 PolarHBondContact NH1-O 2.95Å; A424-F428 HydrophobicContact CB-CD1 3.65Å; A424-F428 HydrophobicContact CB-CE1 4.05Å; A424-L429 HydrophobicContact CB-CD1 4.24Å; A424-L429 HydrophobicContact CB-CD2 4.41Å; A424-L429 HydrophobicContact CB-CG 4.19Å
425	G	88	Confident	77.2	Confident	20 Å²	20	35.5 Å²	35.5	21%	0.206	20%	0.203	C	C	.	.	P	Polyproline II helix	trans	-72.5	160.1	-177.3	0	0	0	0	0	113.1	E305 G427 F428 L429	E305-G425 PolarHBondContact OE1-N 3.34Å; G425-G427 PolarHBondContact O-N 3.23Å; G425-F428 PolarHBondContact O-N 3.41Å; G425-L429 PolarHBondContact O-N 2.72Å; G425-L429 VanDerWaalsContact O-N 3.07Å
426	D	90.1	Very high	79.9	Confident	10 Å²	10	33.3 Å²	33.3	5%	0.053	19%	0.191	C	C	.	.	H	α-helix	trans	-70.6	-34.8	-174.5	-47.9	-48.5	0	0	0	113.3	L318 R402 F428 L429 S430 L523 R526	L318-D426 HydrophobicContact CB-CB 4.35Å; L318-D426 HydrophobicContact CD1-CB 3.88Å; R402-D426 IonicContact CZ-OD1 3.81Å; R402-D426 IonicContact NH1-OD1 2.91Å; R402-D426 PolarHBondContact NH1-OD1 2.67Å; R402-D426 IonicContact NH2-OD1 3.83Å; R402-D426 PolarHBondContact NH2-OD1 3.34Å; D426-F428 VanDerWaalsContact C-N 3.29Å; D426-F428 PolarHBondContact O-N 3.16Å; D426-L429 PolarHBondContact O-N 3.46Å; D426-S430 WeakPolarHBondContact O-CA 3.09Å; D426-S430 WeakPolarHBondContact O-CB 3.33Å; D426-S430 PolarHBondContact O-N 2.91Å; D426-L523 HydrophobicContact CB-CD1 4.28Å; D426-R526 IonicContact OD1-CZ 2.68Å; D426-R526 IonicContact OD1-NH1 3.62Å; D426-R526 IonicContact OD1-NH2 2.71Å; D426-R526 PolarHBondContact OD1-NH2 3.42Å; D426-R526 IonicContact OD2-CZ 2.61Å; D426-R526 IonicContact OD2-NH1 3.06Å; D426-R526 PolarHBondContact OD2-NH1 3.39Å; D426-R526 IonicContact OD2-NH2 2.64Å; D426-R526 PolarHBondContact OD2-NH2 2.96Å
427	G	92.3	Very high	82.5	Confident	4 Å²	4	30.8 Å²	30.8	4%	0.041	17%	0.173	C	C	.	.	H	α-helix	trans	-55.8	-49.6	174.5	0	0	0	0	0	111.1	S316 G425 N431	S316-G427 VanDerWaalsContact OG-CA 3.31Å; S316-G427 WeakPolarHBondContact OG-CA 3.41Å; G425-G427 PolarHBondContact O-N 3.23Å; G427-N431 WeakPolarHBondContact O-CB 3.46Å; G427-N431 PolarHBondContact O-N 3.37Å; G427-N431 PolarHBondContact O-ND2 3.41Å
428	F	95.4	Very high	85.3	Confident	0 Å²	0	24.6 Å²	24.6	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-59.5	-52.3	176.5	171.2	-102.5	0	0	0	112	F304 E305 L313 V314 W391 C395 A424 G425 D426 S430 N431 F432	F304-F428 HydrophobicContact CB-CZ 4.4Å; E305-F428 HydrophobicContact CG-CB 4.23Å; E305-F428 HydrophobicContact CG-CD1 4.06Å; E305-F428 HydrophobicContact CG-CD2 4.2Å; E305-F428 HydrophobicContact CG-CG 3.88Å; E305-F428 WeakPolarHBondContact OE1-CB 3.26Å; L313-F428 HydrophobicContact CB-CD2 3.48Å; L313-F428 VanDerWaalsContact CB-CD2 3.48Å; L313-F428 HydrophobicContact CB-CE2 3.65Å; L313-F428 HydrophobicContact CD1-CD2 4.44Å; L313-F428 HydrophobicContact CD1-CE2 3.79Å; L313-F428 HydrophobicContact CG-CE2 4.39Å; L313-F428 WeakPolarHBondContact O-CA 3.46Å; V314-F428 HydrophobicContact CG1-CB 4.21Å; V314-F428 HydrophobicContact CG1-CD2 4.24Å; W391-F428 HydrophobicContact CH2-CZ 4.47Å; C395-F428 VanDerWaalsContact SG-CE1 3.59Å; A424-F428 HydrophobicContact CB-CD1 3.65Å; A424-F428 HydrophobicContact CB-CE1 4.05Å; G425-F428 PolarHBondContact O-N 3.41Å; D426-F428 VanDerWaalsContact C-N 3.29Å; D426-F428 PolarHBondContact O-N 3.16Å; F428-S430 PolarHBondContact O-N 3.43Å; F428-N431 PolarHBondContact O-N 2.98Å; F428-F432 VanDerWaalsContact O-CB 3.22Å; F428-F432 WeakPolarHBondContact O-CB 3.47Å; F428-F432 PolarHBondContact O-N 3.24Å
429	L	95.5	Very high	88.1	Confident	0 Å²	0	21.4 Å²	21.4	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-71.7	-30.1	-176.2	-67.9	173.6	0	0	0	113.5	N399 A424 G425 D426 F432 T433 I518	N399-L429 HydrophobicContact CB-CD1 4.47Å; A424-L429 HydrophobicContact CB-CD1 4.24Å; A424-L429 HydrophobicContact CB-CD2 4.41Å; A424-L429 HydrophobicContact CB-CG 4.19Å; G425-L429 PolarHBondContact O-N 2.72Å; G425-L429 VanDerWaalsContact O-N 3.07Å; D426-L429 PolarHBondContact O-N 3.46Å; L429-F432 HydrophobicContact CD2-CD1 4.5Å; L429-T433 VanDerWaalsContact O-CB 3.27Å; L429-T433 WeakPolarHBondContact O-CB 3.18Å; L429-T433 PolarHBondContact O-N 2.87Å; L429-T433 PolarHBondContact O-OG1 3.5Å; L429-I518 HydrophobicContact CD2-CD1 3.98Å; L429-I518 HydrophobicContact CD2-CG1 4.43Å
430	S	95.6	Very high	90.6	Very high	4 Å²	4	15.1 Å²	15.1	3%	0.028	9%	0.093	C	C	.	.	H	α-helix	trans	-64.5	-48.4	173	-178.1	0	0	0	0	110.3	D426 F428 T433 A434 S574 R580	D426-S430 WeakPolarHBondContact O-CA 3.09Å; D426-S430 WeakPolarHBondContact O-CB 3.33Å; D426-S430 PolarHBondContact O-N 2.91Å; F428-S430 PolarHBondContact O-N 3.43Å; S430-T433 PolarHBondContact O-N 3.35Å; S430-A434 WeakPolarHBondContact O-CB 3.31Å; S430-A434 PolarHBondContact O-N 3.37Å; S430-S574 PolarHBondContact OG-OG 3.19Å; S430-R580 PolarHBondContact OG-NH1 3.24Å
431	N	97	Very high	92.2	Very high	2 Å²	2	13.4 Å²	13.4	1%	0.011	9%	0.086	C	C	.	.	H	α-helix	trans	-65.3	-43.5	176.5	-65.3	-12	0	0	0	111.7	L313 S315 M363 G427 F428 T433 A434 V435 R580	L313-N431 HydrophobicContact CD2-CB 3.97Å; L313-N431 PolarHBondContact O-ND2 3.35Å; S315-N431 PolarHBondContact O-ND2 3.47Å; M363-N431 WeakPolarHBondContact CE-ND2 3.46Å; G427-N431 WeakPolarHBondContact O-CB 3.46Å; G427-N431 PolarHBondContact O-N 3.37Å; G427-N431 PolarHBondContact O-ND2 3.41Å; F428-N431 PolarHBondContact O-N 2.98Å; N431-T433 VanDerWaalsContact C-N 3.34Å; N431-T433 PolarHBondContact O-N 2.94Å; N431-A434 PolarHBondContact O-N 2.9Å; N431-V435 WeakPolarHBondContact O-CG2 3.45Å; N431-V435 PolarHBondContact O-N 3.21Å; N431-R580 PolarHBondContact OD1-NH1 3.38Å; N431-R580 PolarHBondContact OD1-NH2 2.67Å
432	F	98	Very high	93.8	Very high	0 Å²	0	13 Å²	13	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-58.7	-44.9	176.4	177.3	-105.6	0	0	0	112.2	L313 W391 F392 C395 I396 F428 L429 V435 L436 A515	L313-F432 HydrophobicContact CD1-CD2 4.18Å; W391-F432 HydrophobicContact CH2-CD2 4.42Å; W391-F432 HydrophobicContact CH2-CE2 4.34Å; W391-F432 HydrophobicContact CZ3-CD2 4.24Å; W391-F432 AromaticContact CZ3-CE2 3.83Å; W391-F432 HydrophobicContact CZ3-CE2 3.83Å; F392-F432 HydrophobicContact CB-CZ 4.48Å; F392-F432 AromaticContact CD1-CE2 3.76Å; F392-F432 HydrophobicContact CD1-CE2 3.76Å; F392-F432 HydrophobicContact CD1-CZ 4.24Å; F392-F432 HydrophobicContact CE1-CE2 4.29Å; C395-F432 HydrophobicContact CB-CZ 4.23Å; I396-F432 HydrophobicContact CD1-CE1 4.14Å; I396-F432 HydrophobicContact CD1-CZ 4.29Å; I396-F432 HydrophobicContact CG1-CE1 3.7Å; I396-F432 HydrophobicContact CG1-CZ 4.03Å; F428-F432 VanDerWaalsContact O-CB 3.22Å; F428-F432 WeakPolarHBondContact O-CB 3.47Å; F428-F432 PolarHBondContact O-N 3.24Å; L429-F432 HydrophobicContact CD2-CD1 4.5Å; F432-V435 PolarHBondContact O-N 2.88Å; F432-L436 HydrophobicContact CD1-CD1 4.05Å; F432-L436 HydrophobicContact CE1-CD1 3.41Å; F432-L436 VanDerWaalsContact CE1-CD1 3.41Å; F432-L436 HydrophobicContact CE1-CG 4.49Å; F432-L436 HydrophobicContact CE2-CD1 4Å; F432-L436 HydrophobicContact CE2-CG 4.47Å; F432-L436 HydrophobicContact CZ-CD1 3.39Å; F432-L436 HydrophobicContact CZ-CG 4.31Å; F432-L436 PolarHBondContact O-N 3.09Å; F432-A515 HydrophobicContact CD1-CB 4.14Å; F432-A515 HydrophobicContact CE1-CB 3.96Å
433	T	97.7	Very high	94.5	Very high	2 Å²	2	10.3 Å²	10.3	1%	0.012	7%	0.067	C	C	.	.	H	α-helix	trans	-63.5	-46.3	176.2	-58.1	0	0	0	0	111	L429 S430 N431 V435 L436 V437 A515 I516	L429-T433 VanDerWaalsContact O-CB 3.27Å; L429-T433 WeakPolarHBondContact O-CB 3.18Å; L429-T433 PolarHBondContact O-N 2.87Å; L429-T433 PolarHBondContact O-OG1 3.5Å; S430-T433 PolarHBondContact O-N 3.35Å; N431-T433 VanDerWaalsContact C-N 3.34Å; N431-T433 PolarHBondContact O-N 2.94Å; T433-V435 VanDerWaalsContact C-N 3.3Å; T433-V435 PolarHBondContact O-N 3.47Å; T433-L436 PolarHBondContact O-N 3.04Å; T433-V437 HydrophobicContact CG2-CG2 4.27Å; T433-V437 WeakPolarHBondContact O-CG2 3.22Å; T433-V437 PolarHBondContact O-N 2.88Å; T433-A515 HydrophobicContact CG2-CB 4.38Å; T433-A515 PolarHBondContact OG1-O 3.13Å; T433-A515 VanDerWaalsContact OG1-O 3.12Å; T433-I516 HydrophobicContact CG2-CB 4.33Å; T433-I516 HydrophobicContact CG2-CG1 3.7Å
434	A	97.6	Very high	94.8	Very high	12 Å²	12	10 Å²	10	10%	0.099	7%	0.066	C	C	.	.	H	α-helix	trans	-58.3	-42.7	178.5	0	0	0	0	0	111.8	S430 N431 R438 R580	S430-A434 WeakPolarHBondContact O-CB 3.31Å; S430-A434 PolarHBondContact O-N 3.37Å; N431-A434 PolarHBondContact O-N 2.9Å; A434-R438 VanDerWaalsContact O-CB 3.3Å; A434-R438 WeakPolarHBondContact O-CB 3.26Å; A434-R438 PolarHBondContact O-N 3.28Å; A434-R580 HydrophobicContact CB-CG 4.2Å
435	V	98	Very high	94.8	Very high	4 Å²	4	14.9 Å²	14.9	2%	0.024	10%	0.096	C	C	.	.	H	α-helix	trans	-59.7	-54.7	173.9	167.3	0	0	0	0	110.8	L313 L367 F371 N431 F432 T433 V437 R438 L439	L313-V435 HydrophobicContact CD2-CG2 4.13Å; L367-V435 HydrophobicContact CB-CG2 3.88Å; L367-V435 HydrophobicContact CD1-CG2 4.35Å; F371-V435 HydrophobicContact CB-CG1 3.97Å; F371-V435 HydrophobicContact CD1-CG1 4.39Å; F371-V435 HydrophobicContact CD2-CB 4.44Å; F371-V435 HydrophobicContact CD2-CG1 3.44Å; F371-V435 VanDerWaalsContact CD2-CG1 3.44Å; F371-V435 HydrophobicContact CD2-CG2 4.15Å; F371-V435 HydrophobicContact CE2-CG1 3.98Å; F371-V435 HydrophobicContact CE2-CG2 4.3Å; F371-V435 HydrophobicContact CG-CG1 3.68Å; N431-V435 WeakPolarHBondContact O-CG2 3.45Å; N431-V435 PolarHBondContact O-N 3.21Å; F432-V435 PolarHBondContact O-N 2.88Å; T433-V435 VanDerWaalsContact C-N 3.3Å; T433-V435 PolarHBondContact O-N 3.47Å; V435-V437 VanDerWaalsContact C-N 3.34Å; V435-V437 PolarHBondContact O-N 3.3Å; V435-R438 PolarHBondContact O-N 2.97Å; V435-R438 VanDerWaalsContact O-N 3.13Å; V435-L439 HydrophobicContact CG1-CD1 3.85Å; V435-L439 HydrophobicContact CG1-CG 4.15Å; V435-L439 VanDerWaalsContact O-CG 3.28Å; V435-L439 WeakPolarHBondContact O-CG 3.47Å; V435-L439 PolarHBondContact O-N 2.81Å
436	L	98.1	Very high	94.7	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-62.2	-40.2	-175.8	-74.9	176.5	0	0	0	112.8	F392 I396 F432 T433 L439 T440 L511 A512 A515	F392-L436 HydrophobicContact CD1-CD2 4.21Å; F392-L436 HydrophobicContact CD2-CD2 3.89Å; F392-L436 HydrophobicContact CE1-CD2 4.16Å; F392-L436 HydrophobicContact CE2-CD2 3.83Å; F392-L436 HydrophobicContact CG-CD2 4.08Å; F392-L436 HydrophobicContact CZ-CD2 3.96Å; I396-L436 HydrophobicContact CD1-CD1 4.27Å; F432-L436 HydrophobicContact CD1-CD1 4.05Å; F432-L436 HydrophobicContact CE1-CD1 3.41Å; F432-L436 VanDerWaalsContact CE1-CD1 3.41Å; F432-L436 HydrophobicContact CE1-CG 4.49Å; F432-L436 HydrophobicContact CE2-CD1 4Å; F432-L436 HydrophobicContact CE2-CG 4.47Å; F432-L436 HydrophobicContact CZ-CD1 3.39Å; F432-L436 HydrophobicContact CZ-CG 4.31Å; F432-L436 PolarHBondContact O-N 3.09Å; T433-L436 PolarHBondContact O-N 3.04Å; L436-L439 HydrophobicContact CD2-CD1 4.34Å; L436-L439 PolarHBondContact O-N 3.43Å; L436-T440 PolarHBondContact O-N 2.95Å; L436-L511 HydrophobicContact CD1-CB 4.49Å; L436-L511 HydrophobicContact CD2-CB 4.46Å; L436-A512 HydrophobicContact CB-CB 4.49Å; L436-A515 HydrophobicContact CB-CB 4.4Å; L436-A515 HydrophobicContact CD1-CB 3.5Å
437	V	98	Very high	94.1	Very high	3 Å²	3	18.8 Å²	18.8	2%	0.018	11%	0.112	C	C	.	.	H	α-helix	trans	-60.9	-47.6	173.8	172.5	0	0	0	0	110.2	T433 V435 L439 T440 V444 A512 I516 D583 F587	T433-V437 HydrophobicContact CG2-CG2 4.27Å; T433-V437 WeakPolarHBondContact O-CG2 3.22Å; T433-V437 PolarHBondContact O-N 2.88Å; V435-V437 VanDerWaalsContact C-N 3.34Å; V435-V437 PolarHBondContact O-N 3.3Å; V437-L439 VanDerWaalsContact C-N 3.33Å; V437-L439 PolarHBondContact O-N 3.05Å; V437-T440 WeakPolarHBondContact O-CB 3.24Å; V437-T440 PolarHBondContact O-N 2.96Å; V437-T440 VanDerWaalsContact O-N 3.08Å; V437-T440 PolarHBondContact O-OG1 3.06Å; V437-V444 HydrophobicContact CG1-CG2 4.06Å; V437-A512 HydrophobicContact CG2-CB 4.31Å; V437-I516 HydrophobicContact CG2-CD1 3.86Å; V437-I516 HydrophobicContact CG2-CG1 3.95Å; V437-D583 HydrophobicContact CG1-CB 4.26Å; V437-F587 HydrophobicContact CG1-CB 4.11Å; V437-F587 HydrophobicContact CG1-CG 4.33Å
438	R	96.5	Very high	93.5	Very high	45 Å²	45	25.3 Å²	25.3	17%	0.17	14%	0.142	C	C	.	.	H	α-helix	trans	-67.8	-30.2	-178.9	-168	171.6	-76.2	-174.7	-1.9	113.4	N368 A434 V435 T440 G441 D583	N368-R438 HydrophobicContact CB-CG 4.39Å; N368-R438 VanDerWaalsContact CG-CD 3.48Å; A434-R438 VanDerWaalsContact O-CB 3.3Å; A434-R438 WeakPolarHBondContact O-CB 3.26Å; A434-R438 PolarHBondContact O-N 3.28Å; V435-R438 PolarHBondContact O-N 2.97Å; V435-R438 VanDerWaalsContact O-N 3.13Å; R438-T440 PolarHBondContact O-N 3.43Å; R438-G441 WeakPolarHBondContact O-CA 3.43Å; R438-G441 PolarHBondContact O-N 3.31Å; R438-D583 IonicContact CZ-OD2 2.75Å; R438-D583 IonicContact NE-OD2 3.59Å; R438-D583 PolarHBondContact NE-OD2 3.11Å; R438-D583 IonicContact NH2-OD2 2.89Å; R438-D583 PolarHBondContact NH2-OD2 3.22Å
439	L	96.7	Very high	93	Very high	16 Å²	16	33.9 Å²	33.9	8%	0.084	18%	0.179	C	C	.	.	H	α-helix	trans	-64.9	-20.4	173.3	-69.7	177.7	0	0	0	112.8	F371 L375 F392 V435 L436 V437 G441 L508	F371-L439 HydrophobicContact CB-CD1 3.89Å; F371-L439 HydrophobicContact CB-CD2 3.95Å; F371-L439 HydrophobicContact CB-CG 4.39Å; L375-L439 HydrophobicContact CD1-CB 4.34Å; L375-L439 HydrophobicContact CD1-CD1 4.14Å; L375-L439 HydrophobicContact CD1-CD2 3.82Å; L375-L439 HydrophobicContact CD1-CG 4.3Å; F392-L439 HydrophobicContact CE2-CD1 4.47Å; F392-L439 HydrophobicContact CZ-CD1 4.19Å; V435-L439 HydrophobicContact CG1-CD1 3.85Å; V435-L439 HydrophobicContact CG1-CG 4.15Å; V435-L439 VanDerWaalsContact O-CG 3.28Å; V435-L439 WeakPolarHBondContact O-CG 3.47Å; V435-L439 PolarHBondContact O-N 2.81Å; L436-L439 HydrophobicContact CD2-CD1 4.34Å; L436-L439 PolarHBondContact O-N 3.43Å; V437-L439 VanDerWaalsContact C-N 3.33Å; V437-L439 PolarHBondContact O-N 3.05Å; L439-G441 PolarHBondContact O-N 3.32Å; L439-L508 HydrophobicContact CB-CD1 4.34Å; L439-L508 HydrophobicContact CB-CD2 4.23Å; L439-L508 WeakPolarHBondContact O-CD1 3.47Å
440	T	96.3	Very high	92.7	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-7.2	171	74.6	0	0	0	0	113.5	L436 V437 R438 P442 L443 L505 L508 A512 F587	L436-T440 PolarHBondContact O-N 2.95Å; V437-T440 WeakPolarHBondContact O-CB 3.24Å; V437-T440 PolarHBondContact O-N 2.96Å; V437-T440 VanDerWaalsContact O-N 3.08Å; V437-T440 PolarHBondContact O-OG1 3.06Å; R438-T440 PolarHBondContact O-N 3.43Å; T440-P442 WeakPolarHBondContact O-CD 3.37Å; T440-L443 PolarHBondContact O-N 2.89Å; T440-L505 WeakPolarHBondContact O-CD1 3.37Å; T440-L508 HydrophobicContact CG2-CB 4.25Å; T440-A512 HydrophobicContact CG2-CB 3.83Å; T440-F587 HydrophobicContact CG2-CD2 4.41Å; T440-F587 HydrophobicContact CG2-CE2 3.84Å
441	G	91.3	Very high	92.6	Very high	20 Å²	20	36.7 Å²	36.7	21%	0.206	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	40.9	-92	165.2	0	0	0	0	0	114.7	R438 L439 L443 V444 T445	R438-G441 WeakPolarHBondContact O-CA 3.43Å; R438-G441 PolarHBondContact O-N 3.31Å; L439-G441 PolarHBondContact O-N 3.32Å; G441-L443 PolarHBondContact O-N 2.95Å; G441-L443 VanDerWaalsContact O-N 3.07Å; G441-V444 PolarHBondContact O-N 3.32Å; G441-T445 PolarHBondContact O-N 2.98Å; G441-T445 PolarHBondContact O-OG1 3.39Å; G441-T445 VanDerWaalsContact O-OG1 3.12Å
442	P	91.5	Very high	92.3	Very high	55 Å²	55	37.4 Å²	37.4	36%	0.357	20%	0.201	S	C	.	.	H	α-helix	trans	-49.6	-29.7	177.8	-28.5	34.2	0	0	0	116.1	T440 V444 L446 P451	T440-P442 WeakPolarHBondContact O-CD 3.37Å; P442-V444 VanDerWaalsContact C-N 3.3Å; P442-L446 WeakPolarHBondContact O-CB 3.17Å; P442-L446 PolarHBondContact O-N 3.32Å; P442-P451 HydrophobicContact CB-CG 3.66Å
443	L	94.2	Very high	91.9	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-77	-18.5	179.2	-56.1	-177.5	0	0	0	113.2	T440 G441 P450 I455 L505 F509 F587 T590	T440-L443 PolarHBondContact O-N 2.89Å; G441-L443 PolarHBondContact O-N 2.95Å; G441-L443 VanDerWaalsContact O-N 3.07Å; L443-P450 HydrophobicContact CD2-CB 4.07Å; L443-I455 HydrophobicContact CD1-CD1 3.76Å; L443-I455 HydrophobicContact CD1-CG1 4.42Å; L443-I455 HydrophobicContact CD2-CD1 3.9Å; L443-L505 HydrophobicContact CD1-CD1 3.99Å; L443-L505 HydrophobicContact CD1-CD2 4.42Å; L443-L505 HydrophobicContact CD1-CG 4.14Å; L443-L505 HydrophobicContact CD2-CD2 3.95Å; L443-L505 HydrophobicContact CG-CD1 4.01Å; L443-L505 HydrophobicContact CG-CD2 4.11Å; L443-L505 HydrophobicContact CG-CG 4.28Å; L443-F509 HydrophobicContact CD1-CB 4.43Å; L443-F509 HydrophobicContact CD1-CD2 4.03Å; L443-F587 HydrophobicContact CB-CD2 4.24Å; L443-F587 HydrophobicContact CD1-CE2 4.04Å; L443-T590 HydrophobicContact CB-CG2 3.88Å; L443-T590 HydrophobicContact CD2-CG2 3.68Å; L443-T590 HydrophobicContact CG-CG2 4.25Å; L443-T590 WeakPolarHBondContact O-CB 3.32Å; L443-T590 PolarHBondContact O-OG1 2.98Å
444	V	93.5	Very high	91.7	Very high	12 Å²	12	47.1 Å²	47.1	7%	0.073	25%	0.247	C	C	.	.	H	α-helix	trans	-103.4	-38.9	-178.6	174.5	0	0	0	0	111.3	V437 G441 P442 D583 S586 F587	V437-V444 HydrophobicContact CG1-CG2 4.06Å; G441-V444 PolarHBondContact O-N 3.32Å; P442-V444 VanDerWaalsContact C-N 3.3Å; V444-D583 HydrophobicContact CG1-CB 3.86Å; V444-D583 VanDerWaalsContact CG1-OD1 3.31Å; V444-D583 WeakPolarHBondContact CG1-OD1 3.43Å; V444-S586 WeakPolarHBondContact CA-OG 3.26Å; V444-S586 WeakPolarHBondContact O-CB 3.16Å; V444-S586 PolarHBondContact O-OG 3.14Å; V444-F587 HydrophobicContact CG2-CB 4.15Å; V444-F587 HydrophobicContact CG2-CD2 4.48Å
445	T	90.3	Very high	91.4	Very high	103 Å²	103	46.6 Å²	46.6	63%	0.632	24%	0.243	S	C	*	.	H	α-helix	trans	-88	-18.9	-174.4	58.9	0	0	0	0	114.2	G441 P447	G441-T445 PolarHBondContact O-N 2.98Å; G441-T445 PolarHBondContact O-OG1 3.39Å; G441-T445 VanDerWaalsContact O-OG1 3.12Å; T445-P447 WeakPolarHBondContact O-CD 3.23Å
446	L	85.8	Confident	91.2	Very high	99 Å²	99	48.2 Å²	48.2	52%	0.518	25%	0.248	S	C	.	.			trans	-123	61.9	-178.1	-61	171.3	0	0	0	111.9	P442 E448 K449 P450	P442-L446 WeakPolarHBondContact O-CB 3.17Å; P442-L446 PolarHBondContact O-N 3.32Å; L446-E448 PolarHBondContact O-N 2.96Å; L446-K449 CarbonylContact O-C 3.6Å; L446-K449 PolarHBondContact O-N 3.37Å; L446-P450 WeakPolarHBondContact O-CD 3.38Å; L446-P450 VanDerWaalsContact O-N 3.16Å
447	P	77.1	Confident	90.9	Very high	13 Å²	13	48.2 Å²	48.2	8%	0.084	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67	-19.4	-173.1	28.4	-36.5	0	0	0	114.4	T445 R593 I662	T445-P447 WeakPolarHBondContact O-CD 3.23Å; P447-R593 PolarHBondContact O-NE 3.25Å; P447-I662 HydrophobicContact CB-CG2 4.46Å; P447-I662 HydrophobicContact CG-CG1 4.25Å
448	E	78.5	Confident	90.5	Very high	141 Å²	141	50.8 Å²	50.8	66%	0.659	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.1	-39.6	176.4	-68.8	-170.4	167.8	0	0	113.1	L446	L446-E448 PolarHBondContact O-N 2.96Å
449	K	86.8	Confident	90.2	Very high	181 Å²	181	49.3 Å²	49.3	79%	0.787	25%	0.254	S	S	*	.	S	Bend	trans	-138.2	64.8	-176.8	-66.1	-173.2	-179.1	-177.8	0	111.7	L446	L446-K449 CarbonylContact O-C 3.6Å; L446-K449 PolarHBondContact O-N 3.37Å
450	P	88.9	Confident	89.8	Confident	16 Å²	16	48.7 Å²	48.7	10%	0.104	25%	0.252	C	S	.	.			trans	-69.1	148.1	177.6	27	-31.9	0	0	0	110.7	L443 L446 L452 T590	L443-P450 HydrophobicContact CD2-CB 4.07Å; L446-P450 WeakPolarHBondContact O-CD 3.38Å; L446-P450 VanDerWaalsContact O-N 3.16Å; P450-L452 HydrophobicContact CB-CD2 4Å; P450-L452 HydrophobicContact CB-CG 4.42Å; P450-L452 HydrophobicContact CG-CD1 4.44Å; P450-L452 HydrophobicContact CG-CD2 3.7Å; P450-L452 HydrophobicContact CG-CG 3.94Å; P450-L452 PolarHBondContact O-N 3.48Å; P450-T590 HydrophobicContact CB-CG2 3.52Å; P450-T590 HydrophobicContact CG-CG2 3.68Å
451	P	92.5	Very high	89.3	Confident	46 Å²	46	50.9 Å²	50.9	30%	0.299	27%	0.265	S	S	.	.			trans	-76.2	65.7	179	32.9	-37.2	0	0	0	111.7	P442 D453 K454 L505	P442-P451 HydrophobicContact CB-CG 3.66Å; P451-D453 PolarHBondContact O-N 3.03Å; P451-K454 HydrophobicContact CB-CG 4.29Å; P451-K454 WeakPolarHBondContact O-CB 3.4Å; P451-K454 PolarHBondContact O-N 3.11Å; P451-K454 VanDerWaalsContact O-N 3.11Å; P451-L505 HydrophobicContact CG-CD2 3.83Å
452	L	91.7	Very high	88.9	Confident	18 Å²	18	52.1 Å²	52.1	9%	0.094	27%	0.267	C	S	.	.	G	3₁₀ helix	trans	-58.6	-34.2	-173.5	-61.3	-178.3	0	0	0	112.7	P450 K454 I455 T590 R593 L594 K597 F623	P450-L452 HydrophobicContact CB-CD2 4Å; P450-L452 HydrophobicContact CB-CG 4.42Å; P450-L452 HydrophobicContact CG-CD1 4.44Å; P450-L452 HydrophobicContact CG-CD2 3.7Å; P450-L452 HydrophobicContact CG-CG 3.94Å; P450-L452 PolarHBondContact O-N 3.48Å; L452-K454 PolarHBondContact O-N 3.37Å; L452-I455 HydrophobicContact CD2-CD1 4.39Å; L452-I455 PolarHBondContact O-N 2.92Å; L452-T590 HydrophobicContact CD2-CG2 3.87Å; L452-R593 HydrophobicContact CD1-CB 4.02Å; L452-L594 HydrophobicContact CB-CD1 4.33Å; L452-L594 HydrophobicContact CD2-CB 4.15Å; L452-K597 HydrophobicContact CD1-CD 4.29Å; L452-F623 WeakPolarHBondContact O-CZ 3.48Å
453	D	89.8	Confident	87.7	Confident	86 Å²	86	53.4 Å²	53.4	46%	0.46	28%	0.278	S	S	.	.	G	3₁₀ helix	trans	-64.2	-9.1	-179.1	-49.1	-34.4	0	0	0	113.6	P451 W456 K597	P451-D453 PolarHBondContact O-N 3.03Å; D453-W456 PolarHBondContact O-NE1 3.39Å; D453-K597 IonicContact OD1-NZ 3.91Å; D453-K597 PolarHBondContact OD1-NZ 3.16Å
454	K	91.7	Very high	86	Confident	120 Å²	120	58.7 Å²	58.7	52%	0.522	31%	0.313	S	S	.	.	G	3₁₀ helix	trans	-93.3	-0.7	174.1	-59.6	-57.9	-175.1	-173.1	0	113.7	P451 L452 P503 L505 T506	P451-K454 HydrophobicContact CB-CG 4.29Å; P451-K454 WeakPolarHBondContact O-CB 3.4Å; P451-K454 PolarHBondContact O-N 3.11Å; P451-K454 VanDerWaalsContact O-N 3.11Å; L452-K454 PolarHBondContact O-N 3.37Å; K454-P503 WeakPolarHBondContact O-CB 3.32Å; K454-L505 HydrophobicContact CB-CB 4.45Å; K454-L505 HydrophobicContact CB-CD2 4.13Å; K454-T506 PolarHBondContact O-OG1 3.32Å
455	I	93.1	Very high	84.2	Confident	1 Å²	1	59.8 Å²	59.8	1%	0.005	32%	0.32	C	S	.	.			trans	-102.2	111.8	173.1	-55.6	171.4	0	0	0	106.9	L443 L452 P457 T506 F509 L594 F623	L443-I455 HydrophobicContact CD1-CD1 3.76Å; L443-I455 HydrophobicContact CD1-CG1 4.42Å; L443-I455 HydrophobicContact CD2-CD1 3.9Å; L452-I455 HydrophobicContact CD2-CD1 4.39Å; L452-I455 PolarHBondContact O-N 2.92Å; I455-P457 VanDerWaalsContact O-CD 3.23Å; I455-P457 WeakPolarHBondContact O-CD 3.43Å; I455-T506 WeakPolarHBondContact CA-OG1 3.36Å; I455-F509 HydrophobicContact CD1-CD2 3.99Å; I455-F509 HydrophobicContact CD1-CE2 4.37Å; I455-F509 HydrophobicContact CD1-CG 4.31Å; I455-F509 HydrophobicContact CG2-CB 4.39Å; I455-F509 HydrophobicContact CG2-CD1 3.67Å; I455-F509 HydrophobicContact CG2-CD2 4.49Å; I455-F509 HydrophobicContact CG2-CE1 4.03Å; I455-F509 HydrophobicContact CG2-CG 3.93Å; I455-L594 HydrophobicContact CB-CD2 4.22Å; I455-L594 HydrophobicContact CD1-CD2 4.05Å; I455-L594 HydrophobicContact CG2-CD2 3.73Å; I455-F623 VanDerWaalsContact O-CE1 3.27Å; I455-F623 WeakPolarHBondContact O-CE1 3.32Å
456	W	93.1	Very high	82.5	Confident	38 Å²	38	60.3 Å²	60.3	14%	0.144	32%	0.319	C	S	.	.			trans	-102.4	105.2	-176.7	-65.1	-2.8	0	0	0	110.7	D453 E458 Y459 Y502 P503 T506 H625	D453-W456 PolarHBondContact O-NE1 3.39Å; W456-E458 HydrophobicContact CB-CG 4.37Å; W456-E458 PolarHBondContact O-N 3.18Å; W456-Y459 VanDerWaalsContact O-CB 3.31Å; W456-Y459 WeakPolarHBondContact O-CB 3.38Å; W456-Y459 PolarHBondContact O-N 3.43Å; W456-Y459 VanDerWaalsContact O-N 3.16Å; W456-Y502 HydrophobicContact CB-CD1 4.19Å; W456-Y502 HydrophobicContact CB-CE1 4.27Å; W456-Y502 HydrophobicContact CD2-CD1 4.32Å; W456-Y502 AromaticContact CE3-CD1 3.52Å; W456-Y502 HydrophobicContact CE3-CD1 3.52Å; W456-Y502 AromaticContact CE3-CE1 3.79Å; W456-Y502 HydrophobicContact CE3-CE1 3.79Å; W456-Y502 HydrophobicContact CE3-CG 4.47Å; W456-Y502 HydrophobicContact CZ3-CD1 4.26Å; W456-P503 HydrophobicContact CD2-CG 3.82Å; W456-P503 HydrophobicContact CE3-CG 4.25Å; W456-P503 HydrophobicContact CG-CG 4.35Å; W456-P503 HydrophobicContact CH2-CG 4.09Å; W456-P503 HydrophobicContact CZ2-CG 3.66Å; W456-P503 HydrophobicContact CZ3-CG 4.36Å; W456-T506 HydrophobicContact CB-CG2 4.15Å; W456-T506 PolarHBondContact N-OG1 2.64Å; W456-T506 WeakPolarHBondContact O-CG2 3.46Å; W456-H625 HydrophobicContact CB-CB 3.84Å; W456-H625 AromaticContact CD1-CG 3.91Å; W456-H625 HydrophobicContact CD2-CB 3.74Å; W456-H625 AromaticContact CD2-CG 3.61Å; W456-H625 AromaticContact CD2-ND1 3.86Å; W456-H625 AromaticContact CE2-CD2 3.49Å; W456-H625 VanDerWaalsContact CE2-CD2 3.49Å; W456-H625 AromaticContact CE2-CG 3.57Å; W456-H625 AromaticContact CE2-ND1 3.95Å; W456-H625 AromaticContact CE2-NE2 3.91Å; W456-H625 HydrophobicContact CE3-CB 4.37Å; W456-H625 AromaticContact CE3-ND1 3.85Å; W456-H625 HydrophobicContact CG-CB 3.45Å; W456-H625 VanDerWaalsContact CG-CB 3.45Å; W456-H625 AromaticContact CG-CG 3.87Å; W456-H625 AromaticContact CH2-CE1 3.83Å; W456-H625 AromaticContact CZ2-CD2 3.77Å; W456-H625 AromaticContact CZ2-CE1 3.82Å; W456-H625 AromaticContact CZ2-NE2 3.66Å; W456-H625 AromaticContact CZ3-ND1 3.99Å; W456-H625 AromaticContact NE1-CD2 3.5Å; W456-H625 AromaticContact NE1-CG 3.74Å
457	P	92.1	Very high	81.3	Confident	0 Å²	0	64.8 Å²	64.8	0%	0	33%	0.329	C	S	.	.	G	3₁₀ helix	trans	-50.7	-36.8	178	-32.2	34	0	0	0	115.2	I455 Y459 A460 L598 H625 C627 D630 L631	I455-P457 VanDerWaalsContact O-CD 3.23Å; I455-P457 WeakPolarHBondContact O-CD 3.43Å; P457-Y459 PolarHBondContact O-N 3.22Å; P457-A460 PolarHBondContact O-N 2.87Å; P457-L598 HydrophobicContact CG-CD1 3.82Å; P457-L598 HydrophobicContact CG-CD2 4.44Å; P457-H625 WeakPolarHBondContact CD-O 3.38Å; P457-C627 WeakPolarHBondContact CB-O 3.38Å; P457-D630 HydrophobicContact CB-CB 3.91Å; P457-D630 WeakPolarHBondContact O-CB 3.03Å; P457-L631 HydrophobicContact CB-CD2 3.84Å; P457-L631 HydrophobicContact CB-CG 4.03Å; P457-L631 HydrophobicContact CG-CD2 4.23Å; P457-L631 HydrophobicContact CG-CG 4.38Å
458	E	89.4	Confident	80.7	Confident	56 Å²	56	66.6 Å²	66.6	26%	0.262	34%	0.34	S	S	.	.	G	3₁₀ helix	trans	-57.8	-20.4	-178.2	69	-170.2	166.9	0	0	113.6	W456 A460 T461 D462 Y502 H625	W456-E458 HydrophobicContact CB-CG 4.37Å; W456-E458 PolarHBondContact O-N 3.18Å; E458-A460 PolarHBondContact O-N 3.17Å; E458-A460 VanDerWaalsContact O-N 3.15Å; E458-T461 PolarHBondContact O-N 3.47Å; E458-T461 PolarHBondContact O-OG1 3.46Å; E458-D462 WeakPolarHBondContact O-CB 3.32Å; E458-D462 PolarHBondContact O-N 2.9Å; E458-Y502 HydrophobicContact CG-CE1 3.89Å; E458-H625 PolarHBondContact N-O 3.28Å; E458-H625 WeakPolarHBondContact OE1-CB 3.31Å; E458-H625 IonicContact OE1-CG 3.7Å; E458-H625 IonicContact OE1-ND1 2.87Å; E458-H625 PolarHBondContact OE1-ND1 2.96Å
459	Y	89.8	Confident	80.9	Confident	14 Å²	14	60.4 Å²	60.4	6%	0.055	31%	0.311	C	S	.	.	G	3₁₀ helix	trans	-54.2	-33	173.4	179.2	-96.1	0	0	0	113	W456 P457 T461 T465 L473 Y502 T506 E507 F510	W456-Y459 VanDerWaalsContact O-CB 3.31Å; W456-Y459 WeakPolarHBondContact O-CB 3.38Å; W456-Y459 PolarHBondContact O-N 3.43Å; W456-Y459 VanDerWaalsContact O-N 3.16Å; P457-Y459 PolarHBondContact O-N 3.22Å; Y459-T461 VanDerWaalsContact C-N 3.33Å; Y459-T465 HydrophobicContact CD2-CG2 3.79Å; Y459-T465 HydrophobicContact CE2-CG2 3.8Å; Y459-L473 HydrophobicContact CD1-CD2 3.86Å; Y459-L473 HydrophobicContact CE1-CD2 3.8Å; Y459-Y502 AromaticContact CD2-CD1 3.92Å; Y459-Y502 HydrophobicContact CD2-CD1 3.92Å; Y459-Y502 AromaticContact CD2-CD2 3.73Å; Y459-Y502 HydrophobicContact CD2-CD2 3.73Å; Y459-Y502 HydrophobicContact CD2-CE1 4.2Å; Y459-Y502 HydrophobicContact CD2-CE2 4.02Å; Y459-Y502 AromaticContact CD2-CG 3.68Å; Y459-Y502 HydrophobicContact CD2-CG 3.68Å; Y459-Y502 HydrophobicContact CE2-CD2 4.27Å; Y459-Y502 HydrophobicContact CE2-CG 4.41Å; Y459-Y502 HydrophobicContact CG-CD1 4.46Å; Y459-T506 HydrophobicContact CD1-CG2 4.4Å; Y459-T506 HydrophobicContact CD2-CG2 4.28Å; Y459-T506 HydrophobicContact CG-CG2 3.83Å; Y459-E507 HydrophobicContact CD2-CG 4.48Å; Y459-E507 HydrophobicContact CE2-CG 3.76Å; Y459-F510 HydrophobicContact CD1-CB 4.32Å; Y459-F510 AromaticContact CD1-CD2 3.28Å; Y459-F510 HydrophobicContact CD1-CD2 3.28Å; Y459-F510 AromaticContact CD1-CE2 3.67Å; Y459-F510 HydrophobicContact CD1-CE2 3.67Å; Y459-F510 AromaticContact CD1-CG 3.88Å; Y459-F510 HydrophobicContact CD1-CG 3.88Å; Y459-F510 HydrophobicContact CE1-CB 4.15Å; Y459-F510 AromaticContact CE1-CD2 3.92Å; Y459-F510 HydrophobicContact CE1-CD2 3.92Å; Y459-F510 HydrophobicContact CE1-CG 4.21Å; Y459-F510 HydrophobicContact CG-CD2 4.09Å; Y459-F510 HydrophobicContact CG-CE2 4.16Å
460	A	88.9	Confident	80.9	Confident	3 Å²	3	53 Å²	53	3%	0.025	28%	0.28	C	S	.	.	G	3₁₀ helix	trans	-73.2	-25.4	179.9	0	0	0	0	0	113	P457 E458 L473 R478 F510 D630	P457-A460 PolarHBondContact O-N 2.87Å; E458-A460 PolarHBondContact O-N 3.17Å; E458-A460 VanDerWaalsContact O-N 3.15Å; A460-L473 HydrophobicContact CB-CD1 4.35Å; A460-L473 HydrophobicContact CB-CD2 4.03Å; A460-L473 HydrophobicContact CB-CG 3.98Å; A460-R478 VanDerWaalsContact C-NH2 3.33Å; A460-R478 PolarHBondContact O-NH2 2.98Å; A460-F510 HydrophobicContact CB-CE1 3.9Å; A460-F510 HydrophobicContact CB-CZ 4Å; A460-D630 VanDerWaalsContact CB-O 3.27Å; A460-D630 WeakPolarHBondContact CB-O 3.23Å
461	T	85.9	Confident	80.4	Confident	46 Å²	46	54.9 Å²	54.9	28%	0.282	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.5	-19.8	-173.9	49.6	0	0	0	0	113.9	E458 Y459 D630	E458-T461 PolarHBondContact O-N 3.47Å; E458-T461 PolarHBondContact O-OG1 3.46Å; Y459-T461 VanDerWaalsContact C-N 3.33Å; T461-D630 HydrophobicContact CG2-CB 3.96Å; T461-D630 WeakPolarHBondContact CG2-OD1 3.27Å; T461-D630 PolarHBondContact OG1-OD1 3.13Å
462	D	81.5	Confident	79.8	Confident	47 Å²	47	55 Å²	55	25%	0.251	29%	0.291	S	S	.	.			trans	-58.8	137.9	-178.9	-175.2	20.8	0	0	0	112.5	E458 C464 T465 Y502	E458-D462 WeakPolarHBondContact O-CB 3.32Å; E458-D462 PolarHBondContact O-N 2.9Å; D462-C464 PolarHBondContact OD1-N 2.82Å; D462-C464 WeakPolarHBondContact OD2-CB 3.45Å; D462-T465 HydrophobicContact CB-CG2 4.31Å; D462-T465 PolarHBondContact O-OG1 2.92Å; D462-T465 PolarHBondContact OD2-N 3.38Å; D462-Y502 VanDerWaalsContact CB-OH 3.27Å; D462-Y502 WeakPolarHBondContact CB-OH 3.4Å; D462-Y502 PolarHBondContact OD2-OH 3.2Å
463	S	67.6	Low	79.6	Confident	82 Å²	82	54.7 Å²	54.7	57%	0.573	29%	0.289	S	S	*	.	S	Bend	trans	-86.1	-20	174.6	52.1	0	0	0	0	113.9
464	C	58.9	Low	79.2	Confident	110 Å²	110	57.8 Å²	57.8	74%	0.743	29%	0.294	S	S	*	.	S	Bend	trans	-85.1	-17.2	-174.7	-70	0	0	0	0	113.4	D462 D466	D462-C464 PolarHBondContact OD1-N 2.82Å; D462-C464 WeakPolarHBondContact OD2-CB 3.45Å; C464-D466 PolarHBondContact O-N 2.9Å
465	T	55.9	Low	78.8	Confident	35 Å²	35	55.6 Å²	55.6	22%	0.215	31%	0.305	C	S	.	.	S	Bend	trans	-62.5	127.1	171.3	52.1	0	0	0	0	109.9	Y459 D462 R467 Y502	Y459-T465 HydrophobicContact CD2-CG2 3.79Å; Y459-T465 HydrophobicContact CE2-CG2 3.8Å; D462-T465 HydrophobicContact CB-CG2 4.31Å; D462-T465 PolarHBondContact O-OG1 2.92Å; D462-T465 PolarHBondContact OD2-N 3.38Å; T465-R467 PolarHBondContact O-N 2.92Å; T465-Y502 HydrophobicContact CG2-CD2 3.77Å; T465-Y502 HydrophobicContact CG2-CE2 3.27Å
466	D	54.6	Low	78.6	Confident	114 Å²	114	57.7 Å²	57.7	61%	0.61	32%	0.315	S	S	*	.			trans	-56.8	109.7	178.6	-151.2	-6.7	0	0	0	107.4	C464 T468 V469	C464-D466 PolarHBondContact O-N 2.9Å; D466-T468 HydrophobicContact CB-CG2 4.31Å; D466-T468 PolarHBondContact O-N 2.82Å; D466-T468 PolarHBondContact O-OG1 3.3Å; D466-T468 VanDerWaalsContact O-OG1 3.08Å; D466-T468 WeakPolarHBondContact OD1-CG2 3.26Å; D466-V469 PolarHBondContact O-N 3.03Å
467	R	60.1	Low	78.4	Confident	193 Å²	193	59.6 Å²	59.6	73%	0.728	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.6	-3.8	-173.9	-67.3	-175.2	-179.8	-176.5	-0.3	114.5	T465 P471	T465-R467 PolarHBondContact O-N 2.92Å; R467-P471 WeakPolarHBondContact O-CA 3.19Å; R467-P471 VanDerWaalsContact O-CB 3.26Å; R467-P471 WeakPolarHBondContact O-CB 3.4Å; R467-P471 WeakPolarHBondContact O-CD 3.41Å
468	T	64.5	Low	78.4	Confident	51 Å²	51	61.6 Å²	61.6	31%	0.313	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-35.6	179.2	62.6	0	0	0	0	115.3	D466	D466-T468 HydrophobicContact CB-CG2 4.31Å; D466-T468 PolarHBondContact O-N 2.82Å; D466-T468 PolarHBondContact O-OG1 3.3Å; D466-T468 VanDerWaalsContact O-OG1 3.08Å; D466-T468 WeakPolarHBondContact OD1-CG2 3.26Å
469	V	82.5	Confident	78.4	Confident	11 Å²	11	59 Å²	59	7%	0.067	33%	0.327	C	S	.	.	S	Bend	trans	-86	-56.1	-171.4	-173.1	0	0	0	0	111.7	F389 G393 D466 L511	F389-V469 HydrophobicContact CB-CG1 4.16Å; F389-V469 HydrophobicContact CB-CG2 3.86Å; F389-V469 HydrophobicContact CD1-CG1 4.14Å; G393-V469 WeakPolarHBondContact CA-O 3.39Å; D466-V469 PolarHBondContact O-N 3.03Å; V469-L511 HydrophobicContact CG1-CD1 4.14Å; V469-L511 HydrophobicContact CG1-CD2 3.86Å; V469-L511 HydrophobicContact CG1-CG 4.19Å
470	L	86.6	Confident	78.3	Confident	25 Å²	25	58.7 Å²	58.7	13%	0.131	33%	0.327	C	S	.	.			trans	-133.1	77.9	176.5	-72.8	171.1	0	0	0	109.7	I396 D472 L473 F510 L511 A514	I396-L470 HydrophobicContact CB-CD2 4.43Å; I396-L470 HydrophobicContact CD1-CD2 4.21Å; I396-L470 HydrophobicContact CG2-CD2 3.96Å; L470-D472 PolarHBondContact O-N 3.48Å; L470-L473 HydrophobicContact CB-CB 3.9Å; L470-L473 HydrophobicContact CB-CD2 4.36Å; L470-L473 HydrophobicContact CD1-CD2 4.26Å; L470-L473 WeakPolarHBondContact O-CB 3.28Å; L470-L473 PolarHBondContact O-N 3.08Å; L470-L473 VanDerWaalsContact O-N 3.1Å; L470-F510 HydrophobicContact CD1-CB 3.86Å; L470-L511 HydrophobicContact CD1-CD2 4.15Å; L470-L511 HydrophobicContact CD1-CG 4.37Å; L470-L511 HydrophobicContact CD2-CD2 4.06Å; L470-L511 HydrophobicContact CG-CD2 4.01Å; L470-A514 HydrophobicContact CD1-CB 4.46Å; L470-A514 HydrophobicContact CD2-CB 4Å
471	P	77.7	Confident	77.9	Confident	56 Å²	56	62.5 Å²	62.5	36%	0.364	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-32.5	-172.8	19.2	-30.9	0	0	0	113.5	H397 R467	H397-P471 HydrophobicContact CB-CG 4.33Å; R467-P471 WeakPolarHBondContact O-CA 3.19Å; R467-P471 VanDerWaalsContact O-CB 3.26Å; R467-P471 WeakPolarHBondContact O-CB 3.4Å; R467-P471 WeakPolarHBondContact O-CD 3.41Å
472	D	80.7	Confident	77.3	Confident	50 Å²	50	64.3 Å²	64.3	27%	0.267	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.5	-13.5	-177.2	-59.3	-49.5	0	0	0	113	H397 K400 L470 R474 G475 E476	H397-D472 IonicContact CE1-OD1 3.49Å; H397-D472 IonicContact CE1-OD2 3.25Å; H397-D472 PolarHBondContact CE1-OD2 3.18Å; H397-D472 VanDerWaalsContact CE1-OD2 3.32Å; H397-D472 IonicContact CG-OD2 3.1Å; H397-D472 IonicContact ND1-OD1 2.68Å; H397-D472 IonicContact ND1-OD2 3.31Å; H397-D472 PolarHBondContact ND1-OD2 3.1Å; K400-D472 WeakPolarHBondContact CD-OD2 3.37Å; K400-D472 IonicContact NZ-OD1 3.82Å; K400-D472 PolarHBondContact NZ-OD1 2.64Å; K400-D472 IonicContact NZ-OD2 3.82Å; K400-D472 PolarHBondContact NZ-OD2 3.08Å; L470-D472 PolarHBondContact O-N 3.48Å; D472-R474 PolarHBondContact O-N 3.09Å; D472-R474 VanDerWaalsContact O-N 3.11Å; D472-G475 WeakPolarHBondContact O-CA 3.29Å; D472-G475 PolarHBondContact O-N 2.71Å; D472-E476 PolarHBondContact O-N 3.15Å
473	L	86.7	Confident	76.3	Confident	11 Å²	11	65.2 Å²	65.2	6%	0.058	38%	0.376	C	S	.	.	G	3₁₀ helix	trans	-57.9	-34.1	-170.2	-177	60.2	0	0	0	113.4	Y459 A460 L470 G475 R478 F510 P632 Y634	Y459-L473 HydrophobicContact CD1-CD2 3.86Å; Y459-L473 HydrophobicContact CE1-CD2 3.8Å; A460-L473 HydrophobicContact CB-CD1 4.35Å; A460-L473 HydrophobicContact CB-CD2 4.03Å; A460-L473 HydrophobicContact CB-CG 3.98Å; L470-L473 HydrophobicContact CB-CB 3.9Å; L470-L473 HydrophobicContact CB-CD2 4.36Å; L470-L473 HydrophobicContact CD1-CD2 4.26Å; L470-L473 WeakPolarHBondContact O-CB 3.28Å; L470-L473 PolarHBondContact O-N 3.08Å; L470-L473 VanDerWaalsContact O-N 3.1Å; L473-G475 VanDerWaalsContact C-N 3.33Å; L473-R478 PolarHBondContact O-NH1 3.19Å; L473-R478 PolarHBondContact O-NH2 3.49Å; L473-R478 VanDerWaalsContact O-NH2 3.16Å; L473-F510 HydrophobicContact CD1-CD1 4.04Å; L473-F510 HydrophobicContact CD2-CB 4.29Å; L473-F510 HydrophobicContact CD2-CD1 3.96Å; L473-F510 HydrophobicContact CD2-CE1 4.5Å; L473-F510 HydrophobicContact CD2-CG 4.1Å; L473-P632 HydrophobicContact CD1-CG 3.88Å; L473-Y634 HydrophobicContact CD1-CE1 4.18Å; L473-Y634 WeakPolarHBondContact CD1-OH 3.35Å
474	R	82	Confident	75.3	Confident	151 Å²	151	67 Å²	67	57%	0.57	38%	0.38	S	S	*	.	G	3₁₀ helix	trans	-72.4	-26.9	177.5	-171.4	173.4	171.4	178.4	0.6	113.2	D472	D472-R474 PolarHBondContact O-N 3.09Å; D472-R474 VanDerWaalsContact O-N 3.11Å
475	G	83.2	Confident	74.5	Confident	73 Å²	73	68.7 Å²	68.7	75%	0.753	38%	0.381	S	S	*	.	G	3₁₀ helix	trans	-84.7	-10.5	178.1	0	0	0	0	0	114.1	D472 L473	D472-G475 WeakPolarHBondContact O-CA 3.29Å; D472-G475 PolarHBondContact O-N 2.71Å; L473-G475 VanDerWaalsContact C-N 3.33Å
476	E	88	Confident	73.8	Confident	45 Å²	45	72.2 Å²	72.2	21%	0.21	39%	0.393	C	S	.	.	S	Bend	trans	-69.4	139.5	178.5	-63.6	-73	173.4	0	0	111.5	D472 R478 R517 P632 Y634	D472-E476 PolarHBondContact O-N 3.15Å; E476-R478 PolarHBondContact O-NH1 3.39Å; E476-R517 IonicContact OE1-CZ 3.52Å; E476-R517 VanDerWaalsContact OE1-CZ 3.32Å; E476-R517 IonicContact OE1-NH1 2.94Å; E476-R517 PolarHBondContact OE1-NH1 2.98Å; E476-R517 VanDerWaalsContact OE1-NH1 3.09Å; E476-R517 IonicContact OE1-NH2 3.38Å; E476-R517 PolarHBondContact OE1-NH2 3.23Å; E476-R517 IonicContact OE2-CZ 3.53Å; E476-R517 IonicContact OE2-NH1 2.97Å; E476-R517 PolarHBondContact OE2-NH1 3.2Å; E476-R517 VanDerWaalsContact OE2-NH1 3.08Å; E476-P632 HydrophobicContact CB-CB 3.84Å; E476-Y634 HydrophobicContact CB-CD1 4.34Å; E476-Y634 HydrophobicContact CB-CE1 4.3Å; E476-Y634 HydrophobicContact CG-CD1 4.18Å; E476-Y634 HydrophobicContact CG-CE1 3.96Å
477	T	90.2	Very high	72.9	Confident	79 Å²	79	74 Å²	74	49%	0.485	40%	0.396	S	S	.	.	P	Polyproline II helix	trans	-56	141	176.8	-44.6	0	0	0	0	111.1	P632 E633	T477-P632 CarbonylContact O-C 2.87Å; T477-P632 WeakPolarHBondContact O-CA 3.32Å; T477-E633 VanDerWaalsContact CG2-CD 3.46Å; T477-E633 HydrophobicContact CG2-CG 4.14Å; T477-E633 WeakPolarHBondContact CG2-OE1 3Å; T477-E633 PolarHBondContact O-N 3.43Å
478	R	91.4	Very high	71.6	Confident	42 Å²	42	72.8 Å²	72.8	16%	0.158	40%	0.396	C	S	.	.	B	Isolated β-bridge	trans	-101.2	147.3	-173.9	-62.7	-58.6	-171	-124	13.1	112.5	A460 L473 E476 A480 D630 L631 E633	A460-R478 VanDerWaalsContact C-NH2 3.33Å; A460-R478 PolarHBondContact O-NH2 2.98Å; L473-R478 PolarHBondContact O-NH1 3.19Å; L473-R478 PolarHBondContact O-NH2 3.49Å; L473-R478 VanDerWaalsContact O-NH2 3.16Å; E476-R478 PolarHBondContact O-NH1 3.39Å; R478-A480 VanDerWaalsContact C-N 3.32Å; R478-A480 PolarHBondContact O-N 3.12Å; R478-D630 WeakPolarHBondContact CD-O 3.44Å; R478-D630 PolarHBondContact NE-O 2.93Å; R478-D630 VanDerWaalsContact NE-O 3.12Å; R478-L631 WeakPolarHBondContact CA-O 3.45Å; R478-L631 WeakPolarHBondContact CD-O 3.35Å; R478-E633 WeakPolarHBondContact O-CG 3.4Å; R478-E633 VanDerWaalsContact O-OE1 3.12Å
479	L	90.3	Very high	69.9	Low	0 Å²	0	73.5 Å²	73.5	0%	0	40%	0.403	C	S	.	.	S	Bend	trans	-59.5	-40.8	-178.9	-68.9	173.3	0	0	0	113.3	L595 L628 L631 E633 V636 L681 T682	L479-L595 HydrophobicContact CD1-CD2 3.71Å; L479-L628 HydrophobicContact CD1-CD1 3.89Å; L479-L631 HydrophobicContact CD1-CB 3.76Å; L479-L631 HydrophobicContact CG-CB 4.45Å; L479-L631 PolarHBondContact N-O 2.85Å; L479-E633 HydrophobicContact CD2-CB 4.44Å; L479-E633 HydrophobicContact CD2-CG 4.27Å; L479-V636 HydrophobicContact CD2-CB 4.27Å; L479-V636 HydrophobicContact CD2-CG2 3.51Å; L479-L681 HydrophobicContact CB-CD1 4.5Å; L479-L681 HydrophobicContact CD2-CD1 3.65Å; L479-L681 CarbonylContact O-C 3.55Å; L479-L681 VanDerWaalsContact O-CA 3.28Å; L479-L681 WeakPolarHBondContact O-CA 3.5Å; L479-T682 PolarHBondContact O-N 3.24Å; L479-T682 PolarHBondContact O-OG1 3.21Å; L479-T682 VanDerWaalsContact O-OG1 3.13Å
480	A	86.2	Confident	67.4	Low	9 Å²	9	81.5 Å²	81.5	7%	0.074	44%	0.439	C	S	.	.	S	Bend	trans	-132.1	157.6	-174.8	0	0	0	0	0	110.2	R478	R478-A480 VanDerWaalsContact C-N 3.32Å; R478-A480 PolarHBondContact O-N 3.12Å
481	P	81.4	Confident	64.6	Low	82 Å²	82	87.6 Å²	87.6	53%	0.532	47%	0.472	S	S	.	.			trans	-63.8	146.7	178.3	1	14.4	0	0	0	109.4	N483 S629 T682	P481-N483 PolarHBondContact O-N 3.19Å; P481-S629 WeakPolarHBondContact O-CB 2.9Å; P481-T682 VanDerWaalsContact CD-CG2 3.44Å; P481-T682 HydrophobicContact CG-CG2 3.65Å
482	A	72.6	Confident	62.4	Low	84 Å²	84	89.1 Å²	89.1	69%	0.694	48%	0.481	S	S	*	.			trans	-56.2	117	176.2	0	0	0	0	0	110	N484	A482-N484 PolarHBondContact O-N 3.49Å; A482-N484 VanDerWaalsContact O-N 3.13Å
483	N	61.7	Low	59.9	Low	67 Å²	67	92 Å²	92	36%	0.358	50%	0.504	S	S	.	.			trans	-80.2	100.4	-176.3	-152.1	-5	0	0	0	109.1	P481 N485 F486	P481-N483 PolarHBondContact O-N 3.19Å; N483-N485 PolarHBondContact O-N 2.99Å; N483-F486 HydrophobicContact CB-CD2 4.31Å; N483-F486 PolarHBondContact O-N 3.33Å
484	N	46.5	Very low	57.3	Low	120 Å²	120	97.9 Å²	97.9	64%	0.642	54%	0.536	S	S	*	.	G	3₁₀ helix	trans	-58.1	-20	-178.6	-80.4	-21.6	0	0	0	113.2	A482 F486 K487	A482-N484 PolarHBondContact O-N 3.49Å; A482-N484 VanDerWaalsContact O-N 3.13Å; N484-F486 VanDerWaalsContact C-N 3.28Å; N484-F486 PolarHBondContact O-N 3.13Å; N484-K487 PolarHBondContact O-N 3.21Å
485	N	42	Very low	55	Low	144 Å²	144	93.6 Å²	93.6	77%	0.77	53%	0.532	S	S	*	.	G	3₁₀ helix	trans	-73.9	-14	178.3	-69.5	-10.2	0	0	0	114.1	N483	N483-N485 PolarHBondContact O-N 2.99Å
486	F	41.9	Very low	52.8	Low	109 Å²	109	96 Å²	96	48%	0.478	53%	0.532	S	S	.	.	G	3₁₀ helix	trans	-101.9	2.3	177.1	-81.6	-82.4	0	0	0	114.3	N483 N484 K488 K605	N483-F486 HydrophobicContact CB-CD2 4.31Å; N483-F486 PolarHBondContact O-N 3.33Å; N484-F486 VanDerWaalsContact C-N 3.28Å; N484-F486 PolarHBondContact O-N 3.13Å; F486-K488 PolarHBondContact O-N 2.95Å; F486-K605 HydrophobicContact CZ-CD 4.32Å
487	K	35.3	Very low	49.9	Very low	152 Å²	152	98.8 Å²	98.8	66%	0.661	55%	0.552	S	S	*	*	S	Bend	trans	-67.1	94.2	157.6	-75.2	-173.4	178.3	-178.8	0	107	N484 S489	N484-K487 PolarHBondContact O-N 3.21Å; K487-S489 PolarHBondContact O-N 3.44Å; K487-S489 VanDerWaalsContact O-N 3.12Å
488	K	32.3	Very low	47.1	Very low	167 Å²	167	100.5 Å²	100.5	73%	0.726	56%	0.559	S	S	*	*			trans	-38.2	124.1	163.1	-81.3	174.8	177.5	167.9	0	107.5	F486 E490	F486-K488 PolarHBondContact O-N 2.95Å; K488-E490 PolarHBondContact O-N 3.05Å; K488-E490 VanDerWaalsContact O-N 3.09Å
489	S	28.9	Very low	44.8	Very low	66 Å²	66	106.9 Å²	106.9	46%	0.462	60%	0.596	S	S	.	*			trans	-10.3	107.4	159.7	178	0	0	0	0	111.8	K487 N491 T492	K487-S489 PolarHBondContact O-N 3.44Å; K487-S489 VanDerWaalsContact O-N 3.12Å; S489-N491 PolarHBondContact O-N 3.36Å; S489-N491 PolarHBondContact OG-N 3.48Å; S489-T492 PolarHBondContact O-N 3.5Å; S489-T492 PolarHBondContact OG-N 2.92Å; S489-T492 PolarHBondContact OG-OG1 2.8Å
490	E	30.6	Very low	43	Very low	179 Å²	179	114 Å²	114	84%	0.836	63%	0.629	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.7	0.8	167.8	-77.6	-178.1	158.8	0	0	112.1	K488	K488-E490 PolarHBondContact O-N 3.05Å; K488-E490 VanDerWaalsContact O-N 3.09Å
491	N	27.3	Very low	42.5	Very low	154 Å²	154	118.3 Å²	118.3	82%	0.824	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-116.1	14.1	173	-71.5	-26.8	0	0	0	114.6	S489	S489-N491 PolarHBondContact O-N 3.36Å; S489-N491 PolarHBondContact OG-N 3.48Å
492	T	30.8	Very low	42.8	Very low	88 Å²	88	116.2 Å²	116.2	54%	0.54	63%	0.633	S	S	.	*			trans	-119.7	72.3	158.8	-38.8	0	0	0	0	107.9	S489 L494	S489-T492 PolarHBondContact O-N 3.5Å; S489-T492 PolarHBondContact OG-N 2.92Å; S489-T492 PolarHBondContact OG-OG1 2.8Å; T492-L494 PolarHBondContact O-N 3.35Å
493	S	29	Very low	43.6	Very low	109 Å²	109	113.5 Å²	113.5	76%	0.762	61%	0.608	S	S	*	*			trans	-65.4	63	161.5	52.6	0	0	0	0	110.4	A495	S493-A495 PolarHBondContact O-N 2.79Å
494	L	32.6	Very low	45	Very low	136 Å²	136	113.3 Å²	113.3	71%	0.712	61%	0.607	S	S	*	*				-78.6	72.7	123.7	-69.9	167	0	0	0	104.9	T492 V496	T492-L494 PolarHBondContact O-N 3.35Å; L494-V496 PolarHBondContact O-N 3.06Å
495	A	32.4	Very low	47.3	Very low	61 Å²	61	108.7 Å²	108.7	50%	0.504	58%	0.582	S	S	.	*			trans	-43.1	136.1	141.4	0	0	0	0	0	104.8	S493 T497	S493-A495 PolarHBondContact O-N 2.79Å; A495-T497 PolarHBondContact O-N 3.03Å
496	V	37	Very low	49.8	Very low	124 Å²	124	101.8 Å²	101.8	75%	0.752	55%	0.545	S	S	*	.			trans	-61.8	80.4	163.2	178.7	0	0	0	0	105.3	L494 N498	L494-V496 PolarHBondContact O-N 3.06Å; V496-N498 VanDerWaalsContact C-N 3.31Å; V496-N498 PolarHBondContact O-N 3.37Å
497	T	26.6	Very low	52.2	Low	102 Å²	102	97.7 Å²	97.7	63%	0.626	53%	0.527	S	S	*	.			trans	-61.4	104.4	151.9	51	0	0	0	0	102.2	A495	A495-T497 PolarHBondContact O-N 3.03Å
498	N	33.1	Very low	55.1	Low	116 Å²	116	90.7 Å²	90.7	62%	0.62	50%	0.497	S	S	*	.	S	Bend	trans	143.1	96.9	162.9	-69.4	-12	0	0	0	106.8	V496 E500	V496-N498 VanDerWaalsContact C-N 3.31Å; V496-N498 PolarHBondContact O-N 3.37Å; N498-E500 HydrophobicContact CB-CG 4.39Å; N498-E500 PolarHBondContact O-N 3.26Å
499	D	42.7	Very low	58.1	Low	176 Å²	176	82.8 Å²	82.8	94%	0.941	46%	0.463	S	S	*	.				23.3	19.9	114.6	-129.5	15.2	0	0	0	120	D501	D499-D501 PolarHBondContact O-N 3.02Å
500	E	52.9	Low	61.3	Low	148 Å²	148	79.6 Å²	79.6	69%	0.692	44%	0.441	S	S	*	.			trans	-91.4	102.1	175.9	-69.8	-146.5	165.2	0	0	109.4	N498 Y502	N498-E500 HydrophobicContact CB-CG 4.39Å; N498-E500 PolarHBondContact O-N 3.26Å; E500-Y502 PolarHBondContact O-N 3.41Å
501	D	75.7	Confident	64.4	Low	101 Å²	101	71.1 Å²	71.1	54%	0.54	40%	0.401	S	S	.	.	P	Polyproline II helix	trans	-49.7	135.1	167.6	-80.2	-28.8	0	0	0	110.5	D499	D499-D501 PolarHBondContact O-N 3.02Å
502	Y	86.8	Confident	67.8	Low	37 Å²	37	63.8 Å²	63.8	15%	0.145	36%	0.362	C	S	.	.	P	Polyproline II helix	trans	-51.2	147.9	172.4	-78.4	-88.4	0	0	0	111.7	W456 E458 Y459 D462 T465 E500 L504 T506	W456-Y502 HydrophobicContact CB-CD1 4.19Å; W456-Y502 HydrophobicContact CB-CE1 4.27Å; W456-Y502 HydrophobicContact CD2-CD1 4.32Å; W456-Y502 AromaticContact CE3-CD1 3.52Å; W456-Y502 HydrophobicContact CE3-CD1 3.52Å; W456-Y502 AromaticContact CE3-CE1 3.79Å; W456-Y502 HydrophobicContact CE3-CE1 3.79Å; W456-Y502 HydrophobicContact CE3-CG 4.47Å; W456-Y502 HydrophobicContact CZ3-CD1 4.26Å; E458-Y502 HydrophobicContact CG-CE1 3.89Å; Y459-Y502 AromaticContact CD2-CD1 3.92Å; Y459-Y502 HydrophobicContact CD2-CD1 3.92Å; Y459-Y502 AromaticContact CD2-CD2 3.73Å; Y459-Y502 HydrophobicContact CD2-CD2 3.73Å; Y459-Y502 HydrophobicContact CD2-CE1 4.2Å; Y459-Y502 HydrophobicContact CD2-CE2 4.02Å; Y459-Y502 AromaticContact CD2-CG 3.68Å; Y459-Y502 HydrophobicContact CD2-CG 3.68Å; Y459-Y502 HydrophobicContact CE2-CD2 4.27Å; Y459-Y502 HydrophobicContact CE2-CG 4.41Å; Y459-Y502 HydrophobicContact CG-CD1 4.46Å; D462-Y502 VanDerWaalsContact CB-OH 3.27Å; D462-Y502 WeakPolarHBondContact CB-OH 3.4Å; D462-Y502 PolarHBondContact OD2-OH 3.2Å; T465-Y502 HydrophobicContact CG2-CD2 3.77Å; T465-Y502 HydrophobicContact CG2-CE2 3.27Å; E500-Y502 PolarHBondContact O-N 3.41Å; Y502-L504 PolarHBondContact O-N 3.49Å; Y502-T506 HydrophobicContact CD1-CG2 4.31Å
503	P	89.8	Confident	70.9	Confident	27 Å²	27	59.7 Å²	59.7	18%	0.175	34%	0.336	C	S	.	.	P	Polyproline II helix	trans	-54.5	132.6	173.5	-22.4	31.3	0	0	0	110.2	K454 W456 L505 T506 E507	K454-P503 WeakPolarHBondContact O-CB 3.32Å; W456-P503 HydrophobicContact CD2-CG 3.82Å; W456-P503 HydrophobicContact CE3-CG 4.25Å; W456-P503 HydrophobicContact CG-CG 4.35Å; W456-P503 HydrophobicContact CH2-CG 4.09Å; W456-P503 HydrophobicContact CZ2-CG 3.66Å; W456-P503 HydrophobicContact CZ3-CG 4.36Å; P503-L505 PolarHBondContact O-N 3.41Å; P503-T506 WeakPolarHBondContact O-CA 3.35Å; P503-T506 VanDerWaalsContact O-CB 3.25Å; P503-T506 WeakPolarHBondContact O-CB 3.38Å; P503-T506 PolarHBondContact O-N 3.23Å; P503-E507 PolarHBondContact O-N 2.99Å
504	L	91.8	Very high	74.1	Confident	63 Å²	63	54.7 Å²	54.7	33%	0.33	30%	0.302	S	S	.	.	H	α-helix	trans	-49	-36.1	178.7	176.7	66	0	0	0	112.6	L375 F389 Y502 T506 E507 L508	L375-L504 HydrophobicContact CD2-CD1 4.32Å; F389-L504 HydrophobicContact CE1-CD1 4.28Å; F389-L504 HydrophobicContact CE2-CD1 4.05Å; F389-L504 HydrophobicContact CZ-CD1 3.44Å; F389-L504 VanDerWaalsContact CZ-CD1 3.44Å; Y502-L504 PolarHBondContact O-N 3.49Å; L504-T506 VanDerWaalsContact C-N 3.32Å; L504-T506 PolarHBondContact O-N 3.45Å; L504-E507 PolarHBondContact O-N 2.95Å; L504-L508 HydrophobicContact CD1-CD1 4.2Å; L504-L508 HydrophobicContact CD1-CG 4.28Å; L504-L508 HydrophobicContact CD2-CD1 4.37Å; L504-L508 HydrophobicContact CG-CD1 3.86Å; L504-L508 HydrophobicContact CG-CG 4.35Å; L504-L508 WeakPolarHBondContact O-CB 3.45Å; L504-L508 WeakPolarHBondContact O-CG 3.36Å; L504-L508 PolarHBondContact O-N 3.2Å
505	L	93.8	Very high	77.2	Confident	23 Å²	23	48.2 Å²	48.2	12%	0.12	27%	0.268	C	S	.	.	H	α-helix	trans	-66.4	-32.5	179.6	-166.5	59.8	0	0	0	112.9	T440 L443 P451 K454 P503 F509	T440-L505 WeakPolarHBondContact O-CD1 3.37Å; L443-L505 HydrophobicContact CD1-CD1 3.99Å; L443-L505 HydrophobicContact CD1-CD2 4.42Å; L443-L505 HydrophobicContact CD1-CG 4.14Å; L443-L505 HydrophobicContact CD2-CD2 3.95Å; L443-L505 HydrophobicContact CG-CD1 4.01Å; L443-L505 HydrophobicContact CG-CD2 4.11Å; L443-L505 HydrophobicContact CG-CG 4.28Å; P451-L505 HydrophobicContact CG-CD2 3.83Å; K454-L505 HydrophobicContact CB-CB 4.45Å; K454-L505 HydrophobicContact CB-CD2 4.13Å; P503-L505 PolarHBondContact O-N 3.41Å; L505-F509 VanDerWaalsContact O-CB 3.22Å; L505-F509 WeakPolarHBondContact O-CB 3.33Å; L505-F509 PolarHBondContact O-N 2.89Å
506	T	94	Very high	80.2	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-62.2	-52.9	174	-65.1	0	0	0	0	110.1	K454 I455 W456 Y459 Y502 P503 L504 L508 F509 F510	K454-T506 PolarHBondContact O-OG1 3.32Å; I455-T506 WeakPolarHBondContact CA-OG1 3.36Å; W456-T506 HydrophobicContact CB-CG2 4.15Å; W456-T506 PolarHBondContact N-OG1 2.64Å; W456-T506 WeakPolarHBondContact O-CG2 3.46Å; Y459-T506 HydrophobicContact CD1-CG2 4.4Å; Y459-T506 HydrophobicContact CD2-CG2 4.28Å; Y459-T506 HydrophobicContact CG-CG2 3.83Å; Y502-T506 HydrophobicContact CD1-CG2 4.31Å; P503-T506 WeakPolarHBondContact O-CA 3.35Å; P503-T506 VanDerWaalsContact O-CB 3.25Å; P503-T506 WeakPolarHBondContact O-CB 3.38Å; P503-T506 PolarHBondContact O-N 3.23Å; L504-T506 VanDerWaalsContact C-N 3.32Å; L504-T506 PolarHBondContact O-N 3.45Å; T506-L508 VanDerWaalsContact C-N 3.34Å; T506-L508 PolarHBondContact O-N 3.08Å; T506-F509 WeakPolarHBondContact O-CB 3.39Å; T506-F509 PolarHBondContact O-N 3.43Å; T506-F510 HydrophobicContact CG2-CD2 4.09Å; T506-F510 HydrophobicContact CG2-CE2 3.9Å; T506-F510 VanDerWaalsContact O-CD2 3.26Å; T506-F510 WeakPolarHBondContact O-CD2 3.41Å; T506-F510 PolarHBondContact O-N 3.3Å
507	E	93	Very high	82.9	Confident	23 Å²	23	41.9 Å²	41.9	11%	0.107	22%	0.218	C	C	.	.	H	α-helix	trans	-63	-42	-178.5	-60.7	169.8	99.7	0	0	111.6	K385 F389 Y459 P503 L504 F509 F510 L511	K385-E507 WeakPolarHBondContact CE-OE2 3.37Å; K385-E507 IonicContact NZ-OE1 3.67Å; K385-E507 IonicContact NZ-OE2 3.81Å; K385-E507 PolarHBondContact NZ-OE2 3.3Å; F389-E507 HydrophobicContact CD1-CB 4.05Å; F389-E507 HydrophobicContact CE1-CB 3.48Å; F389-E507 VanDerWaalsContact CE1-CB 3.48Å; F389-E507 HydrophobicContact CE1-CG 4.35Å; Y459-E507 HydrophobicContact CD2-CG 4.48Å; Y459-E507 HydrophobicContact CE2-CG 3.76Å; P503-E507 PolarHBondContact O-N 2.99Å; L504-E507 PolarHBondContact O-N 2.95Å; E507-F509 VanDerWaalsContact C-N 3.35Å; E507-F509 PolarHBondContact O-N 3.19Å; E507-F510 PolarHBondContact O-N 3Å; E507-L511 WeakPolarHBondContact O-CB 3.25Å; E507-L511 WeakPolarHBondContact O-CG 3.44Å; E507-L511 PolarHBondContact O-N 3.17Å
508	L	95.6	Very high	86.1	Confident	4 Å²	4	37 Å²	37	2%	0.021	19%	0.188	C	C	.	.	H	α-helix	trans	-64.6	-36.6	176.3	-72.3	174.5	0	0	0	112.6	L375 F389 L439 T440 L504 T506 L511 A512	L375-L508 HydrophobicContact CD1-CD1 4.12Å; F389-L508 HydrophobicContact CE1-CD2 4.36Å; F389-L508 HydrophobicContact CZ-CD2 3.81Å; F389-L508 HydrophobicContact CZ-CG 4.11Å; L439-L508 HydrophobicContact CB-CD1 4.34Å; L439-L508 HydrophobicContact CB-CD2 4.23Å; L439-L508 WeakPolarHBondContact O-CD1 3.47Å; T440-L508 HydrophobicContact CG2-CB 4.25Å; L504-L508 HydrophobicContact CD1-CD1 4.2Å; L504-L508 HydrophobicContact CD1-CG 4.28Å; L504-L508 HydrophobicContact CD2-CD1 4.37Å; L504-L508 HydrophobicContact CG-CD1 3.86Å; L504-L508 HydrophobicContact CG-CG 4.35Å; L504-L508 WeakPolarHBondContact O-CB 3.45Å; L504-L508 WeakPolarHBondContact O-CG 3.36Å; L504-L508 PolarHBondContact O-N 3.2Å; T506-L508 VanDerWaalsContact C-N 3.34Å; T506-L508 PolarHBondContact O-N 3.08Å; L508-L511 PolarHBondContact O-N 2.59Å; L508-A512 VanDerWaalsContact O-CB 3.23Å; L508-A512 WeakPolarHBondContact O-CB 3.33Å; L508-A512 PolarHBondContact O-N 3Å
509	F	96.4	Very high	88.9	Confident	1 Å²	1	31.7 Å²	31.7	0%	0.004	16%	0.161	C	C	.	.	H	α-helix	trans	-60	-49.2	176.5	169.5	-96.4	0	0	0	111.5	L443 I455 L505 T506 E507 A512 H513 F587 T591 L594 L635	L443-F509 HydrophobicContact CD1-CB 4.43Å; L443-F509 HydrophobicContact CD1-CD2 4.03Å; I455-F509 HydrophobicContact CD1-CD2 3.99Å; I455-F509 HydrophobicContact CD1-CE2 4.37Å; I455-F509 HydrophobicContact CD1-CG 4.31Å; I455-F509 HydrophobicContact CG2-CB 4.39Å; I455-F509 HydrophobicContact CG2-CD1 3.67Å; I455-F509 HydrophobicContact CG2-CD2 4.49Å; I455-F509 HydrophobicContact CG2-CE1 4.03Å; I455-F509 HydrophobicContact CG2-CG 3.93Å; L505-F509 VanDerWaalsContact O-CB 3.22Å; L505-F509 WeakPolarHBondContact O-CB 3.33Å; L505-F509 PolarHBondContact O-N 2.89Å; T506-F509 WeakPolarHBondContact O-CB 3.39Å; T506-F509 PolarHBondContact O-N 3.43Å; E507-F509 VanDerWaalsContact C-N 3.35Å; E507-F509 PolarHBondContact O-N 3.19Å; F509-A512 PolarHBondContact O-N 2.98Å; F509-H513 AromaticContact CD2-CD2 3.97Å; F509-H513 AromaticContact CE1-CD2 3.9Å; F509-H513 AromaticContact CE2-CD2 3.47Å; F509-H513 VanDerWaalsContact CE2-CD2 3.47Å; F509-H513 WeakPolarHBondContact CE2-CD2 3.45Å; F509-H513 AromaticContact CE2-NE2 3.3Å; F509-H513 VanDerWaalsContact CE2-NE2 3.3Å; F509-H513 WeakPolarHBondContact CE2-NE2 3.32Å; F509-H513 AromaticContact CZ-CD2 3.43Å; F509-H513 VanDerWaalsContact CZ-CD2 3.43Å; F509-H513 WeakPolarHBondContact CZ-CD2 3.38Å; F509-H513 AromaticContact CZ-NE2 3.4Å; F509-H513 WeakPolarHBondContact CZ-NE2 3.39Å; F509-H513 PolarHBondContact O-N 2.72Å; F509-H513 VanDerWaalsContact O-N 3.11Å; F509-F587 AromaticContact CD2-CE2 3.86Å; F509-F587 HydrophobicContact CD2-CE2 3.86Å; F509-F587 AromaticContact CD2-CZ 3.7Å; F509-F587 HydrophobicContact CD2-CZ 3.7Å; F509-F587 HydrophobicContact CE2-CE2 4.38Å; F509-F587 HydrophobicContact CE2-CZ 4.02Å; F509-T591 HydrophobicContact CE2-CG2 4.34Å; F509-T591 HydrophobicContact CZ-CG2 4.25Å; F509-L594 HydrophobicContact CE1-CD2 4.38Å; F509-L594 HydrophobicContact CE2-CD2 4.43Å; F509-L594 HydrophobicContact CZ-CD2 3.98Å; F509-L635 HydrophobicContact CE1-CD2 3.88Å; F509-L635 HydrophobicContact CZ-CD2 3.91Å; F509-L635 HydrophobicContact CZ-CG 4.42Å
510	F	95.7	Very high	91.3	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-68.2	-39.1	178.4	-73.9	-76	0	0	0	112.4	Y459 A460 L470 L473 T506 E507 A514 L631	Y459-F510 HydrophobicContact CD1-CB 4.32Å; Y459-F510 AromaticContact CD1-CD2 3.28Å; Y459-F510 HydrophobicContact CD1-CD2 3.28Å; Y459-F510 AromaticContact CD1-CE2 3.67Å; Y459-F510 HydrophobicContact CD1-CE2 3.67Å; Y459-F510 AromaticContact CD1-CG 3.88Å; Y459-F510 HydrophobicContact CD1-CG 3.88Å; Y459-F510 HydrophobicContact CE1-CB 4.15Å; Y459-F510 AromaticContact CE1-CD2 3.92Å; Y459-F510 HydrophobicContact CE1-CD2 3.92Å; Y459-F510 HydrophobicContact CE1-CG 4.21Å; Y459-F510 HydrophobicContact CG-CD2 4.09Å; Y459-F510 HydrophobicContact CG-CE2 4.16Å; A460-F510 HydrophobicContact CB-CE1 3.9Å; A460-F510 HydrophobicContact CB-CZ 4Å; L470-F510 HydrophobicContact CD1-CB 3.86Å; L473-F510 HydrophobicContact CD1-CD1 4.04Å; L473-F510 HydrophobicContact CD2-CB 4.29Å; L473-F510 HydrophobicContact CD2-CD1 3.96Å; L473-F510 HydrophobicContact CD2-CE1 4.5Å; L473-F510 HydrophobicContact CD2-CG 4.1Å; T506-F510 HydrophobicContact CG2-CD2 4.09Å; T506-F510 HydrophobicContact CG2-CE2 3.9Å; T506-F510 VanDerWaalsContact O-CD2 3.26Å; T506-F510 WeakPolarHBondContact O-CD2 3.41Å; T506-F510 PolarHBondContact O-N 3.3Å; E507-F510 PolarHBondContact O-N 3Å; F510-A514 WeakPolarHBondContact O-CB 3.44Å; F510-A514 PolarHBondContact O-N 2.69Å; F510-L631 HydrophobicContact CE1-CD2 4.06Å; F510-L631 HydrophobicContact CZ-CD2 3.79Å
511	L	95.9	Very high	93.2	Very high	0 Å²	0	16.7 Å²	16.7	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-61.4	-43.9	173.9	-78	170.6	0	0	0	112	F389 F392 I396 L436 V469 L470 E507 L508 A514 A515	F389-L511 HydrophobicContact CD1-CD1 3.64Å; F389-L511 HydrophobicContact CE1-CD1 3.6Å; F389-L511 HydrophobicContact CG-CD1 4.4Å; F389-L511 HydrophobicContact CZ-CD1 4.38Å; F392-L511 HydrophobicContact CB-CD1 4.28Å; F392-L511 HydrophobicContact CB-CD2 4.02Å; F392-L511 HydrophobicContact CD2-CD1 4Å; I396-L511 HydrophobicContact CD1-CD2 3.65Å; L436-L511 HydrophobicContact CD1-CB 4.49Å; L436-L511 HydrophobicContact CD2-CB 4.46Å; V469-L511 HydrophobicContact CG1-CD1 4.14Å; V469-L511 HydrophobicContact CG1-CD2 3.86Å; V469-L511 HydrophobicContact CG1-CG 4.19Å; L470-L511 HydrophobicContact CD1-CD2 4.15Å; L470-L511 HydrophobicContact CD1-CG 4.37Å; L470-L511 HydrophobicContact CD2-CD2 4.06Å; L470-L511 HydrophobicContact CG-CD2 4.01Å; E507-L511 WeakPolarHBondContact O-CB 3.25Å; E507-L511 WeakPolarHBondContact O-CG 3.44Å; E507-L511 PolarHBondContact O-N 3.17Å; L508-L511 PolarHBondContact O-N 2.59Å; L511-A514 PolarHBondContact O-N 2.98Å; L511-A515 WeakPolarHBondContact O-CB 3.43Å; L511-A515 PolarHBondContact O-N 3.46Å
512	A	97.8	Very high	93.8	Very high	0 Å²	0	12.1 Å²	12.1	0%	0	6%	0.061	C	C	.	.	H	α-helix	trans	-62	-48.4	178.7	0	0	0	0	0	111.4	L436 V437 T440 L508 F509 A514 A515 I516 F587	L436-A512 HydrophobicContact CB-CB 4.49Å; V437-A512 HydrophobicContact CG2-CB 4.31Å; T440-A512 HydrophobicContact CG2-CB 3.83Å; L508-A512 VanDerWaalsContact O-CB 3.23Å; L508-A512 WeakPolarHBondContact O-CB 3.33Å; L508-A512 PolarHBondContact O-N 3Å; F509-A512 PolarHBondContact O-N 2.98Å; A512-A514 VanDerWaalsContact C-N 3.34Å; A512-A514 PolarHBondContact O-N 2.86Å; A512-A515 PolarHBondContact O-N 2.6Å; A512-I516 VanDerWaalsContact O-CG1 3.27Å; A512-I516 WeakPolarHBondContact O-CG1 3.47Å; A512-I516 PolarHBondContact O-N 2.82Å; A512-F587 HydrophobicContact CB-CE1 4.2Å; A512-F587 HydrophobicContact CB-CE2 4.34Å; A512-F587 HydrophobicContact CB-CZ 3.81Å
513	H	97.1	Very high	94	Very high	2 Å²	2	10.5 Å²	10.5	1%	0.009	6%	0.055	C	C	.	.	H	α-helix	trans	-62.7	-38.9	175.7	-85.7	-67	0	0	0	113.2	F509 A515 I516 R517 F587 T591 Y634 L635 N638	F509-H513 AromaticContact CD2-CD2 3.97Å; F509-H513 AromaticContact CE1-CD2 3.9Å; F509-H513 AromaticContact CE2-CD2 3.47Å; F509-H513 VanDerWaalsContact CE2-CD2 3.47Å; F509-H513 WeakPolarHBondContact CE2-CD2 3.45Å; F509-H513 AromaticContact CE2-NE2 3.3Å; F509-H513 VanDerWaalsContact CE2-NE2 3.3Å; F509-H513 WeakPolarHBondContact CE2-NE2 3.32Å; F509-H513 AromaticContact CZ-CD2 3.43Å; F509-H513 VanDerWaalsContact CZ-CD2 3.43Å; F509-H513 WeakPolarHBondContact CZ-CD2 3.38Å; F509-H513 AromaticContact CZ-NE2 3.4Å; F509-H513 WeakPolarHBondContact CZ-NE2 3.39Å; F509-H513 PolarHBondContact O-N 2.72Å; F509-H513 VanDerWaalsContact O-N 3.11Å; H513-A515 VanDerWaalsContact C-N 3.32Å; H513-I516 PolarHBondContact O-N 3.47Å; H513-R517 PolarHBondContact O-N 3.14Å; H513-F587 AromaticContact CD2-CE1 3.6Å; H513-F587 AromaticContact CD2-CZ 3.62Å; H513-F587 AromaticContact CE1-CE1 3.55Å; H513-F587 AromaticContact CG-CE1 3.82Å; H513-F587 AromaticContact ND1-CE1 3.79Å; H513-F587 AromaticContact NE2-CE1 3.43Å; H513-F587 WeakPolarHBondContact NE2-CE1 3.16Å; H513-F587 AromaticContact NE2-CZ 3.67Å; H513-T591 WeakPolarHBondContact NE2-CG2 3.47Å; H513-T591 PolarHBondContact NE2-OG1 2.76Å; H513-T591 VanDerWaalsContact NE2-OG1 3.14Å; H513-Y634 HydrophobicContact CB-CE2 3.76Å; H513-L635 HydrophobicContact CB-CD1 4.15Å; H513-N638 PolarHBondContact ND1-ND2 3.27Å; H513-N638 PolarHBondContact O-ND2 2.76Å
514	A	95.4	Very high	94.1	Very high	4 Å²	4	9.2 Å²	9.2	3%	0.033	5%	0.047	C	C	.	.	H	α-helix	trans	-66.9	-35.8	176.9	0	0	0	0	0	111.8	I396 L470 F510 L511 A512 R517 I518	I396-A514 HydrophobicContact CD1-CB 4.16Å; I396-A514 HydrophobicContact CG2-CB 3.86Å; L470-A514 HydrophobicContact CD1-CB 4.46Å; L470-A514 HydrophobicContact CD2-CB 4Å; F510-A514 WeakPolarHBondContact O-CB 3.44Å; F510-A514 PolarHBondContact O-N 2.69Å; L511-A514 PolarHBondContact O-N 2.98Å; A512-A514 VanDerWaalsContact C-N 3.34Å; A512-A514 PolarHBondContact O-N 2.86Å; A514-R517 PolarHBondContact O-N 3.22Å; A514-I518 PolarHBondContact O-N 2.9Å
515	A	96.9	Very high	93.8	Very high	0 Å²	0	6.6 Å²	6.6	0%	0	3%	0.034	C	C	.	.	H	α-helix	trans	-67.7	-42.8	173.5	0	0	0	0	0	112.5	I396 F432 T433 L436 L511 A512 H513 R517 I518 G519	I396-A515 HydrophobicContact CD1-CB 4.45Å; F432-A515 HydrophobicContact CD1-CB 4.14Å; F432-A515 HydrophobicContact CE1-CB 3.96Å; T433-A515 HydrophobicContact CG2-CB 4.38Å; T433-A515 PolarHBondContact OG1-O 3.13Å; T433-A515 VanDerWaalsContact OG1-O 3.12Å; L436-A515 HydrophobicContact CB-CB 4.4Å; L436-A515 HydrophobicContact CD1-CB 3.5Å; L511-A515 WeakPolarHBondContact O-CB 3.43Å; L511-A515 PolarHBondContact O-N 3.46Å; A512-A515 PolarHBondContact O-N 2.6Å; H513-A515 VanDerWaalsContact C-N 3.32Å; A515-R517 PolarHBondContact O-N 3.29Å; A515-I518 VanDerWaalsContact O-CG1 3.32Å; A515-I518 WeakPolarHBondContact O-CG1 3.19Å; A515-I518 PolarHBondContact O-N 3.44Å; A515-I518 VanDerWaalsContact O-N 3.15Å; A515-G519 PolarHBondContact O-N 2.9Å
516	I	96.8	Very high	93.5	Very high	9 Å²	9	6.7 Å²	6.7	5%	0.046	3%	0.033	C	C	.	.	H	α-helix	trans	-54.6	-38.8	174.8	-70.1	165.4	0	0	0	111	T433 V437 A512 H513 W520 T521 F587 N638	T433-I516 HydrophobicContact CG2-CB 4.33Å; T433-I516 HydrophobicContact CG2-CG1 3.7Å; V437-I516 HydrophobicContact CG2-CD1 3.86Å; V437-I516 HydrophobicContact CG2-CG1 3.95Å; A512-I516 VanDerWaalsContact O-CG1 3.27Å; A512-I516 WeakPolarHBondContact O-CG1 3.47Å; A512-I516 PolarHBondContact O-N 2.82Å; H513-I516 PolarHBondContact O-N 3.47Å; I516-W520 HydrophobicContact CG2-CB 4.33Å; I516-W520 PolarHBondContact O-N 3.42Å; I516-T521 HydrophobicContact CG2-CG2 4.11Å; I516-T521 PolarHBondContact O-N 3.41Å; I516-T521 PolarHBondContact O-OG1 3.41Å; I516-T521 VanDerWaalsContact O-OG1 3.1Å; I516-F587 HydrophobicContact CD1-CD1 3.74Å; I516-F587 HydrophobicContact CD1-CE1 3.76Å; I516-N638 HydrophobicContact CG2-CB 4.01Å; I516-N638 WeakPolarHBondContact CG2-OD1 3.37Å
517	R	93.1	Very high	93.3	Very high	43 Å²	43	7 Å²	7	16%	0.162	3%	0.034	C	C	.	.	H	α-helix	trans	-65.4	-39.8	179.2	-165.7	174.1	65.2	161.1	-6.5	113.7	E476 H513 A514 A515 T521 S522	E476-R517 IonicContact OE1-CZ 3.52Å; E476-R517 VanDerWaalsContact OE1-CZ 3.32Å; E476-R517 IonicContact OE1-NH1 2.94Å; E476-R517 PolarHBondContact OE1-NH1 2.98Å; E476-R517 VanDerWaalsContact OE1-NH1 3.09Å; E476-R517 IonicContact OE1-NH2 3.38Å; E476-R517 PolarHBondContact OE1-NH2 3.23Å; E476-R517 IonicContact OE2-CZ 3.53Å; E476-R517 IonicContact OE2-NH1 2.97Å; E476-R517 PolarHBondContact OE2-NH1 3.2Å; E476-R517 VanDerWaalsContact OE2-NH1 3.08Å; H513-R517 PolarHBondContact O-N 3.14Å; A514-R517 PolarHBondContact O-N 3.22Å; A515-R517 PolarHBondContact O-N 3.29Å; R517-T521 VanDerWaalsContact C-OG1 3.27Å; R517-T521 WeakPolarHBondContact CA-OG1 3.11Å; R517-T521 PolarHBondContact O-OG1 2.95Å; R517-S522 PolarHBondContact O-OG 3.2Å
518	I	92.9	Very high	93	Very high	1 Å²	1	8.4 Å²	8.4	1%	0.005	4%	0.04	C	C	.	.	H	α-helix	trans	-90.4	-23.4	-177.6	63	172.9	0	0	0	113.5	I396 N399 R402 L429 A514 A515 S522	I396-I518 HydrophobicContact CB-CD1 4.21Å; I396-I518 HydrophobicContact CG1-CD1 3.96Å; I396-I518 HydrophobicContact CG2-CD1 4.33Å; N399-I518 HydrophobicContact CB-CD1 4.01Å; N399-I518 WeakPolarHBondContact O-CG2 3.42Å; R402-I518 HydrophobicContact CB-CB 4.28Å; R402-I518 PolarHBondContact NE-O 3.17Å; L429-I518 HydrophobicContact CD2-CD1 3.98Å; L429-I518 HydrophobicContact CD2-CG1 4.43Å; A514-I518 PolarHBondContact O-N 2.9Å; A515-I518 VanDerWaalsContact O-CG1 3.32Å; A515-I518 WeakPolarHBondContact O-CG1 3.19Å; A515-I518 PolarHBondContact O-N 3.44Å; A515-I518 VanDerWaalsContact O-N 3.15Å; I518-S522 WeakPolarHBondContact O-CB 3.43Å; I518-S522 PolarHBondContact O-OG 2.9Å
519	G	93.7	Very high	92.4	Very high	4 Å²	4	9.7 Å²	9.7	4%	0.041	5%	0.046	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98	-76.3	-178.5	0	0	0	0	0	111.9	A515 L523	A515-G519 PolarHBondContact O-N 2.9Å; G519-L523 WeakPolarHBondContact O-CB 3.26Å; G519-L523 PolarHBondContact O-N 3.22Å; G519-L523 VanDerWaalsContact O-N 3.09Å
520	W	92.5	Very high	91.9	Very high	4 Å²	4	9.7 Å²	9.7	2%	0.015	5%	0.046	C	C	.	.	H	α-helix	trans	-72.7	-53.1	-167.4	-169.5	-96.6	0	0	0	114	I516 S522 L523 I524 L575 L581 Q584	I516-W520 HydrophobicContact CG2-CB 4.33Å; I516-W520 PolarHBondContact O-N 3.42Å; W520-S522 VanDerWaalsContact C-N 3.29Å; W520-S522 PolarHBondContact O-N 3.12Å; W520-L523 CarbonylContact O-C 3.6Å; W520-L523 WeakPolarHBondContact O-CA 3.44Å; W520-L523 WeakPolarHBondContact O-CB 3.43Å; W520-L523 PolarHBondContact O-N 3.38Å; W520-I524 VanDerWaalsContact CD1-CD1 3.44Å; W520-I524 PolarHBondContact O-N 3.28Å; W520-L575 HydrophobicContact CD2-CD2 3.8Å; W520-L575 HydrophobicContact CE3-CD2 4.01Å; W520-L575 VanDerWaalsContact CH2-CA 3.47Å; W520-L575 HydrophobicContact CH2-CB 4.36Å; W520-L575 HydrophobicContact CH2-CD2 3.97Å; W520-L575 WeakPolarHBondContact CH2-O 3.49Å; W520-L575 HydrophobicContact CZ2-CB 4.31Å; W520-L575 HydrophobicContact CZ2-CD2 3.68Å; W520-L575 WeakPolarHBondContact CZ2-O 3.11Å; W520-L575 HydrophobicContact CZ3-CD2 4.1Å; W520-L581 HydrophobicContact CH2-CD1 4.48Å; W520-L581 HydrophobicContact CZ2-CD1 3.89Å; W520-Q584 VanDerWaalsContact CD2-OE1 3.25Å; W520-Q584 VanDerWaalsContact CG-OE1 3.23Å; W520-Q584 VanDerWaalsContact NE1-OE1 3.09Å
521	T	91.7	Very high	91.6	Very high	4 Å²	4	10.2 Å²	10.2	3%	0.025	5%	0.051	C	C	.	.	H	α-helix	trans	-62	-39.5	-179.8	53.4	0	0	0	0	111.6	I516 R517 L523 I524 A525 E641	I516-T521 HydrophobicContact CG2-CG2 4.11Å; I516-T521 PolarHBondContact O-N 3.41Å; I516-T521 PolarHBondContact O-OG1 3.41Å; I516-T521 VanDerWaalsContact O-OG1 3.1Å; R517-T521 VanDerWaalsContact C-OG1 3.27Å; R517-T521 WeakPolarHBondContact CA-OG1 3.11Å; R517-T521 PolarHBondContact O-OG1 2.95Å; T521-L523 VanDerWaalsContact C-N 3.28Å; T521-L523 PolarHBondContact O-N 3.14Å; T521-I524 PolarHBondContact O-N 2.79Å; T521-A525 PolarHBondContact O-N 3.31Å; T521-E641 HydrophobicContact CG2-CB 3.81Å; T521-E641 HydrophobicContact CG2-CG 3.96Å
522	S	88.9	Confident	90.9	Very high	6 Å²	6	14.5 Å²	14.5	4%	0.042	7%	0.071	C	C	.	.	H	α-helix	trans	-60.9	-34.6	172	-61.9	0	0	0	0	112.8	R402 R517 I518 W520 R526	R402-S522 VanDerWaalsContact C-OG 3.31Å; R402-S522 PolarHBondContact O-OG 3.11Å; R517-S522 PolarHBondContact O-OG 3.2Å; I518-S522 WeakPolarHBondContact O-CB 3.43Å; I518-S522 PolarHBondContact O-OG 2.9Å; W520-S522 VanDerWaalsContact C-N 3.29Å; W520-S522 PolarHBondContact O-N 3.12Å; S522-R526 PolarHBondContact O-N 3.4Å
523	L	91.7	Very high	90.3	Very high	2 Å²	2	15.9 Å²	15.9	1%	0.01	8%	0.078	C	C	.	.	H	α-helix	trans	-74.3	-39.4	175.9	-177.1	61.7	0	0	0	111.8	L318 D426 G519 W520 T521 R526 H527 Q571 L575	L318-L523 HydrophobicContact CD1-CD1 4.42Å; L318-L523 HydrophobicContact CD1-CD2 3.95Å; D426-L523 HydrophobicContact CB-CD1 4.28Å; G519-L523 WeakPolarHBondContact O-CB 3.26Å; G519-L523 PolarHBondContact O-N 3.22Å; G519-L523 VanDerWaalsContact O-N 3.09Å; W520-L523 CarbonylContact O-C 3.6Å; W520-L523 WeakPolarHBondContact O-CA 3.44Å; W520-L523 WeakPolarHBondContact O-CB 3.43Å; W520-L523 PolarHBondContact O-N 3.38Å; T521-L523 VanDerWaalsContact C-N 3.28Å; T521-L523 PolarHBondContact O-N 3.14Å; L523-R526 PolarHBondContact O-N 3.26Å; L523-H527 WeakPolarHBondContact O-CB 3.25Å; L523-H527 PolarHBondContact O-N 3.11Å; L523-Q571 HydrophobicContact CD1-CB 4.5Å; L523-Q571 HydrophobicContact CD1-CG 4.06Å; L523-L575 HydrophobicContact CB-CD2 4.26Å; L523-L575 HydrophobicContact CD2-CD2 3.78Å; L523-L575 HydrophobicContact CD2-CG 4.01Å; L523-L575 HydrophobicContact CG-CD1 4.33Å; L523-L575 HydrophobicContact CG-CD2 3.9Å; L523-L575 HydrophobicContact CG-CG 4.08Å
524	I	90.9	Very high	89.8	Confident	1 Å²	1	16.8 Å²	16.8	1%	0.005	8%	0.082	C	C	.	.	H	α-helix	trans	-58	-50.6	173.1	-68.3	170.9	0	0	0	110.4	W520 T521 R526 H527 F528 L575 Y645	W520-I524 VanDerWaalsContact CD1-CD1 3.44Å; W520-I524 PolarHBondContact O-N 3.28Å; T521-I524 PolarHBondContact O-N 2.79Å; I524-R526 VanDerWaalsContact C-N 3.3Å; I524-R526 PolarHBondContact O-N 3.31Å; I524-H527 WeakPolarHBondContact O-CB 3.43Å; I524-H527 PolarHBondContact O-N 3.15Å; I524-H527 VanDerWaalsContact O-N 3.08Å; I524-F528 HydrophobicContact CG2-CD2 3.72Å; I524-F528 HydrophobicContact CG2-CE2 3.51Å; I524-F528 WeakPolarHBondContact O-CD2 3.47Å; I524-F528 PolarHBondContact O-N 3.08Å; I524-L575 HydrophobicContact CG1-CD1 4.31Å; I524-L575 HydrophobicContact CG1-CD2 3.83Å; I524-Y645 HydrophobicContact CD1-CG 4.08Å; I524-Y645 HydrophobicContact CG1-CD2 4.22Å; I524-Y645 HydrophobicContact CG1-CG 4.18Å; I524-Y645 HydrophobicContact CG2-CD2 4.17Å
525	A	86.5	Confident	89.1	Confident	8 Å²	8	21 Å²	21	7%	0.066	10%	0.101	C	C	.	.	H	α-helix	trans	-57.7	-45.6	-178.5	0	0	0	0	0	111.5	A406 I409 T521 H527 F528 E529	A406-A525 HydrophobicContact CB-CB 4.13Å; I409-A525 HydrophobicContact CD1-CB 4.24Å; I409-A525 HydrophobicContact CG1-CB 4.31Å; T521-A525 PolarHBondContact O-N 3.31Å; A525-H527 VanDerWaalsContact C-N 3.34Å; A525-H527 PolarHBondContact O-N 3.36Å; A525-F528 PolarHBondContact O-N 3.44Å; A525-E529 PolarHBondContact O-N 2.9Å
526	R	86.6	Confident	88.4	Confident	24 Å²	24	24 Å²	24	9%	0.091	11%	0.113	C	C	.	.	H	α-helix	trans	-70	-29.3	176.9	-175	146.3	43.5	83.2	42.4	113.6	P321 D426 S522 L523 I524 E529 T530	P321-R526 VanDerWaalsContact CD-NH1 3.29Å; D426-R526 IonicContact OD1-CZ 2.68Å; D426-R526 IonicContact OD1-NH1 3.62Å; D426-R526 IonicContact OD1-NH2 2.71Å; D426-R526 PolarHBondContact OD1-NH2 3.42Å; D426-R526 IonicContact OD2-CZ 2.61Å; D426-R526 IonicContact OD2-NH1 3.06Å; D426-R526 PolarHBondContact OD2-NH1 3.39Å; D426-R526 IonicContact OD2-NH2 2.64Å; D426-R526 PolarHBondContact OD2-NH2 2.96Å; S522-R526 PolarHBondContact O-N 3.4Å; L523-R526 PolarHBondContact O-N 3.26Å; I524-R526 VanDerWaalsContact C-N 3.3Å; I524-R526 PolarHBondContact O-N 3.31Å; R526-E529 PolarHBondContact O-N 3.23Å; R526-T530 VanDerWaalsContact O-CB 3.29Å; R526-T530 WeakPolarHBondContact O-CB 3.37Å; R526-T530 PolarHBondContact O-N 2.96Å; R526-T530 PolarHBondContact O-OG1 3.12Å
527	H	90.2	Very high	87.8	Confident	7 Å²	7	24 Å²	24	3%	0.032	11%	0.113	C	C	.	.	H	α-helix	trans	-62.3	-48.1	173.3	178.1	57.6	0	0	0	111.6	L523 I524 A525 T530 G531 Y568 Q571 L575	L523-H527 WeakPolarHBondContact O-CB 3.25Å; L523-H527 PolarHBondContact O-N 3.11Å; I524-H527 WeakPolarHBondContact O-CB 3.43Å; I524-H527 PolarHBondContact O-N 3.15Å; I524-H527 VanDerWaalsContact O-N 3.08Å; A525-H527 VanDerWaalsContact C-N 3.34Å; A525-H527 PolarHBondContact O-N 3.36Å; H527-T530 PolarHBondContact O-N 3.3Å; H527-G531 PolarHBondContact O-N 3.45Å; H527-Y568 AromaticContact CE1-CD2 3.52Å; H527-Y568 AromaticContact CE1-CE2 3.11Å; H527-Y568 WeakPolarHBondContact CE1-CE2 3.49Å; H527-Y568 AromaticContact CE1-CZ 3.41Å; H527-Y568 VanDerWaalsContact CE1-CZ 3.41Å; H527-Y568 AromaticContact ND1-CD2 3.67Å; H527-Y568 AromaticContact ND1-CE2 3.64Å; H527-Y568 AromaticContact NE2-CE2 3.75Å; H527-Y568 AromaticContact NE2-CZ 3.9Å; H527-Q571 HydrophobicContact CB-CB 4.27Å; H527-L575 HydrophobicContact CB-CD1 3.66Å
528	F	86.8	Confident	87.4	Confident	53 Å²	53	24.4 Å²	24.4	23%	0.232	12%	0.117	C	C	.	.	H	α-helix	trans	-66.2	-39.6	176.1	-73.5	-59.4	0	0	0	112.6	I524 A525 G531 Q532 Y645 R648	I524-F528 HydrophobicContact CG2-CD2 3.72Å; I524-F528 HydrophobicContact CG2-CE2 3.51Å; I524-F528 WeakPolarHBondContact O-CD2 3.47Å; I524-F528 PolarHBondContact O-N 3.08Å; A525-F528 PolarHBondContact O-N 3.44Å; F528-G531 PolarHBondContact O-N 3.03Å; F528-Q532 PolarHBondContact O-N 3.43Å; F528-Y645 HydrophobicContact CE2-CD2 4.23Å; F528-Y645 HydrophobicContact CZ-CD2 4.16Å; F528-R648 HydrophobicContact CE1-CB 4.29Å; F528-R648 HydrophobicContact CZ-CB 3.94Å
529	E	83.1	Confident	86.8	Confident	31 Å²	31	28.9 Å²	28.9	15%	0.145	14%	0.14	C	C	.	.	H	α-helix	trans	-61.4	-44.7	174.5	-168.3	-153.6	-175.9	0	0	111.5	L415 A525 R526 G531 Q532 Q533	L415-E529 VanDerWaalsContact CD1-CD 3.41Å; L415-E529 HydrophobicContact CD1-CG 4.48Å; L415-E529 WeakPolarHBondContact CD1-OE2 3.41Å; A525-E529 PolarHBondContact O-N 2.9Å; R526-E529 PolarHBondContact O-N 3.23Å; E529-G531 VanDerWaalsContact C-N 3.32Å; E529-G531 PolarHBondContact O-N 3.34Å; E529-Q532 WeakPolarHBondContact O-CB 3.4Å; E529-Q532 PolarHBondContact O-N 3.47Å; E529-Q532 VanDerWaalsContact O-N 3.15Å; E529-Q533 WeakPolarHBondContact O-CG 3.36Å; E529-Q533 PolarHBondContact O-N 3.32Å; E529-Q533 PolarHBondContact OE1-NE2 3.31Å
530	T	86.4	Confident	86.3	Confident	1 Å²	1	33.6 Å²	33.6	1%	0.006	16%	0.161	C	C	.	.	H	α-helix	trans	-62	-41.9	178	-55.9	0	0	0	0	110.6	R526 H527 Q532 Q533 L534 R567 Q571	R526-T530 VanDerWaalsContact O-CB 3.29Å; R526-T530 WeakPolarHBondContact O-CB 3.37Å; R526-T530 PolarHBondContact O-N 2.96Å; R526-T530 PolarHBondContact O-OG1 3.12Å; H527-T530 PolarHBondContact O-N 3.3Å; T530-Q532 VanDerWaalsContact C-N 3.34Å; T530-Q532 PolarHBondContact O-N 3.06Å; T530-Q533 PolarHBondContact O-N 2.71Å; T530-L534 PolarHBondContact O-N 3.46Å; T530-R567 HydrophobicContact CG2-CB 4.43Å; T530-Q571 PolarHBondContact OG1-NE2 2.81Å; T530-Q571 PolarHBondContact OG1-OE1 2.65Å
531	G	87.8	Confident	85.8	Confident	11 Å²	11	33.6 Å²	33.6	11%	0.113	16%	0.162	C	C	.	.	H	α-helix	trans	-61.7	-40.5	173.9	0	0	0	0	0	112.7	H527 F528 E529 L534 H535	H527-G531 PolarHBondContact O-N 3.45Å; F528-G531 PolarHBondContact O-N 3.03Å; E529-G531 VanDerWaalsContact C-N 3.32Å; E529-G531 PolarHBondContact O-N 3.34Å; G531-L534 PolarHBondContact O-N 3.08Å; G531-H535 PolarHBondContact O-N 2.82Å; G531-H535 VanDerWaalsContact O-N 3.1Å
532	Q	82.3	Confident	85.3	Confident	90 Å²	90	39.4 Å²	39.4	42%	0.421	19%	0.189	S	C	.	.	H	α-helix	trans	-65.9	-41	175.9	-164.2	-174.6	30.7	0	0	112.1	F528 E529 T530 L534 H535 R536	F528-Q532 PolarHBondContact O-N 3.43Å; E529-Q532 WeakPolarHBondContact O-CB 3.4Å; E529-Q532 PolarHBondContact O-N 3.47Å; E529-Q532 VanDerWaalsContact O-N 3.15Å; T530-Q532 VanDerWaalsContact C-N 3.34Å; T530-Q532 PolarHBondContact O-N 3.06Å; Q532-L534 VanDerWaalsContact C-N 3.32Å; Q532-H535 PolarHBondContact O-N 3Å; Q532-R536 VanDerWaalsContact NE2-NH2 3.13Å; Q532-R536 WeakPolarHBondContact O-CG 3.18Å; Q532-R536 PolarHBondContact O-N 3.19Å; Q532-R536 VanDerWaalsContact O-N 3.14Å
533	Q	84.3	Confident	84.7	Confident	29 Å²	29	42.1 Å²	42.1	14%	0.136	21%	0.206	C	C	.	.	H	α-helix	trans	-61.8	-40.8	173.7	-70.5	173.4	6.3	0	0	111.3	E529 T530 R536 L537	E529-Q533 WeakPolarHBondContact O-CG 3.36Å; E529-Q533 PolarHBondContact O-N 3.32Å; E529-Q533 PolarHBondContact OE1-NE2 3.31Å; T530-Q533 PolarHBondContact O-N 2.71Å; Q533-R536 PolarHBondContact O-N 3.02Å; Q533-L537 WeakPolarHBondContact O-CG 3.48Å; Q533-L537 PolarHBondContact O-N 3.2Å
534	L	86.5	Confident	83.9	Confident	20 Å²	20	44.1 Å²	44.1	11%	0.105	22%	0.215	C	C	.	.	H	α-helix	trans	-61.5	-47.6	178.5	-171.9	63.8	0	0	0	111.4	T530 G531 Q532 R536 L537 E538 M561 R564 T565	T530-L534 PolarHBondContact O-N 3.46Å; G531-L534 PolarHBondContact O-N 3.08Å; Q532-L534 VanDerWaalsContact C-N 3.32Å; L534-R536 VanDerWaalsContact C-N 3.32Å; L534-R536 PolarHBondContact O-N 2.98Å; L534-L537 WeakPolarHBondContact O-CB 3.32Å; L534-L537 PolarHBondContact O-N 3.4Å; L534-E538 WeakPolarHBondContact O-CG 3.45Å; L534-E538 PolarHBondContact O-N 3.03Å; L534-M561 HydrophobicContact CD1-CG 3.77Å; L534-R564 HydrophobicContact CD1-CB 4.05Å; L534-T565 WeakPolarHBondContact CD1-OG1 3.31Å
535	H	82.2	Confident	82.9	Confident	93 Å²	93	50.9 Å²	50.9	43%	0.431	25%	0.247	S	C	.	.	H	α-helix	trans	-59.1	-41.1	175.1	-78.2	-46.8	0	0	0	112.9	G531 Q532 L537 E538 D539	G531-H535 PolarHBondContact O-N 2.82Å; G531-H535 VanDerWaalsContact O-N 3.1Å; Q532-H535 PolarHBondContact O-N 3Å; H535-L537 VanDerWaalsContact C-N 3.28Å; H535-L537 PolarHBondContact O-N 3.44Å; H535-E538 IonicContact CE1-OE2 3.6Å; H535-E538 IonicContact ND1-OE2 3.16Å; H535-E538 PolarHBondContact ND1-OE2 2.81Å; H535-E538 PolarHBondContact O-N 3.31Å; H535-D539 PolarHBondContact O-N 2.93Å
536	R	81.5	Confident	81.8	Confident	64 Å²	64	55.8 Å²	55.8	24%	0.242	28%	0.28	C	S	.	.	H	α-helix	trans	-62.4	-35.2	175.2	-68.3	179	-161	135.6	8.4	112.6	H412 Q532 Q533 L534 Q540	H412-R536 PolarHBondContact CD2-NH2 2.92Å; H412-R536 PolarHBondContact CE1-NE 3.26Å; H412-R536 PolarHBondContact CE1-NH1 3.17Å; H412-R536 PolarHBondContact CE1-NH2 3.43Å; H412-R536 PolarHBondContact ND1-NH1 2.91Å; H412-R536 PolarHBondContact ND1-NH2 2.99Å; H412-R536 PolarHBondContact NE2-NH2 3.22Å; Q532-R536 VanDerWaalsContact NE2-NH2 3.13Å; Q532-R536 WeakPolarHBondContact O-CG 3.18Å; Q532-R536 PolarHBondContact O-N 3.19Å; Q532-R536 VanDerWaalsContact O-N 3.14Å; Q533-R536 PolarHBondContact O-N 3.02Å; L534-R536 VanDerWaalsContact C-N 3.32Å; L534-R536 PolarHBondContact O-N 2.98Å; R536-Q540 VanDerWaalsContact O-CG 3.29Å; R536-Q540 WeakPolarHBondContact O-CG 3.46Å; R536-Q540 PolarHBondContact O-N 2.95Å
537	L	85	Confident	80.5	Confident	9 Å²	9	59 Å²	59	5%	0.047	30%	0.299	C	S	.	.	H	α-helix	trans	-73.9	-38.1	177.8	-69.3	171.2	0	0	0	112	Q533 L534 H535 Q540 L541 L557 F560 R564	Q533-L537 WeakPolarHBondContact O-CG 3.48Å; Q533-L537 PolarHBondContact O-N 3.2Å; L534-L537 WeakPolarHBondContact O-CB 3.32Å; L534-L537 PolarHBondContact O-N 3.4Å; H535-L537 VanDerWaalsContact C-N 3.28Å; H535-L537 PolarHBondContact O-N 3.44Å; L537-Q540 PolarHBondContact O-N 3.31Å; L537-L541 WeakPolarHBondContact O-CB 3.47Å; L537-L541 PolarHBondContact O-N 2.94Å; L537-L557 HydrophobicContact CD2-CD2 3.89Å; L537-F560 HydrophobicContact CD1-CD1 3.58Å; L537-F560 HydrophobicContact CD1-CE1 3.8Å; L537-F560 HydrophobicContact CD1-CG 4.04Å; L537-F560 HydrophobicContact CD1-CZ 4.46Å; L537-F560 HydrophobicContact CD2-CD1 3.47Å; L537-F560 VanDerWaalsContact CD2-CD1 3.47Å; L537-F560 HydrophobicContact CD2-CE1 3.83Å; L537-F560 HydrophobicContact CD2-CG 4.49Å; L537-F560 HydrophobicContact CG-CD1 4.16Å; L537-F560 HydrophobicContact CG-CE1 4.33Å; L537-R564 HydrophobicContact CD1-CB 4.34Å; L537-R564 HydrophobicContact CD1-CG 3.7Å
538	E	84.8	Confident	79.1	Confident	51 Å²	51	66.5 Å²	66.5	24%	0.238	34%	0.34	C	S	.	.	H	α-helix	trans	-57.7	-49.4	171.9	-71.1	174.5	159.3	0	0	110.5	L534 H535 Q540 L541 Q542 M561	L534-E538 WeakPolarHBondContact O-CG 3.45Å; L534-E538 PolarHBondContact O-N 3.03Å; H535-E538 IonicContact CE1-OE2 3.6Å; H535-E538 IonicContact ND1-OE2 3.16Å; H535-E538 PolarHBondContact ND1-OE2 2.81Å; H535-E538 PolarHBondContact O-N 3.31Å; E538-Q540 VanDerWaalsContact C-N 3.27Å; E538-Q540 PolarHBondContact O-N 3.34Å; E538-L541 PolarHBondContact O-N 3.22Å; E538-Q542 PolarHBondContact O-N 3.42Å; E538-M561 HydrophobicContact CG-CE 4.16Å
539	D	78.8	Confident	77.7	Confident	94 Å²	94	65.7 Å²	65.7	50%	0.503	34%	0.341	S	S	.	.	H	α-helix	trans	-58.7	-36.7	177.5	-71.9	-14.1	0	0	0	112.5	H535	H535-D539 PolarHBondContact O-N 2.93Å
540	Q	82.7	Confident	77	Confident	103 Å²	103	71.5 Å²	71.5	48%	0.481	37%	0.373	S	S	.	.	H	α-helix	trans	-73.7	-28.3	177.4	-73.7	175.8	10.1	0	0	113.3	R536 L537 E538 P543 L557	R536-Q540 VanDerWaalsContact O-CG 3.29Å; R536-Q540 WeakPolarHBondContact O-CG 3.46Å; R536-Q540 PolarHBondContact O-N 2.95Å; L537-Q540 PolarHBondContact O-N 3.31Å; E538-Q540 VanDerWaalsContact C-N 3.27Å; E538-Q540 PolarHBondContact O-N 3.34Å; Q540-P543 WeakPolarHBondContact O-CD 3.36Å; Q540-L557 HydrophobicContact CB-CD1 4.46Å
541	L	82.6	Confident	76.6	Confident	5 Å²	5	74.8 Å²	74.8	3%	0.026	39%	0.39	C	S	.	.	H	α-helix	trans	-86.2	-27.7	-179.9	-94.4	152.6	0	0	0	113.2	L537 E538 P543 H544 E545 V554 L557 R558 M561	L537-L541 WeakPolarHBondContact O-CB 3.47Å; L537-L541 PolarHBondContact O-N 2.94Å; E538-L541 PolarHBondContact O-N 3.22Å; L541-P543 VanDerWaalsContact C-N 3.34Å; L541-H544 CarbonylContact O-C 3.48Å; L541-H544 WeakPolarHBondContact O-CA 3.47Å; L541-H544 PolarHBondContact O-N 3.32Å; L541-E545 PolarHBondContact O-N 3.38Å; L541-V554 HydrophobicContact CD2-CG1 4.23Å; L541-L557 HydrophobicContact CD1-CB 3.9Å; L541-L557 HydrophobicContact CD2-CB 4.19Å; L541-L557 HydrophobicContact CG-CB 3.92Å; L541-R558 HydrophobicContact CD2-CG 3.76Å; L541-M561 HydrophobicContact CB-CE 4.42Å; L541-M561 HydrophobicContact CD1-CB 4.19Å; L541-M561 HydrophobicContact CD1-CE 3.46Å; L541-M561 VanDerWaalsContact CD1-CE 3.46Å; L541-M561 HydrophobicContact CD1-SD 4.43Å
542	Q	80.7	Confident	76.3	Confident	126 Å²	126	78.4 Å²	78.4	59%	0.589	41%	0.414	S	S	*	.	G	3₁₀ helix	trans	-49.5	-42.2	-178.2	-163.5	174.4	25	0	0	114.6	E538 H544 E545	E538-Q542 PolarHBondContact O-N 3.42Å; Q542-H544 PolarHBondContact O-N 3.42Å; Q542-E545 PolarHBondContact O-N 3.41Å
543	P	76.6	Confident	76.3	Confident	62 Å²	62	79.7 Å²	79.7	40%	0.403	42%	0.42	S	S	.	.	G	3₁₀ helix	trans	-66.5	-18.8	177.3	-17.9	31.7	0	0	0	114	Q540 L541	Q540-P543 WeakPolarHBondContact O-CD 3.36Å; L541-P543 VanDerWaalsContact C-N 3.34Å
544	H	75.5	Confident	76.3	Confident	45 Å²	45	78.3 Å²	78.3	21%	0.208	41%	0.414	C	S	.	.	G	3₁₀ helix	trans	-106.5	7.1	-175.1	-61.4	-76.7	0	0	0	112.6	L541 Q542 D547 V554	L541-H544 CarbonylContact O-C 3.48Å; L541-H544 WeakPolarHBondContact O-CA 3.47Å; L541-H544 PolarHBondContact O-N 3.32Å; Q542-H544 PolarHBondContact O-N 3.42Å; H544-D547 PolarHBondContact O-N 3.39Å; H544-D547 VanDerWaalsContact O-O 3.07Å; H544-V554 HydrophobicContact CB-CG1 4.35Å; H544-V554 HydrophobicContact CB-CG2 3.86Å
545	E	69.2	Low	76.2	Confident	143 Å²	143	80 Å²	80	67%	0.668	42%	0.422	S	S	*	.	S	Bend	trans	-67.6	-35.8	178.4	-76.4	-172.7	156	0	0	112.9	L541 Q542	L541-E545 PolarHBondContact O-N 3.38Å; Q542-E545 PolarHBondContact O-N 3.41Å
546	S	63.8	Low	76.5	Confident	110 Å²	110	77.2 Å²	77.2	77%	0.769	41%	0.409	S	S	*	.	S	Bend	trans	-79.1	-19.9	176.9	51.1	0	0	0	0	113.4
547	D	60	Low	76.7	Confident	91 Å²	91	74.7 Å²	74.7	49%	0.487	40%	0.4	S	S	.	.			trans	-93.4	109	179.2	-89.3	-13.9	0	0	0	110	H544 S549	H544-D547 PolarHBondContact O-N 3.39Å; H544-D547 VanDerWaalsContact O-O 3.07Å; D547-S549 PolarHBondContact O-N 2.86Å
548	N	59.8	Low	76.8	Confident	165 Å²	165	79.3 Å²	79.3	88%	0.882	42%	0.417	S	S	*	.			trans	-74.1	42.9	166	-140.1	16.3	0	0	0	110.5
549	S	58.7	Low	76.9	Confident	37 Å²	37	80.6 Å²	80.6	26%	0.259	42%	0.42	S	S	.	.			trans	-74.1	128.8	-175.9	57.7	0	0	0	0	109.6	D547 D551	D547-S549 PolarHBondContact O-N 2.86Å; S549-D551 PolarHBondContact O-N 3.35Å
550	N	66.8	Low	77.4	Confident	153 Å²	153	77.4 Å²	77.4	82%	0.818	40%	0.401	S	S	*	.			trans	-73.4	29.5	167.8	-80	-23	0	0	0	111.6	S552	N550-S552 PolarHBondContact O-N 2.97Å
551	D	79.2	Confident	77.6	Confident	69 Å²	69	75.1 Å²	75.1	37%	0.369	39%	0.391	S	S	.	.			trans	-67.1	126.3	178.6	-168.4	-14.5	0	0	0	109.1	S549 Q553 V554 I555	S549-D551 PolarHBondContact O-N 3.35Å; D551-Q553 PolarHBondContact O-N 3.49Å; D551-Q553 VanDerWaalsContact O-N 3.14Å; D551-Q553 PolarHBondContact OD1-N 3Å; D551-Q553 VanDerWaalsContact OD1-N 3.13Å; D551-V554 HydrophobicContact CB-CB 4.33Å; D551-V554 HydrophobicContact CB-CG2 4.05Å; D551-V554 PolarHBondContact O-N 3.39Å; D551-I555 WeakPolarHBondContact O-CG1 3.22Å; D551-I555 PolarHBondContact O-N 2.97Å
552	S	81.4	Confident	77.9	Confident	87 Å²	87	78.1 Å²	78.1	61%	0.608	40%	0.402	S	S	*	.	H	α-helix	trans	-50.8	-35.3	176.5	61.9	0	0	0	0	112.6	N550 F556	N550-S552 PolarHBondContact O-N 2.97Å; S552-F556 WeakPolarHBondContact O-CB 3.4Å; S552-F556 PolarHBondContact O-N 3.43Å
553	Q	82.3	Confident	78.3	Confident	117 Å²	117	72.1 Å²	72.1	55%	0.547	37%	0.374	S	S	.	.	H	α-helix	trans	-69.5	-44	178.8	-174.1	174.4	1.7	0	0	111.9	D551 F556 L557	D551-Q553 PolarHBondContact O-N 3.49Å; D551-Q553 VanDerWaalsContact O-N 3.14Å; D551-Q553 PolarHBondContact OD1-N 3Å; D551-Q553 VanDerWaalsContact OD1-N 3.13Å; Q553-F556 PolarHBondContact O-N 2.65Å; Q553-L557 HydrophobicContact CG-CD1 4.25Å; Q553-L557 WeakPolarHBondContact O-CB 3.44Å; Q553-L557 WeakPolarHBondContact O-CG 3.47Å; Q553-L557 PolarHBondContact O-N 3.02Å
554	V	84.1	Confident	78.9	Confident	1 Å²	1	69.8 Å²	69.8	1%	0.006	36%	0.357	C	S	.	.	H	α-helix	trans	-66.3	-42.4	178.5	176.2	0	0	0	0	110.5	L541 H544 D551 F556 L557 R558	L541-V554 HydrophobicContact CD2-CG1 4.23Å; H544-V554 HydrophobicContact CB-CG1 4.35Å; H544-V554 HydrophobicContact CB-CG2 3.86Å; D551-V554 HydrophobicContact CB-CB 4.33Å; D551-V554 HydrophobicContact CB-CG2 4.05Å; D551-V554 PolarHBondContact O-N 3.39Å; V554-F556 VanDerWaalsContact C-N 3.33Å; V554-F556 PolarHBondContact O-N 3.22Å; V554-L557 PolarHBondContact O-N 3.35Å; V554-R558 VanDerWaalsContact CG1-NH2 3.32Å; V554-R558 WeakPolarHBondContact O-CG 3.43Å; V554-R558 PolarHBondContact O-N 3.35Å
555	I	85	Confident	79.7	Confident	55 Å²	55	69.1 Å²	69.1	28%	0.282	36%	0.356	S	S	.	.	H	α-helix	trans	-61	-43.7	175.5	-65.5	169	0	0	0	110.6	D551 R559	D551-I555 WeakPolarHBondContact O-CG1 3.22Å; D551-I555 PolarHBondContact O-N 2.97Å; I555-R559 VanDerWaalsContact CG2-CZ 3.43Å; I555-R559 VanDerWaalsContact CG2-NH2 3.25Å; I555-R559 WeakPolarHBondContact O-CG 3.43Å; I555-R559 PolarHBondContact O-N 3.33Å; I555-R559 VanDerWaalsContact O-N 3.11Å
556	F	87.6	Confident	80.7	Confident	34 Å²	34	62.5 Å²	62.5	15%	0.149	33%	0.326	C	S	.	.	H	α-helix	trans	-61.2	-49	174.8	166.8	-104.1	0	0	0	111.9	A324 I327 F328 S552 Q553 V554 R558 R559 F560	A324-F556 HydrophobicContact CB-CZ 4.13Å; A324-F556 WeakPolarHBondContact O-CE2 3.19Å; I327-F556 HydrophobicContact CB-CE2 4.29Å; I327-F556 HydrophobicContact CG2-CD2 4.45Å; I327-F556 HydrophobicContact CG2-CE2 4.17Å; F328-F556 HydrophobicContact CB-CD2 3.88Å; F328-F556 HydrophobicContact CB-CE2 3.65Å; F328-F556 HydrophobicContact CB-CZ 4.44Å; F328-F556 HydrophobicContact CD2-CB 4.36Å; F328-F556 AromaticContact CD2-CD2 3.76Å; F328-F556 HydrophobicContact CD2-CD2 3.76Å; F328-F556 HydrophobicContact CD2-CE2 4.23Å; F328-F556 AromaticContact CD2-CG 3.97Å; F328-F556 HydrophobicContact CD2-CG 3.97Å; F328-F556 HydrophobicContact CG-CD2 4.33Å; F328-F556 HydrophobicContact CG-CE2 4.46Å; S552-F556 WeakPolarHBondContact O-CB 3.4Å; S552-F556 PolarHBondContact O-N 3.43Å; Q553-F556 PolarHBondContact O-N 2.65Å; V554-F556 VanDerWaalsContact C-N 3.33Å; V554-F556 PolarHBondContact O-N 3.22Å; F556-R558 VanDerWaalsContact C-N 3.35Å; F556-R558 PolarHBondContact O-N 3.42Å; F556-R559 PolarHBondContact O-N 2.99Å; F556-R559 VanDerWaalsContact O-N 3.16Å; F556-F560 HydrophobicContact CE2-CB 4.49Å; F556-F560 HydrophobicContact CZ-CB 4.34Å; F556-F560 HydrophobicContact CZ-CD1 4.41Å; F556-F560 HydrophobicContact CZ-CG 4.46Å; F556-F560 WeakPolarHBondContact O-CB 3.3Å; F556-F560 PolarHBondContact O-N 2.72Å
557	L	87	Confident	82	Confident	11 Å²	11	57.6 Å²	57.6	6%	0.058	29%	0.291	C	S	.	.	H	α-helix	trans	-59.2	-43.7	179.3	-74.8	170.7	0	0	0	111.7	L537 Q540 L541 Q553 V554 R559 F560 M561	L537-L557 HydrophobicContact CD2-CD2 3.89Å; Q540-L557 HydrophobicContact CB-CD1 4.46Å; L541-L557 HydrophobicContact CD1-CB 3.9Å; L541-L557 HydrophobicContact CD2-CB 4.19Å; L541-L557 HydrophobicContact CG-CB 3.92Å; Q553-L557 HydrophobicContact CG-CD1 4.25Å; Q553-L557 WeakPolarHBondContact O-CB 3.44Å; Q553-L557 WeakPolarHBondContact O-CG 3.47Å; Q553-L557 PolarHBondContact O-N 3.02Å; V554-L557 PolarHBondContact O-N 3.35Å; L557-R559 PolarHBondContact O-N 3.02Å; L557-F560 PolarHBondContact O-N 3.11Å; L557-M561 WeakPolarHBondContact O-CB 3.41Å; L557-M561 PolarHBondContact O-N 3.49Å
558	R	87	Confident	83.6	Confident	107 Å²	107	57.1 Å²	57.1	40%	0.404	28%	0.283	S	S	.	.	H	α-helix	trans	-61.1	-42.7	175.6	-70.1	-173.6	-145.8	-90.5	0.7	111.9	L541 V554 F556 R562	L541-R558 HydrophobicContact CD2-CG 3.76Å; V554-R558 VanDerWaalsContact CG1-NH2 3.32Å; V554-R558 WeakPolarHBondContact O-CG 3.43Å; V554-R558 PolarHBondContact O-N 3.35Å; F556-R558 VanDerWaalsContact C-N 3.35Å; F556-R558 PolarHBondContact O-N 3.42Å; R558-R562 WeakPolarHBondContact O-CB 3.36Å; R558-R562 PolarHBondContact O-N 3.11Å
559	R	86.5	Confident	85.2	Confident	78 Å²	78	50.1 Å²	50.1	29%	0.294	25%	0.245	S	C	.	.	H	α-helix	trans	-64.8	-40.9	176.2	-70	174.1	-165.7	165.7	1.1	111.8	I327 N331 I555 F556 L557 R562 E563	I327-R559 HydrophobicContact CG2-CB 4.33Å; N331-R559 VanDerWaalsContact CA-NH1 3.35Å; N331-R559 PolarHBondContact O-NH1 3.1Å; N331-R559 PolarHBondContact OD1-NH1 3.5Å; I555-R559 VanDerWaalsContact CG2-CZ 3.43Å; I555-R559 VanDerWaalsContact CG2-NH2 3.25Å; I555-R559 WeakPolarHBondContact O-CG 3.43Å; I555-R559 PolarHBondContact O-N 3.33Å; I555-R559 VanDerWaalsContact O-N 3.11Å; F556-R559 PolarHBondContact O-N 2.99Å; F556-R559 VanDerWaalsContact O-N 3.16Å; L557-R559 PolarHBondContact O-N 3.02Å; R559-R562 PolarHBondContact O-N 3.39Å; R559-E563 PolarHBondContact O-N 3.44Å; R559-E563 VanDerWaalsContact O-N 3.09Å
560	F	88.4	Confident	86.8	Confident	27 Å²	27	48.5 Å²	48.5	12%	0.118	23%	0.233	C	C	.	.	H	α-helix	trans	-68.7	-42.6	179.6	-172.7	-147.5	0	0	0	111.6	A324 I327 L537 F556 L557 R562 E563 R564	A324-F560 HydrophobicContact CB-CE1 4.25Å; A324-F560 HydrophobicContact CB-CZ 4.17Å; I327-F560 HydrophobicContact CD1-CD2 3.45Å; I327-F560 VanDerWaalsContact CD1-CD2 3.45Å; I327-F560 HydrophobicContact CD1-CE2 3.94Å; I327-F560 HydrophobicContact CD1-CG 4.46Å; L537-F560 HydrophobicContact CD1-CD1 3.58Å; L537-F560 HydrophobicContact CD1-CE1 3.8Å; L537-F560 HydrophobicContact CD1-CG 4.04Å; L537-F560 HydrophobicContact CD1-CZ 4.46Å; L537-F560 HydrophobicContact CD2-CD1 3.47Å; L537-F560 VanDerWaalsContact CD2-CD1 3.47Å; L537-F560 HydrophobicContact CD2-CE1 3.83Å; L537-F560 HydrophobicContact CD2-CG 4.49Å; L537-F560 HydrophobicContact CG-CD1 4.16Å; L537-F560 HydrophobicContact CG-CE1 4.33Å; F556-F560 HydrophobicContact CE2-CB 4.49Å; F556-F560 HydrophobicContact CZ-CB 4.34Å; F556-F560 HydrophobicContact CZ-CD1 4.41Å; F556-F560 HydrophobicContact CZ-CG 4.46Å; F556-F560 WeakPolarHBondContact O-CB 3.3Å; F556-F560 PolarHBondContact O-N 2.72Å; L557-F560 PolarHBondContact O-N 3.11Å; F560-R562 PolarHBondContact O-N 2.82Å; F560-E563 PolarHBondContact O-N 3.34Å; F560-R564 HydrophobicContact CD2-CG 4.17Å; F560-R564 HydrophobicContact CE2-CG 3.96Å; F560-R564 HydrophobicContact CZ-CG 4.3Å; F560-R564 WeakPolarHBondContact O-CG 3.19Å; F560-R564 PolarHBondContact O-N 2.65Å
561	M	88.2	Confident	88.1	Confident	54 Å²	54	41.3 Å²	41.3	27%	0.266	20%	0.195	S	C	.	.	H	α-helix	trans	-57.4	-47.2	171.8	-177.1	-143.1	-95	0	0	110.9	L534 E538 L541 L557 E563 R564 T565	L534-M561 HydrophobicContact CD1-CG 3.77Å; E538-M561 HydrophobicContact CG-CE 4.16Å; L541-M561 HydrophobicContact CB-CE 4.42Å; L541-M561 HydrophobicContact CD1-CB 4.19Å; L541-M561 HydrophobicContact CD1-CE 3.46Å; L541-M561 VanDerWaalsContact CD1-CE 3.46Å; L541-M561 HydrophobicContact CD1-SD 4.43Å; L557-M561 WeakPolarHBondContact O-CB 3.41Å; L557-M561 PolarHBondContact O-N 3.49Å; M561-E563 VanDerWaalsContact C-N 3.33Å; M561-E563 PolarHBondContact O-N 3.04Å; M561-R564 PolarHBondContact O-N 3.33Å; M561-T565 WeakPolarHBondContact O-CB 3.34Å; M561-T565 PolarHBondContact O-N 2.9Å; M561-T565 PolarHBondContact O-OG1 2.98Å
562	R	88.4	Confident	88.8	Confident	68 Å²	68	39 Å²	39	26%	0.257	18%	0.184	S	C	.	.	H	α-helix	trans	-56.9	-44.4	177.3	-176.1	177.9	-179.6	-177.2	-1.3	112.5	I335 T340 E342 R558 R559 F560 T565 A566	I335-R562 VanDerWaalsContact CD1-NH2 3.28Å; T340-R562 PolarHBondContact O-NH2 2.83Å; E342-R562 IonicContact OE1-CZ 2.71Å; E342-R562 IonicContact OE1-NH1 3.44Å; E342-R562 PolarHBondContact OE1-NH1 2.92Å; R558-R562 WeakPolarHBondContact O-CB 3.36Å; R558-R562 PolarHBondContact O-N 3.11Å; R559-R562 PolarHBondContact O-N 3.39Å; F560-R562 PolarHBondContact O-N 2.82Å; R562-T565 PolarHBondContact O-N 3.27Å; R562-A566 PolarHBondContact O-N 2.82Å
563	E	88.7	Confident	89.5	Confident	1 Å²	1	34.9 Å²	34.9	1%	0.005	16%	0.155	C	C	.	.	H	α-helix	trans	-63.9	-46.4	176.7	-167.6	-83.7	173.1	0	0	111.4	Q322 I327 A333 R559 F560 M561 T565 A566 R567	Q322-E563 PolarHBondContact N-OE1 3.11Å; Q322-E563 VanDerWaalsContact N-OE1 3.12Å; I327-E563 HydrophobicContact CD1-CB 4.02Å; I327-E563 HydrophobicContact CD1-CG 3.98Å; A333-E563 HydrophobicContact CB-CB 4.1Å; R559-E563 PolarHBondContact O-N 3.44Å; R559-E563 VanDerWaalsContact O-N 3.09Å; F560-E563 PolarHBondContact O-N 3.34Å; M561-E563 VanDerWaalsContact C-N 3.33Å; M561-E563 PolarHBondContact O-N 3.04Å; E563-T565 VanDerWaalsContact C-N 3.35Å; E563-T565 PolarHBondContact O-N 3Å; E563-A566 PolarHBondContact O-N 3.24Å; E563-R567 WeakPolarHBondContact O-CG 3.37Å; E563-R567 PolarHBondContact O-N 3.27Å; E563-R567 VanDerWaalsContact OE1-CG 3.29Å; E563-R567 WeakPolarHBondContact OE1-CG 3.32Å; E563-R567 IonicContact OE1-NH1 2.62Å; E563-R567 PolarHBondContact OE1-NH1 3.4Å
564	R	89.3	Confident	90	Very high	13 Å²	13	29.5 Å²	29.5	5%	0.049	13%	0.131	C	C	.	.	H	α-helix	trans	-60.3	-42.4	176.9	-71.6	-62.9	100.3	145	14.2	112.2	P321 Q322 L534 L537 F560 M561 R567 Y568	P321-R564 VanDerWaalsContact CB-NH1 3.3Å; Q322-R564 PolarHBondContact O-NH2 3.06Å; L534-R564 HydrophobicContact CD1-CB 4.05Å; L537-R564 HydrophobicContact CD1-CB 4.34Å; L537-R564 HydrophobicContact CD1-CG 3.7Å; F560-R564 HydrophobicContact CD2-CG 4.17Å; F560-R564 HydrophobicContact CE2-CG 3.96Å; F560-R564 HydrophobicContact CZ-CG 4.3Å; F560-R564 WeakPolarHBondContact O-CG 3.19Å; F560-R564 PolarHBondContact O-N 2.65Å; M561-R564 PolarHBondContact O-N 3.33Å; R564-R567 PolarHBondContact O-N 2.93Å; R564-Y568 VanDerWaalsContact O-CB 3.3Å; R564-Y568 WeakPolarHBondContact O-CB 3.47Å; R564-Y568 PolarHBondContact O-N 3.35Å
565	T	91.8	Very high	90.5	Very high	31 Å²	31	29.4 Å²	29.4	19%	0.19	13%	0.13	C	C	.	.	H	α-helix	trans	-60.5	-48	176.3	-60.3	0	0	0	0	111.1	P344 L534 M561 R562 E563 R567 Y568 L569	P344-T565 HydrophobicContact CG-CG2 3.9Å; L534-T565 WeakPolarHBondContact CD1-OG1 3.31Å; M561-T565 WeakPolarHBondContact O-CB 3.34Å; M561-T565 PolarHBondContact O-N 2.9Å; M561-T565 PolarHBondContact O-OG1 2.98Å; R562-T565 PolarHBondContact O-N 3.27Å; E563-T565 VanDerWaalsContact C-N 3.35Å; E563-T565 PolarHBondContact O-N 3Å; T565-R567 PolarHBondContact O-N 2.62Å; T565-Y568 PolarHBondContact O-N 3.02Å; T565-L569 HydrophobicContact CG2-CD1 4.18Å; T565-L569 WeakPolarHBondContact O-CG 3.44Å; T565-L569 PolarHBondContact O-N 3.09Å
566	A	91.3	Very high	90.9	Very high	4 Å²	4	27.1 Å²	27.1	3%	0.033	12%	0.119	C	C	.	.	H	α-helix	trans	-60.4	-47.4	177.8	0	0	0	0	0	111.6	I335 R562 E563 Y568 L569 E570	I335-A566 HydrophobicContact CG2-CB 4.27Å; R562-A566 PolarHBondContact O-N 2.82Å; E563-A566 PolarHBondContact O-N 3.24Å; A566-Y568 VanDerWaalsContact C-N 3.34Å; A566-Y568 PolarHBondContact O-N 2.84Å; A566-L569 PolarHBondContact O-N 3.15Å; A566-E570 VanDerWaalsContact O-CG 3.31Å; A566-E570 WeakPolarHBondContact O-CG 3.44Å; A566-E570 PolarHBondContact O-N 3.14Å
567	R	90.4	Very high	91.2	Very high	6 Å²	6	25.6 Å²	25.6	2%	0.023	11%	0.113	C	C	.	.	H	α-helix	trans	-60.6	-42	176.7	-64.8	-59.1	100.8	106	-8.8	112.3	H319 P321 T530 E563 R564 T565 E570 Q571	H319-R567 WeakPolarHBondContact O-CD 3.43Å; P321-R567 HydrophobicContact CB-CG 4.38Å; T530-R567 HydrophobicContact CG2-CB 4.43Å; E563-R567 WeakPolarHBondContact O-CG 3.37Å; E563-R567 PolarHBondContact O-N 3.27Å; E563-R567 VanDerWaalsContact OE1-CG 3.29Å; E563-R567 WeakPolarHBondContact OE1-CG 3.32Å; E563-R567 IonicContact OE1-NH1 2.62Å; E563-R567 PolarHBondContact OE1-NH1 3.4Å; R564-R567 PolarHBondContact O-N 2.93Å; T565-R567 PolarHBondContact O-N 2.62Å; R567-E570 IonicContact CZ-OE1 3.97Å; R567-E570 IonicContact CZ-OE2 3.92Å; R567-E570 IonicContact NE-OE1 3.13Å; R567-E570 PolarHBondContact NE-OE1 3.29Å; R567-E570 IonicContact NE-OE2 3.86Å; R567-E570 PolarHBondContact NE-OE2 3.47Å; R567-E570 IonicContact NH2-OE1 3.52Å; R567-E570 PolarHBondContact NH2-OE1 2.86Å; R567-E570 IonicContact NH2-OE2 3Å; R567-E570 PolarHBondContact O-N 3.21Å; R567-Q571 WeakPolarHBondContact O-CB 3.04Å; R567-Q571 VanDerWaalsContact O-CD 3.24Å; R567-Q571 WeakPolarHBondContact O-CG 3.41Å; R567-Q571 PolarHBondContact O-N 3.05Å
568	Y	92.8	Very high	91.4	Very high	81 Å²	81	28.4 Å²	28.4	32%	0.318	13%	0.126	S	C	.	.	H	α-helix	trans	-61.6	-43.5	176.9	-178.8	-95.1	0	0	0	111.7	H527 R564 T565 A566 Q571 S572	H527-Y568 AromaticContact CE1-CD2 3.52Å; H527-Y568 AromaticContact CE1-CE2 3.11Å; H527-Y568 WeakPolarHBondContact CE1-CE2 3.49Å; H527-Y568 AromaticContact CE1-CZ 3.41Å; H527-Y568 VanDerWaalsContact CE1-CZ 3.41Å; H527-Y568 AromaticContact ND1-CD2 3.67Å; H527-Y568 AromaticContact ND1-CE2 3.64Å; H527-Y568 AromaticContact NE2-CE2 3.75Å; H527-Y568 AromaticContact NE2-CZ 3.9Å; R564-Y568 VanDerWaalsContact O-CB 3.3Å; R564-Y568 WeakPolarHBondContact O-CB 3.47Å; R564-Y568 PolarHBondContact O-N 3.35Å; T565-Y568 PolarHBondContact O-N 3.02Å; A566-Y568 VanDerWaalsContact C-N 3.34Å; A566-Y568 PolarHBondContact O-N 2.84Å; Y568-Q571 PolarHBondContact O-N 3.34Å; Y568-S572 VanDerWaalsContact O-CB 3.23Å; Y568-S572 WeakPolarHBondContact O-CB 3.47Å; Y568-S572 PolarHBondContact O-N 3.01Å
569	L	93.8	Very high	91.7	Very high	19 Å²	19	24.3 Å²	24.3	10%	0.099	11%	0.114	C	C	.	.	H	α-helix	trans	-66	-42.1	176.1	-68.5	176.1	0	0	0	112	F339 P344 V349 T565 A566 T573	F339-L569 HydrophobicContact CB-CB 4.39Å; F339-L569 HydrophobicContact CB-CD1 4.12Å; F339-L569 HydrophobicContact CD1-CB 3.93Å; F339-L569 HydrophobicContact CD1-CD1 3.91Å; F339-L569 HydrophobicContact CD2-CB 3.93Å; F339-L569 HydrophobicContact CE1-CB 4.22Å; F339-L569 HydrophobicContact CE2-CB 4.2Å; F339-L569 HydrophobicContact CG-CB 3.79Å; F339-L569 HydrophobicContact CG-CD1 4.1Å; F339-L569 HydrophobicContact CZ-CB 4.35Å; P344-L569 HydrophobicContact CB-CD1 3.96Å; P344-L569 HydrophobicContact CG-CD1 3.87Å; V349-L569 HydrophobicContact CG1-CD2 3.94Å; V349-L569 HydrophobicContact CG2-CD1 4Å; T565-L569 HydrophobicContact CG2-CD1 4.18Å; T565-L569 WeakPolarHBondContact O-CG 3.44Å; T565-L569 PolarHBondContact O-N 3.09Å; A566-L569 PolarHBondContact O-N 3.15Å; L569-T573 VanDerWaalsContact O-CB 3.27Å; L569-T573 WeakPolarHBondContact O-CB 3.44Å; L569-T573 PolarHBondContact O-N 3.43Å; L569-T573 PolarHBondContact O-OG1 2.97Å
570	E	93.5	Very high	92.1	Very high	2 Å²	2	20.9 Å²	20.9	1%	0.009	10%	0.101	C	C	.	.	H	α-helix	trans	-59.1	-49.2	174.7	-69.8	169.4	-168.5	0	0	111.3	H317 L318 H319 F339 A566 R567 T573 S574	H317-E570 PolarHBondContact CD2-O 3.03Å; H317-E570 PolarHBondContact NE2-O 2.92Å; H317-E570 WeakPolarHBondContact O-CG 3.29Å; L318-E570 HydrophobicContact CD2-CB 4.13Å; L318-E570 WeakPolarHBondContact CD2-O 3.46Å; H319-E570 IonicContact CG-OE2 3.64Å; H319-E570 PolarHBondContact N-OE2 3.48Å; H319-E570 IonicContact ND1-OE1 3.19Å; H319-E570 PolarHBondContact ND1-OE1 3.29Å; H319-E570 IonicContact ND1-OE2 2.98Å; H319-E570 PolarHBondContact ND1-OE2 2.98Å; F339-E570 HydrophobicContact CD2-CG 3.77Å; F339-E570 HydrophobicContact CE2-CG 4.09Å; A566-E570 VanDerWaalsContact O-CG 3.31Å; A566-E570 WeakPolarHBondContact O-CG 3.44Å; A566-E570 PolarHBondContact O-N 3.14Å; R567-E570 IonicContact CZ-OE1 3.97Å; R567-E570 IonicContact CZ-OE2 3.92Å; R567-E570 IonicContact NE-OE1 3.13Å; R567-E570 PolarHBondContact NE-OE1 3.29Å; R567-E570 IonicContact NE-OE2 3.86Å; R567-E570 PolarHBondContact NE-OE2 3.47Å; R567-E570 IonicContact NH2-OE1 3.52Å; R567-E570 PolarHBondContact NH2-OE1 2.86Å; R567-E570 IonicContact NH2-OE2 3Å; R567-E570 PolarHBondContact O-N 3.21Å; E570-T573 PolarHBondContact O-N 3.07Å; E570-S574 PolarHBondContact O-N 3.48Å
571	Q	94	Very high	92.5	Very high	2 Å²	2	19.7 Å²	19.7	1%	0.009	10%	0.096	C	C	.	.	H	α-helix	trans	-61.7	-50.4	178.8	-69.1	160.1	2.7	0	0	111.5	L318 L523 H527 T530 R567 Y568 T573 S574 L575	L318-Q571 HydrophobicContact CD2-CG 4.3Å; L523-Q571 HydrophobicContact CD1-CB 4.5Å; L523-Q571 HydrophobicContact CD1-CG 4.06Å; H527-Q571 HydrophobicContact CB-CB 4.27Å; T530-Q571 PolarHBondContact OG1-NE2 2.81Å; T530-Q571 PolarHBondContact OG1-OE1 2.65Å; R567-Q571 WeakPolarHBondContact O-CB 3.04Å; R567-Q571 VanDerWaalsContact O-CD 3.24Å; R567-Q571 WeakPolarHBondContact O-CG 3.41Å; R567-Q571 PolarHBondContact O-N 3.05Å; Y568-Q571 PolarHBondContact O-N 3.34Å; Q571-T573 VanDerWaalsContact C-N 3.29Å; Q571-T573 PolarHBondContact O-N 2.95Å; Q571-S574 PolarHBondContact O-N 3.07Å; Q571-L575 WeakPolarHBondContact O-CG 3.38Å; Q571-L575 PolarHBondContact O-N 2.69Å
572	S	93.6	Very high	92.8	Very high	21 Å²	21	20.7 Å²	20.7	15%	0.147	10%	0.099	C	C	.	.	H	α-helix	trans	-55.5	-46.5	176	-174.7	0	0	0	0	110.8	Y568 S574 L575 S576	Y568-S572 VanDerWaalsContact O-CB 3.23Å; Y568-S572 WeakPolarHBondContact O-CB 3.47Å; Y568-S572 PolarHBondContact O-N 3.01Å; S572-S574 PolarHBondContact O-N 3.3Å; S572-L575 PolarHBondContact O-N 3.4Å; S572-S576 WeakPolarHBondContact O-CB 3.32Å; S572-S576 PolarHBondContact O-N 2.61Å; S572-S576 PolarHBondContact O-OG 2.91Å
573	T	95.1	Very high	93.2	Very high	0 Å²	0	18.7 Å²	18.7	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-59.1	-45.1	177.9	-56.6	0	0	0	0	112	F339 Q353 I356 W357 L569 E570 Q571 S576 C577	F339-T573 HydrophobicContact CZ-CG2 4.43Å; F339-T573 WeakPolarHBondContact CZ-OG1 3.43Å; Q353-T573 HydrophobicContact CB-CG2 4.27Å; Q353-T573 HydrophobicContact CG-CG2 3.78Å; Q353-T573 VanDerWaalsContact CG-OG1 3.27Å; Q353-T573 WeakPolarHBondContact CG-OG1 3.42Å; Q353-T573 PolarHBondContact NE2-OG1 3.19Å; I356-T573 HydrophobicContact CB-CG2 3.96Å; I356-T573 HydrophobicContact CD1-CG2 3.85Å; I356-T573 HydrophobicContact CG2-CG2 3.71Å; W357-T573 PolarHBondContact NE1-O 3.32Å; L569-T573 VanDerWaalsContact O-CB 3.27Å; L569-T573 WeakPolarHBondContact O-CB 3.44Å; L569-T573 PolarHBondContact O-N 3.43Å; L569-T573 PolarHBondContact O-OG1 2.97Å; E570-T573 PolarHBondContact O-N 3.07Å; Q571-T573 VanDerWaalsContact C-N 3.29Å; Q571-T573 PolarHBondContact O-N 2.95Å; T573-S576 PolarHBondContact O-N 2.67Å; T573-C577 PolarHBondContact O-N 2.93Å
574	S	94.6	Very high	93.5	Very high	4 Å²	4	19.1 Å²	19.1	3%	0.028	10%	0.095	C	C	.	.	H	α-helix	trans	-67.2	-42	179	-173.6	0	0	0	0	112.6	S430 E570 Q571 S572 S576 C577	S430-S574 PolarHBondContact OG-OG 3.19Å; E570-S574 PolarHBondContact O-N 3.48Å; Q571-S574 PolarHBondContact O-N 3.07Å; S572-S574 PolarHBondContact O-N 3.3Å; S574-S576 PolarHBondContact O-N 3.3Å; S574-C577 WeakPolarHBondContact O-CB 3.44Å; S574-C577 PolarHBondContact O-N 3.28Å
575	L	94.4	Very high	93.9	Very high	0 Å²	0	18.5 Å²	18.5	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-70.9	-22.3	-179.5	-68.6	171.6	0	0	0	112.5	W520 L523 I524 H527 Q571 S572 Y645	W520-L575 HydrophobicContact CD2-CD2 3.8Å; W520-L575 HydrophobicContact CE3-CD2 4.01Å; W520-L575 VanDerWaalsContact CH2-CA 3.47Å; W520-L575 HydrophobicContact CH2-CB 4.36Å; W520-L575 HydrophobicContact CH2-CD2 3.97Å; W520-L575 WeakPolarHBondContact CH2-O 3.49Å; W520-L575 HydrophobicContact CZ2-CB 4.31Å; W520-L575 HydrophobicContact CZ2-CD2 3.68Å; W520-L575 WeakPolarHBondContact CZ2-O 3.11Å; W520-L575 HydrophobicContact CZ3-CD2 4.1Å; L523-L575 HydrophobicContact CB-CD2 4.26Å; L523-L575 HydrophobicContact CD2-CD2 3.78Å; L523-L575 HydrophobicContact CD2-CG 4.01Å; L523-L575 HydrophobicContact CG-CD1 4.33Å; L523-L575 HydrophobicContact CG-CD2 3.9Å; L523-L575 HydrophobicContact CG-CG 4.08Å; I524-L575 HydrophobicContact CG1-CD1 4.31Å; I524-L575 HydrophobicContact CG1-CD2 3.83Å; H527-L575 HydrophobicContact CB-CD1 3.66Å; Q571-L575 WeakPolarHBondContact O-CG 3.38Å; Q571-L575 PolarHBondContact O-N 2.69Å; S572-L575 PolarHBondContact O-N 3.4Å; L575-Y645 HydrophobicContact CB-CE1 4.05Å; L575-Y645 HydrophobicContact CB-CE2 4.22Å; L575-Y645 WeakPolarHBondContact CB-OH 3.04Å; L575-Y645 HydrophobicContact CD1-CE2 3.94Å
576	S	91.6	Very high	94.1	Very high	6 Å²	6	17.1 Å²	17.1	4%	0.042	8%	0.084	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.7	2.9	179.1	-54.5	0	0	0	0	114.1	S572 T573 S574 M578 K650	S572-S576 WeakPolarHBondContact O-CB 3.32Å; S572-S576 PolarHBondContact O-N 2.61Å; S572-S576 PolarHBondContact O-OG 2.91Å; T573-S576 PolarHBondContact O-N 2.67Å; S574-S576 PolarHBondContact O-N 3.3Å; S576-M578 PolarHBondContact O-N 3.45Å; S576-K650 VanDerWaalsContact CB-CE 3.44Å; S576-K650 WeakPolarHBondContact OG-CE 3.45Å; S576-K650 PolarHBondContact OG-NZ 2.8Å
577	C	94.2	Very high	94.5	Very high	3 Å²	3	17 Å²	17	2%	0.02	8%	0.083	C	C	.	.			trans	-63.2	110.1	-178.9	-178.6	0	0	0	0	110.3	T573 S574 S579 R580 L581	T573-C577 PolarHBondContact O-N 2.93Å; S574-C577 WeakPolarHBondContact O-CB 3.44Å; S574-C577 PolarHBondContact O-N 3.28Å; C577-S579 VanDerWaalsContact C-N 3.34Å; C577-S579 PolarHBondContact O-N 3.09Å; C577-R580 HydrophobicContact CB-CB 4.3Å; C577-R580 HydrophobicContact CB-CG 4.45Å; C577-R580 PolarHBondContact O-N 2.87Å; C577-L581 VanDerWaalsContact O-CB 3.3Å; C577-L581 WeakPolarHBondContact O-CB 3.42Å; C577-L581 PolarHBondContact O-N 3.33Å
578	M	91.8	Very high	94.8	Very high	70 Å²	70	17 Å²	17	35%	0.345	8%	0.084	S	C	.	.	H	α-helix	trans	-54.4	-45.2	-168.4	-168.4	70.9	78.2	0	0	113.3	S576 K582 F653 E658	S576-M578 PolarHBondContact O-N 3.45Å; M578-K582 VanDerWaalsContact O-CB 3.3Å; M578-K582 WeakPolarHBondContact O-CB 3.44Å; M578-K582 PolarHBondContact O-N 3.21Å; M578-F653 HydrophobicContact SD-CD2 3.64Å; M578-F653 HydrophobicContact SD-CE2 3.39Å; M578-F653 WeakPolarHBondContact SD-CE2 3.39Å; M578-E658 HydrophobicContact CG-CB 4.28Å; M578-E658 HydrophobicContact CG-CG 3.88Å; M578-E658 HydrophobicContact SD-CB 4.26Å; M578-E658 HydrophobicContact SD-CG 4.07Å
579	S	93.4	Very high	95	Very high	20 Å²	20	13.1 Å²	13.1	14%	0.14	7%	0.069	C	C	.	.	H	α-helix	trans	-66.7	-46.4	-178.6	57.8	0	0	0	0	112.1	C577 K582 D583	C577-S579 VanDerWaalsContact C-N 3.34Å; C577-S579 PolarHBondContact O-N 3.09Å; S579-K582 PolarHBondContact O-N 3.29Å; S579-D583 PolarHBondContact O-N 3.23Å
580	R	95.6	Very high	95.1	Very high	6 Å²	6	12.3 Å²	12.3	2%	0.023	7%	0.065	C	C	.	.	H	α-helix	trans	-65.4	-39.7	176.6	-66.8	-175.6	177.7	-171.3	0.9	112.3	D364 S430 N431 A434 C577 D583 Q584	D364-R580 IonicContact OD1-CZ 3.14Å; D364-R580 IonicContact OD1-NE 2.75Å; D364-R580 IonicContact OD1-NH2 2.86Å; D364-R580 PolarHBondContact OD1-NH2 3.14Å; D364-R580 WeakPolarHBondContact OD2-CG 3.37Å; D364-R580 IonicContact OD2-CZ 3.44Å; D364-R580 IonicContact OD2-NE 3.95Å; D364-R580 PolarHBondContact OD2-NE 3.31Å; D364-R580 IonicContact OD2-NH2 2.65Å; D364-R580 PolarHBondContact OD2-NH2 3.01Å; S430-R580 PolarHBondContact OG-NH1 3.24Å; N431-R580 PolarHBondContact OD1-NH1 3.38Å; N431-R580 PolarHBondContact OD1-NH2 2.67Å; A434-R580 HydrophobicContact CB-CG 4.2Å; C577-R580 HydrophobicContact CB-CB 4.3Å; C577-R580 HydrophobicContact CB-CG 4.45Å; C577-R580 PolarHBondContact O-N 2.87Å; R580-D583 PolarHBondContact O-N 3.29Å; R580-Q584 WeakPolarHBondContact O-CG 3.32Å; R580-Q584 PolarHBondContact O-N 3.14Å
581	L	95.4	Very high	95.3	Very high	3 Å²	3	12.2 Å²	12.2	2%	0.016	7%	0.065	C	C	.	.	H	α-helix	trans	-67.7	-39.7	179.6	-167.2	63.5	0	0	0	111.3	W520 C577 Q584 L585 L642 L646 F653	W520-L581 HydrophobicContact CH2-CD1 4.48Å; W520-L581 HydrophobicContact CZ2-CD1 3.89Å; C577-L581 VanDerWaalsContact O-CB 3.3Å; C577-L581 WeakPolarHBondContact O-CB 3.42Å; C577-L581 PolarHBondContact O-N 3.33Å; L581-Q584 PolarHBondContact O-N 3.24Å; L581-L585 WeakPolarHBondContact O-CB 3.35Å; L581-L585 PolarHBondContact O-N 2.97Å; L581-L642 HydrophobicContact CD1-CD1 3.97Å; L581-L646 HydrophobicContact CD1-CD2 3.75Å; L581-L646 HydrophobicContact CD2-CD2 3.73Å; L581-L646 HydrophobicContact CG-CD2 3.99Å; L581-F653 HydrophobicContact CB-CE1 4.32Å; L581-F653 HydrophobicContact CB-CE2 4.29Å; L581-F653 HydrophobicContact CB-CZ 3.88Å; L581-F653 HydrophobicContact CD2-CB 4.46Å; L581-F653 HydrophobicContact CD2-CD1 3.72Å; L581-F653 HydrophobicContact CD2-CD2 3.76Å; L581-F653 HydrophobicContact CD2-CE1 3.75Å; L581-F653 HydrophobicContact CD2-CE2 3.8Å; L581-F653 HydrophobicContact CD2-CG 3.7Å; L581-F653 HydrophobicContact CD2-CZ 3.77Å; L581-F653 HydrophobicContact CG-CD1 4Å; L581-F653 HydrophobicContact CG-CD2 4.5Å; L581-F653 HydrophobicContact CG-CE1 3.55Å; L581-F653 HydrophobicContact CG-CE2 4.11Å; L581-F653 HydrophobicContact CG-CG 4.43Å; L581-F653 HydrophobicContact CG-CZ 3.6Å
582	K	95.6	Very high	95.5	Very high	75 Å²	75	12.1 Å²	12.1	33%	0.326	6%	0.064	S	C	.	.	H	α-helix	trans	-60.5	-47.8	171.5	174.6	178.3	177.5	163	0	111.6	M578 S579 Q584 L585 S586 F653 E658 V659 I662	M578-K582 VanDerWaalsContact O-CB 3.3Å; M578-K582 WeakPolarHBondContact O-CB 3.44Å; M578-K582 PolarHBondContact O-N 3.21Å; S579-K582 PolarHBondContact O-N 3.29Å; K582-Q584 VanDerWaalsContact C-N 3.3Å; K582-Q584 PolarHBondContact O-N 3.43Å; K582-L585 PolarHBondContact O-N 3.18Å; K582-S586 WeakPolarHBondContact O-CB 3.45Å; K582-S586 PolarHBondContact O-N 3.29Å; K582-F653 HydrophobicContact CB-CZ 4.39Å; K582-E658 WeakPolarHBondContact CD-O 3.31Å; K582-E658 WeakPolarHBondContact CE-O 3.43Å; K582-E658 PolarHBondContact NZ-O 3.33Å; K582-V659 HydrophobicContact CB-CG1 4.25Å; K582-V659 HydrophobicContact CG-CG1 4.23Å; K582-I662 HydrophobicContact CG-CD1 4.02Å
583	D	96.3	Very high	95.6	Very high	25 Å²	25	14.2 Å²	14.2	13%	0.134	7%	0.069	C	C	.	.	H	α-helix	trans	-60.4	-42.9	-179.9	-72.5	-12.6	0	0	0	110.8	V437 R438 V444 S579 R580 F587	V437-D583 HydrophobicContact CG1-CB 4.26Å; R438-D583 IonicContact CZ-OD2 2.75Å; R438-D583 IonicContact NE-OD2 3.59Å; R438-D583 PolarHBondContact NE-OD2 3.11Å; R438-D583 IonicContact NH2-OD2 2.89Å; R438-D583 PolarHBondContact NH2-OD2 3.22Å; V444-D583 HydrophobicContact CG1-CB 3.86Å; V444-D583 VanDerWaalsContact CG1-OD1 3.31Å; V444-D583 WeakPolarHBondContact CG1-OD1 3.43Å; S579-D583 PolarHBondContact O-N 3.23Å; R580-D583 PolarHBondContact O-N 3.29Å; D583-F587 WeakPolarHBondContact O-CB 3.39Å; D583-F587 PolarHBondContact O-N 3.1Å
584	Q	96.1	Very high	95.6	Very high	10 Å²	10	14.3 Å²	14.3	5%	0.047	7%	0.069	C	C	.	.	H	α-helix	trans	-67.2	-42.7	176.6	-75.9	-176.8	49.7	0	0	113.7	W520 R580 L581 K582 S586 F587 A588 L642	W520-Q584 VanDerWaalsContact CD2-OE1 3.25Å; W520-Q584 VanDerWaalsContact CG-OE1 3.23Å; W520-Q584 VanDerWaalsContact NE1-OE1 3.09Å; R580-Q584 WeakPolarHBondContact O-CG 3.32Å; R580-Q584 PolarHBondContact O-N 3.14Å; L581-Q584 PolarHBondContact O-N 3.24Å; K582-Q584 VanDerWaalsContact C-N 3.3Å; K582-Q584 PolarHBondContact O-N 3.43Å; Q584-S586 VanDerWaalsContact C-N 3.34Å; Q584-F587 PolarHBondContact O-N 3.46Å; Q584-A588 WeakPolarHBondContact O-CB 3.28Å; Q584-A588 PolarHBondContact O-N 2.78Å; Q584-L642 HydrophobicContact CB-CD1 4.3Å; Q584-L642 HydrophobicContact CB-CD2 4.1Å
585	L	96.9	Very high	95.7	Very high	0 Å²	0	14.1 Å²	14.1	0%	0	7%	0.068	C	C	.	.	H	α-helix	trans	-61.9	-44.9	176.4	179.8	63.8	0	0	0	110.8	L581 K582 F587 A588 V589 L646 F653 L654 V659 I662 L667	L581-L585 WeakPolarHBondContact O-CB 3.35Å; L581-L585 PolarHBondContact O-N 2.97Å; K582-L585 PolarHBondContact O-N 3.18Å; L585-F587 VanDerWaalsContact C-N 3.35Å; L585-F587 PolarHBondContact O-N 3.22Å; L585-A588 PolarHBondContact O-N 2.83Å; L585-V589 HydrophobicContact CD1-CG2 4.29Å; L585-V589 WeakPolarHBondContact O-CB 3.32Å; L585-V589 VanDerWaalsContact O-CG2 3.32Å; L585-V589 WeakPolarHBondContact O-CG2 3.39Å; L585-V589 PolarHBondContact O-N 3.39Å; L585-L646 HydrophobicContact CD1-CD1 4.26Å; L585-F653 HydrophobicContact CB-CE1 4.29Å; L585-F653 HydrophobicContact CD2-CD1 4.46Å; L585-F653 HydrophobicContact CD2-CE1 3.84Å; L585-L654 HydrophobicContact CD1-CD2 4.21Å; L585-L654 HydrophobicContact CD2-CD2 3.88Å; L585-V659 HydrophobicContact CD2-CB 4.1Å; L585-V659 HydrophobicContact CD2-CG1 4.03Å; L585-V659 HydrophobicContact CD2-CG2 4.42Å; L585-I662 HydrophobicContact CB-CD1 4.47Å; L585-I662 HydrophobicContact CD2-CD1 4.29Å; L585-I662 HydrophobicContact CG-CD1 4.39Å; L585-I662 HydrophobicContact CG-CG2 4.32Å; L585-L667 HydrophobicContact CD1-CD1 4.39Å
586	S	96.9	Very high	95.7	Very high	2 Å²	2	14.4 Å²	14.4	1%	0.014	7%	0.069	C	C	.	.	H	α-helix	trans	-60.9	-45	177.3	-166.5	0	0	0	0	111.5	V444 K582 Q584 A588 V589 T590	V444-S586 WeakPolarHBondContact CA-OG 3.26Å; V444-S586 WeakPolarHBondContact O-CB 3.16Å; V444-S586 PolarHBondContact O-OG 3.14Å; K582-S586 WeakPolarHBondContact O-CB 3.45Å; K582-S586 PolarHBondContact O-N 3.29Å; Q584-S586 VanDerWaalsContact C-N 3.34Å; S586-A588 PolarHBondContact O-N 2.8Å; S586-V589 PolarHBondContact O-N 2.83Å; S586-T590 WeakPolarHBondContact O-CB 3.26Å; S586-T590 PolarHBondContact O-N 3.43Å; S586-T590 PolarHBondContact O-OG1 3.46Å; S586-T590 VanDerWaalsContact O-OG1 3.14Å
587	F	97.8	Very high	95.8	Very high	3 Å²	3	16.4 Å²	16.4	1%	0.013	8%	0.078	C	C	.	.	H	α-helix	trans	-61.9	-42.8	175.9	-173.5	-109.4	0	0	0	112.6	V437 T440 L443 V444 F509 A512 H513 I516 D583 Q584 L585 T590 T591	V437-F587 HydrophobicContact CG1-CB 4.11Å; V437-F587 HydrophobicContact CG1-CG 4.33Å; T440-F587 HydrophobicContact CG2-CD2 4.41Å; T440-F587 HydrophobicContact CG2-CE2 3.84Å; L443-F587 HydrophobicContact CB-CD2 4.24Å; L443-F587 HydrophobicContact CD1-CE2 4.04Å; V444-F587 HydrophobicContact CG2-CB 4.15Å; V444-F587 HydrophobicContact CG2-CD2 4.48Å; F509-F587 AromaticContact CD2-CE2 3.86Å; F509-F587 HydrophobicContact CD2-CE2 3.86Å; F509-F587 AromaticContact CD2-CZ 3.7Å; F509-F587 HydrophobicContact CD2-CZ 3.7Å; F509-F587 HydrophobicContact CE2-CE2 4.38Å; F509-F587 HydrophobicContact CE2-CZ 4.02Å; A512-F587 HydrophobicContact CB-CE1 4.2Å; A512-F587 HydrophobicContact CB-CE2 4.34Å; A512-F587 HydrophobicContact CB-CZ 3.81Å; H513-F587 AromaticContact CD2-CE1 3.6Å; H513-F587 AromaticContact CD2-CZ 3.62Å; H513-F587 AromaticContact CE1-CE1 3.55Å; H513-F587 AromaticContact CG-CE1 3.82Å; H513-F587 AromaticContact ND1-CE1 3.79Å; H513-F587 AromaticContact NE2-CE1 3.43Å; H513-F587 WeakPolarHBondContact NE2-CE1 3.16Å; H513-F587 AromaticContact NE2-CZ 3.67Å; I516-F587 HydrophobicContact CD1-CD1 3.74Å; I516-F587 HydrophobicContact CD1-CE1 3.76Å; D583-F587 WeakPolarHBondContact O-CB 3.39Å; D583-F587 PolarHBondContact O-N 3.1Å; Q584-F587 PolarHBondContact O-N 3.46Å; L585-F587 VanDerWaalsContact C-N 3.35Å; L585-F587 PolarHBondContact O-N 3.22Å; F587-T590 PolarHBondContact O-N 3.08Å; F587-T591 WeakPolarHBondContact O-CB 3.19Å; F587-T591 PolarHBondContact O-N 3.38Å; F587-T591 PolarHBondContact O-OG1 2.98Å
588	A	97.4	Very high	95.7	Very high	5 Å²	5	16.5 Å²	16.5	4%	0.041	8%	0.078	C	C	.	.	H	α-helix	trans	-64.4	-43.2	176.9	0	0	0	0	0	112.2	Q584 L585 S586 T591 C592 V639 L642	Q584-A588 WeakPolarHBondContact O-CB 3.28Å; Q584-A588 PolarHBondContact O-N 2.78Å; L585-A588 PolarHBondContact O-N 2.83Å; S586-A588 PolarHBondContact O-N 2.8Å; A588-T591 WeakPolarHBondContact O-CB 3.29Å; A588-T591 PolarHBondContact O-N 3.47Å; A588-C592 PolarHBondContact O-N 2.85Å; A588-C592 PolarHBondContact O-SG 3.46Å; A588-V639 HydrophobicContact CB-CG2 4.09Å; A588-L642 HydrophobicContact CB-CD2 3.69Å
589	V	97.2	Very high	95.7	Very high	0 Å²	0	13.1 Å²	13.1	0%	0	6%	0.061	C	C	.	.	H	α-helix	trans	-61.9	-44.8	175.7	166.5	0	0	0	0	111	L585 S586 T591 C592 R593 I662 P663 P666 L667	L585-V589 HydrophobicContact CD1-CG2 4.29Å; L585-V589 WeakPolarHBondContact O-CB 3.32Å; L585-V589 VanDerWaalsContact O-CG2 3.32Å; L585-V589 WeakPolarHBondContact O-CG2 3.39Å; L585-V589 PolarHBondContact O-N 3.39Å; S586-V589 PolarHBondContact O-N 2.83Å; V589-T591 VanDerWaalsContact C-N 3.3Å; V589-T591 PolarHBondContact O-N 3.04Å; V589-C592 WeakPolarHBondContact O-CB 3.32Å; V589-C592 PolarHBondContact O-N 3.21Å; V589-R593 PolarHBondContact O-N 3.32Å; V589-I662 HydrophobicContact CB-CG2 4.07Å; V589-I662 HydrophobicContact CG1-CG2 4.18Å; V589-I662 HydrophobicContact CG2-CG2 3.75Å; V589-P663 HydrophobicContact CG1-CG 4.29Å; V589-P663 VanDerWaalsContact CG1-O 3.31Å; V589-P663 WeakPolarHBondContact CG1-O 3.33Å; V589-P666 HydrophobicContact CG1-CB 4.07Å; V589-P666 HydrophobicContact CG1-CG 3.76Å; V589-L667 HydrophobicContact CG2-CD1 4.05Å; V589-L667 HydrophobicContact CG2-CG 4.06Å
590	T	96.6	Very high	95.6	Very high	1 Å²	1	15 Å²	15	1%	0.006	7%	0.07	C	C	.	.	H	α-helix	trans	-62.9	-37.8	175.3	-65.9	0	0	0	0	112.1	L443 P450 L452 S586 F587 R593 L594	L443-T590 HydrophobicContact CB-CG2 3.88Å; L443-T590 HydrophobicContact CD2-CG2 3.68Å; L443-T590 HydrophobicContact CG-CG2 4.25Å; L443-T590 WeakPolarHBondContact O-CB 3.32Å; L443-T590 PolarHBondContact O-OG1 2.98Å; P450-T590 HydrophobicContact CB-CG2 3.52Å; P450-T590 HydrophobicContact CG-CG2 3.68Å; L452-T590 HydrophobicContact CD2-CG2 3.87Å; S586-T590 WeakPolarHBondContact O-CB 3.26Å; S586-T590 PolarHBondContact O-N 3.43Å; S586-T590 PolarHBondContact O-OG1 3.46Å; S586-T590 VanDerWaalsContact O-OG1 3.14Å; F587-T590 PolarHBondContact O-N 3.08Å; T590-R593 PolarHBondContact O-N 3.18Å; T590-L594 PolarHBondContact O-N 3.41Å
591	T	97.5	Very high	95.2	Very high	1 Å²	1	15.8 Å²	15.8	1%	0.006	7%	0.074	C	C	.	.	H	α-helix	trans	-62.2	-44.8	173.2	-56.1	0	0	0	0	111	F509 H513 F587 A588 V589 R593 L594 L595 V639	F509-T591 HydrophobicContact CE2-CG2 4.34Å; F509-T591 HydrophobicContact CZ-CG2 4.25Å; H513-T591 WeakPolarHBondContact NE2-CG2 3.47Å; H513-T591 PolarHBondContact NE2-OG1 2.76Å; H513-T591 VanDerWaalsContact NE2-OG1 3.14Å; F587-T591 WeakPolarHBondContact O-CB 3.19Å; F587-T591 PolarHBondContact O-N 3.38Å; F587-T591 PolarHBondContact O-OG1 2.98Å; A588-T591 WeakPolarHBondContact O-CB 3.29Å; A588-T591 PolarHBondContact O-N 3.47Å; V589-T591 VanDerWaalsContact C-N 3.3Å; V589-T591 PolarHBondContact O-N 3.04Å; T591-R593 VanDerWaalsContact C-N 3.33Å; T591-R593 PolarHBondContact O-N 3.41Å; T591-L594 WeakPolarHBondContact O-CB 3.48Å; T591-L594 PolarHBondContact O-N 3.48Å; T591-L595 HydrophobicContact CG2-CD1 4.26Å; T591-L595 WeakPolarHBondContact O-CG 2.81Å; T591-L595 PolarHBondContact O-N 3.45Å; T591-V639 HydrophobicContact CG2-CG2 4.38Å
592	C	97.3	Very high	94.8	Very high	0 Å²	0	17.3 Å²	17.3	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-60.9	-41.6	175.9	-66.5	0	0	0	0	111.9	A588 V589 L594 L595 V596 P666 F670	A588-C592 PolarHBondContact O-N 2.85Å; A588-C592 PolarHBondContact O-SG 3.46Å; V589-C592 WeakPolarHBondContact O-CB 3.32Å; V589-C592 PolarHBondContact O-N 3.21Å; C592-L594 VanDerWaalsContact C-N 3.34Å; C592-L594 PolarHBondContact O-N 3.18Å; C592-L595 PolarHBondContact O-N 3.09Å; C592-V596 WeakPolarHBondContact O-CB 3.25Å; C592-V596 VanDerWaalsContact O-CG2 3.29Å; C592-V596 WeakPolarHBondContact O-CG2 3.41Å; C592-V596 PolarHBondContact O-N 2.89Å; C592-P666 HydrophobicContact CB-CB 4.04Å; C592-P666 WeakPolarHBondContact CB-O 3.3Å; C592-F670 HydrophobicContact CB-CB 3.82Å; C592-F670 HydrophobicContact CB-CG 4.13Å
593	R	95.4	Very high	94.3	Very high	65 Å²	65	15.6 Å²	15.6	25%	0.245	8%	0.076	C	C	.	.	H	α-helix	trans	-58.9	-43.3	173.9	-70.6	-174.9	174.7	-79	-2.7	112.2	P447 L452 V589 T590 T591 K597 P666	P447-R593 PolarHBondContact O-NE 3.25Å; L452-R593 HydrophobicContact CD1-CB 4.02Å; V589-R593 PolarHBondContact O-N 3.32Å; T590-R593 PolarHBondContact O-N 3.18Å; T591-R593 VanDerWaalsContact C-N 3.33Å; T591-R593 PolarHBondContact O-N 3.41Å; R593-K597 WeakPolarHBondContact O-CB 3.1Å; R593-K597 PolarHBondContact O-N 3.37Å; R593-P666 HydrophobicContact CG-CB 3.49Å; R593-P666 VanDerWaalsContact CG-CB 3.49Å; R593-P666 HydrophobicContact CG-CG 3.39Å; R593-P666 VanDerWaalsContact CZ-CG 3.48Å
594	L	95.6	Very high	93.7	Very high	1 Å²	1	18.7 Å²	18.7	1%	0.005	9%	0.093	C	C	.	.	H	α-helix	trans	-59.9	-49.6	175.9	178.5	65.8	0	0	0	111	L452 I455 F509 T590 T591 C592 V596 K597 L598 F623	L452-L594 HydrophobicContact CB-CD1 4.33Å; L452-L594 HydrophobicContact CD2-CB 4.15Å; I455-L594 HydrophobicContact CB-CD2 4.22Å; I455-L594 HydrophobicContact CD1-CD2 4.05Å; I455-L594 HydrophobicContact CG2-CD2 3.73Å; F509-L594 HydrophobicContact CE1-CD2 4.38Å; F509-L594 HydrophobicContact CE2-CD2 4.43Å; F509-L594 HydrophobicContact CZ-CD2 3.98Å; T590-L594 PolarHBondContact O-N 3.41Å; T591-L594 WeakPolarHBondContact O-CB 3.48Å; T591-L594 PolarHBondContact O-N 3.48Å; C592-L594 VanDerWaalsContact C-N 3.34Å; C592-L594 PolarHBondContact O-N 3.18Å; L594-V596 PolarHBondContact O-N 3.42Å; L594-K597 PolarHBondContact O-N 3.41Å; L594-L598 HydrophobicContact CD1-CD1 4.18Å; L594-L598 HydrophobicContact CD1-CG 4.39Å; L594-L598 HydrophobicContact CG-CD1 4.13Å; L594-L598 WeakPolarHBondContact O-CG 3.32Å; L594-L598 PolarHBondContact O-N 2.87Å; L594-F623 HydrophobicContact CD1-CE2 4.27Å; L594-F623 HydrophobicContact CD1-CZ 3.89Å
595	L	95.9	Very high	92.8	Very high	1 Å²	1	22 Å²	22	1%	0.005	11%	0.107	C	C	.	.	H	α-helix	trans	-61.4	-44.5	-179.4	-67.8	176.3	0	0	0	111.7	L479 T591 C592 L598 A599 L628 L631 V636 F670 F674	L479-L595 HydrophobicContact CD1-CD2 3.71Å; T591-L595 HydrophobicContact CG2-CD1 4.26Å; T591-L595 WeakPolarHBondContact O-CG 2.81Å; T591-L595 PolarHBondContact O-N 3.45Å; C592-L595 PolarHBondContact O-N 3.09Å; L595-L598 PolarHBondContact O-N 3.08Å; L595-A599 VanDerWaalsContact O-CB 3.3Å; L595-A599 WeakPolarHBondContact O-CB 3.34Å; L595-A599 PolarHBondContact O-N 3.27Å; L595-L628 HydrophobicContact CD2-CD1 3.88Å; L595-L631 HydrophobicContact CD2-CD1 3.67Å; L595-V636 HydrophobicContact CD1-CG2 3.92Å; L595-F670 HydrophobicContact CB-CD2 4.16Å; L595-F670 HydrophobicContact CB-CE2 4.39Å; L595-F670 HydrophobicContact CD1-CD2 4.03Å; L595-F670 HydrophobicContact CD1-CE2 3.59Å; L595-F670 HydrophobicContact CD1-CZ 4.25Å; L595-F674 HydrophobicContact CB-CE2 4.05Å; L595-F674 HydrophobicContact CB-CZ 3.75Å; L595-F674 WeakPolarHBondContact O-CZ 3.42Å
596	V	94.9	Very high	91.2	Very high	5 Å²	5	27.4 Å²	27.4	3%	0.03	14%	0.136	C	C	.	.	H	α-helix	trans	-64.5	-42.3	176.7	170.3	0	0	0	0	111.6	C592 L594 A599 N600 E669 F670 I673	C592-V596 WeakPolarHBondContact O-CB 3.25Å; C592-V596 VanDerWaalsContact O-CG2 3.29Å; C592-V596 WeakPolarHBondContact O-CG2 3.41Å; C592-V596 PolarHBondContact O-N 2.89Å; L594-V596 PolarHBondContact O-N 3.42Å; V596-A599 PolarHBondContact O-N 3.43Å; V596-N600 WeakPolarHBondContact O-CB 3.36Å; V596-N600 PolarHBondContact O-N 2.94Å; V596-N600 PolarHBondContact O-ND2 2.98Å; V596-E669 HydrophobicContact CG1-CB 4.27Å; V596-E669 HydrophobicContact CG2-CB 3.99Å; V596-F670 HydrophobicContact CG2-CB 3.88Å; V596-I673 HydrophobicContact CG1-CD1 3.81Å; V596-I673 HydrophobicContact CG2-CD1 4.38Å
597	K	93.1	Very high	89.6	Confident	49 Å²	49	30.3 Å²	30.3	21%	0.213	16%	0.156	C	C	.	.	H	α-helix	trans	-59.6	-48.7	176.1	-178	172.2	175.9	-179.8	0	111.2	L452 D453 R593 L594 A599 N600 D601 F623	L452-K597 HydrophobicContact CD1-CD 4.29Å; D453-K597 IonicContact OD1-NZ 3.91Å; D453-K597 PolarHBondContact OD1-NZ 3.16Å; R593-K597 WeakPolarHBondContact O-CB 3.1Å; R593-K597 PolarHBondContact O-N 3.37Å; L594-K597 PolarHBondContact O-N 3.41Å; K597-A599 VanDerWaalsContact C-N 3.35Å; K597-A599 PolarHBondContact O-N 2.84Å; K597-N600 PolarHBondContact O-N 3.03Å; K597-D601 PolarHBondContact O-N 3Å; K597-F623 HydrophobicContact CD-CD2 4.31Å; K597-F623 HydrophobicContact CD-CE2 3.94Å; K597-F623 HydrophobicContact CG-CE2 4.49Å
598	L	92.9	Very high	87.5	Confident	4 Å²	4	34.2 Å²	34.2	2%	0.021	18%	0.184	C	C	.	.	H	α-helix	trans	-64.8	-37	177.8	-68	173.4	0	0	0	112.6	P457 L594 L595 I602 F623 L628 L631	P457-L598 HydrophobicContact CG-CD1 3.82Å; P457-L598 HydrophobicContact CG-CD2 4.44Å; L594-L598 HydrophobicContact CD1-CD1 4.18Å; L594-L598 HydrophobicContact CD1-CG 4.39Å; L594-L598 HydrophobicContact CG-CD1 4.13Å; L594-L598 WeakPolarHBondContact O-CG 3.32Å; L594-L598 PolarHBondContact O-N 2.87Å; L595-L598 PolarHBondContact O-N 3.08Å; L598-I602 WeakPolarHBondContact O-CG1 3.46Å; L598-I602 PolarHBondContact O-N 2.96Å; L598-F623 HydrophobicContact CD2-CB 3.87Å; L598-F623 HydrophobicContact CD2-CD1 4.04Å; L598-F623 HydrophobicContact CD2-CD2 3.77Å; L598-F623 HydrophobicContact CD2-CE2 4.28Å; L598-F623 HydrophobicContact CD2-CG 3.61Å; L598-L628 HydrophobicContact CB-CB 4.48Å; L598-L628 HydrophobicContact CB-CD1 4.39Å; L598-L631 HydrophobicContact CD1-CD1 3.67Å
599	A	92.4	Very high	85.1	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-62.9	-48.7	174.5	0	0	0	0	0	111.8	L595 V596 K597 D601 I602 L603 I673 F674 L680	L595-A599 VanDerWaalsContact O-CB 3.3Å; L595-A599 WeakPolarHBondContact O-CB 3.34Å; L595-A599 PolarHBondContact O-N 3.27Å; V596-A599 PolarHBondContact O-N 3.43Å; K597-A599 VanDerWaalsContact C-N 3.35Å; K597-A599 PolarHBondContact O-N 2.84Å; A599-D601 VanDerWaalsContact C-N 3.3Å; A599-D601 PolarHBondContact O-N 3.06Å; A599-I602 WeakPolarHBondContact O-CB 3.43Å; A599-I602 PolarHBondContact O-N 3.26Å; A599-L603 WeakPolarHBondContact O-CG 3.28Å; A599-L603 PolarHBondContact O-N 3.15Å; A599-I673 HydrophobicContact CB-CG2 4.04Å; A599-F674 HydrophobicContact CB-CE2 3.8Å; A599-F674 HydrophobicContact CB-CZ 3.96Å; A599-L680 HydrophobicContact CB-CD1 3.74Å
600	N	91.2	Very high	82.3	Confident	60 Å²	60	45.9 Å²	45.9	32%	0.321	25%	0.253	S	S	.	.	H	α-helix	trans	-62.9	-36.3	179.2	-74.3	-28.1	0	0	0	112.2	V596 K597 I602 L603 N604	V596-N600 WeakPolarHBondContact O-CB 3.36Å; V596-N600 PolarHBondContact O-N 2.94Å; V596-N600 PolarHBondContact O-ND2 2.98Å; K597-N600 PolarHBondContact O-N 3.03Å; N600-I602 PolarHBondContact O-N 2.95Å; N600-L603 PolarHBondContact O-N 3.33Å; N600-N604 VanDerWaalsContact O-CB 3.28Å; N600-N604 WeakPolarHBondContact O-CB 3.32Å; N600-N604 PolarHBondContact O-N 3.45Å; N600-N604 PolarHBondContact O-ND2 3.11Å
601	D	87.3	Confident	79.2	Confident	21 Å²	21	50.8 Å²	50.8	11%	0.112	29%	0.287	C	S	.	.	H	α-helix	trans	-60.2	-33.6	173.4	-80.9	-0.8	0	0	0	112.6	K597 A599 K605 F623	K597-D601 PolarHBondContact O-N 3Å; A599-D601 VanDerWaalsContact C-N 3.3Å; A599-D601 PolarHBondContact O-N 3.06Å; D601-K605 WeakPolarHBondContact O-CD 3.22Å; D601-K605 VanDerWaalsContact O-CG 3.28Å; D601-K605 WeakPolarHBondContact O-CG 3.33Å; D601-F623 PolarHBondContact OD2-N 2.9Å
602	I	86	Confident	75.9	Confident	36 Å²	36	58.2 Å²	58.2	19%	0.185	33%	0.327	C	S	.	.	H	α-helix	trans	-76.4	-47.1	175.6	-65.2	167.7	0	0	0	110.4	L598 A599 N600 N604 K605 N606 L628 L680	L598-I602 WeakPolarHBondContact O-CG1 3.46Å; L598-I602 PolarHBondContact O-N 2.96Å; A599-I602 WeakPolarHBondContact O-CB 3.43Å; A599-I602 PolarHBondContact O-N 3.26Å; N600-I602 PolarHBondContact O-N 2.95Å; I602-N604 PolarHBondContact O-N 3.02Å; I602-K605 PolarHBondContact O-N 3.13Å; I602-N606 PolarHBondContact O-N 3.3Å; I602-L628 HydrophobicContact CD1-CB 3.65Å; I602-L628 HydrophobicContact CD1-CD2 4.23Å; I602-L680 HydrophobicContact CB-CD2 4.37Å; I602-L680 HydrophobicContact CD1-CD2 4.18Å; I602-L680 HydrophobicContact CG2-CD2 4.18Å
603	L	86	Confident	72.8	Confident	38 Å²	38	65.4 Å²	65.4	20%	0.199	36%	0.364	C	S	.	.	H	α-helix	trans	-63.6	-39.6	-177.4	-66.2	173.1	0	0	0	112.2	A599 N600 K605 N606 S607 I673 L680	A599-L603 WeakPolarHBondContact O-CG 3.28Å; A599-L603 PolarHBondContact O-N 3.15Å; N600-L603 PolarHBondContact O-N 3.33Å; L603-K605 PolarHBondContact O-N 2.92Å; L603-N606 PolarHBondContact O-N 3.35Å; L603-S607 PolarHBondContact O-N 3.38Å; L603-S607 PolarHBondContact O-OG 3.4Å; L603-I673 HydrophobicContact CD1-CG2 4.19Å; L603-L680 HydrophobicContact CD1-CD1 4.2Å; L603-L680 HydrophobicContact CD2-CD1 4.4Å; L603-L680 HydrophobicContact CG-CD1 4.35Å
604	N	84.3	Confident	69.6	Low	90 Å²	90	68 Å²	68	48%	0.481	39%	0.387	S	S	.	.	H	α-helix	trans	-70.8	-28.1	178.9	-70.5	-25.5	0	0	0	113.5	N600 I602 S607 S608	N600-N604 VanDerWaalsContact O-CB 3.28Å; N600-N604 WeakPolarHBondContact O-CB 3.32Å; N600-N604 PolarHBondContact O-N 3.45Å; N600-N604 PolarHBondContact O-ND2 3.11Å; I602-N604 PolarHBondContact O-N 3.02Å; N604-S607 WeakPolarHBondContact CA-OG 3.41Å; N604-S607 PolarHBondContact O-OG 3.35Å; N604-S607 VanDerWaalsContact O-OG 3.06Å; N604-S608 PolarHBondContact O-N 3.01Å; N604-S608 PolarHBondContact O-OG 2.91Å
605	K	75.7	Confident	66.4	Low	81 Å²	81	75 Å²	75	35%	0.352	43%	0.43	S	S	.	.	H	α-helix	trans	-69.6	-39.8	173.4	-76.3	172.9	-173.8	171	0	111.2	F486 D601 I602 L603 S607 S608	F486-K605 HydrophobicContact CZ-CD 4.32Å; D601-K605 WeakPolarHBondContact O-CD 3.22Å; D601-K605 VanDerWaalsContact O-CG 3.28Å; D601-K605 WeakPolarHBondContact O-CG 3.33Å; I602-K605 PolarHBondContact O-N 3.13Å; L603-K605 PolarHBondContact O-N 2.92Å; K605-S607 VanDerWaalsContact C-N 3.3Å; K605-S607 PolarHBondContact O-N 3.33Å; K605-S608 PolarHBondContact O-N 3.1Å; K605-S608 PolarHBondContact O-OG 3.18Å; K605-S608 VanDerWaalsContact O-OG 3.1Å
606	N	64.8	Low	63.2	Low	113 Å²	113	80.5 Å²	80.5	60%	0.604	47%	0.468	S	S	*	.	H	α-helix	trans	-69.2	-27.7	-179.9	-65.6	-14	0	0	0	112.9	I602 L603	I602-N606 PolarHBondContact O-N 3.3Å; L603-N606 PolarHBondContact O-N 3.35Å
607	S	62.1	Low	60.2	Low	63 Å²	63	86.6 Å²	86.6	44%	0.441	51%	0.506	S	S	.	.	H	α-helix	trans	-82.6	-29.4	177.9	50.8	0	0	0	0	113.8	L603 N604 K605 D609 S610	L603-S607 PolarHBondContact O-N 3.38Å; L603-S607 PolarHBondContact O-OG 3.4Å; N604-S607 WeakPolarHBondContact CA-OG 3.41Å; N604-S607 PolarHBondContact O-OG 3.35Å; N604-S607 VanDerWaalsContact O-OG 3.06Å; K605-S607 VanDerWaalsContact C-N 3.3Å; K605-S607 PolarHBondContact O-N 3.33Å; S607-D609 VanDerWaalsContact C-N 3.27Å; S607-D609 PolarHBondContact O-N 2.94Å; S607-S610 PolarHBondContact O-N 3.32Å; S607-S610 VanDerWaalsContact O-N 3.13Å; S607-S610 PolarHBondContact O-OG 3.4Å; S607-S610 VanDerWaalsContact O-OG 3.06Å
608	S	53.4	Low	57.2	Low	84 Å²	84	89.4 Å²	89.4	59%	0.587	53%	0.531	S	S	*	.	H	α-helix	trans	-71.8	-15.8	-179.1	37.8	0	0	0	0	114.6	N604 K605 S610	N604-S608 PolarHBondContact O-N 3.01Å; N604-S608 PolarHBondContact O-OG 2.91Å; K605-S608 PolarHBondContact O-N 3.1Å; K605-S608 PolarHBondContact O-OG 3.18Å; K605-S608 VanDerWaalsContact O-OG 3.1Å; S608-S610 VanDerWaalsContact C-N 3.25Å; S608-S610 PolarHBondContact O-N 3.21Å
609	D	47.1	Very low	54.4	Low	157 Å²	157	96.5 Å²	96.5	84%	0.84	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.4	-1.8	170.3	-81.4	-19.3	0	0	0	113.6	S607	S607-D609 VanDerWaalsContact C-N 3.27Å; S607-D609 PolarHBondContact O-N 2.94Å
610	S	39.9	Very low	52.1	Low	93 Å²	93	100.7 Å²	100.7	65%	0.65	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	-126.9	-5.5	-173.1	55.1	0	0	0	0	118.6	S607 S608	S607-S610 PolarHBondContact O-N 3.32Å; S607-S610 VanDerWaalsContact O-N 3.13Å; S607-S610 PolarHBondContact O-OG 3.4Å; S607-S610 VanDerWaalsContact O-OG 3.06Å; S608-S610 VanDerWaalsContact C-N 3.25Å; S608-S610 PolarHBondContact O-N 3.21Å
611	S	30.4	Very low	50.2	Low	104 Å²	104	102.5 Å²	102.5	73%	0.727	61%	0.612	S	S	*	*			trans	-174.9	149	160.7	44.1	0	0	0	0	114.4
612	N	29.2	Very low	48.8	Very low	158 Å²	158	105.5 Å²	105.5	85%	0.845	63%	0.633	S	S	*	*			trans	-79.6	147.6	179.9	-88.9	-33.1	0	0	0	113.6
613	I	31.7	Very low	47.7	Very low	150 Å²	150	105 Å²	105	77%	0.769	63%	0.629	S	S	*	*			trans	97.2	101.6	154.8	-64.7	161.1	0	0	0	119.1
614	T	27.9	Very low	47	Very low	121 Å²	121	107.4 Å²	107.4	74%	0.742	65%	0.649	S	S	*	*			trans	54.3	111.2	136.9	68	0	0	0	0	122.2
615	T	29.3	Very low	46.7	Very low	146 Å²	146	105.9 Å²	105.9	90%	0.896	64%	0.639	S	S	*	*				-144.1	120.8	123.3	13.5	0	0	0	0	109.7
616	S	28.1	Very low	47	Very low	117 Å²	117	103 Å²	103	82%	0.818	63%	0.633	S	S	*	*			trans	-81.9	114.4	178.1	49.7	0	0	0	0	110.8
617	T	31.3	Very low	48.1	Very low	134 Å²	134	98.4 Å²	98.4	82%	0.822	61%	0.609	S	S	*	*			trans	-135.8	134.9	150.4	29.6	0	0	0	0	108.6
618	S	30.9	Very low	49.4	Very low	107 Å²	107	95.5 Å²	95.5	75%	0.748	59%	0.589	S	S	*	*	S	Bend	trans	-61.8	150.5	-163.8	43.3	0	0	0	0	116.2
619	D	34.5	Very low	51.1	Low	153 Å²	153	92.1 Å²	92.1	82%	0.818	57%	0.565	S	S	*	*			trans	85.9	44.2	161	-59.7	-13.4	0	0	0	120
620	S	43.5	Very low	53.2	Low	88 Å²	88	85.9 Å²	85.9	62%	0.615	53%	0.532	S	S	*	.			trans	-112.1	78.5	163.1	56.4	0	0	0	0	112.1
621	T	50.8	Low	55.8	Low	99 Å²	99	81.5 Å²	81.5	61%	0.607	50%	0.501	S	S	*	.	P	Polyproline II helix	trans	-71.7	127.1	158.9	46.9	0	0	0	0	108	F623	T621-F623 PolarHBondContact O-N 2.9Å
622	P	57.6	Low	58.8	Low	84 Å²	84	76.5 Å²	76.5	55%	0.545	47%	0.466	S	S	.	.	P	Polyproline II helix	trans	-62.1	135.4	-179.1	23	-31.4	0	0	0	110.1	S624	P622-S624 PolarHBondContact O-N 3.44Å; P622-S624 VanDerWaalsContact O-N 3.11Å
623	F	62.6	Low	61.8	Low	25 Å²	25	69.9 Å²	69.9	11%	0.11	43%	0.43	C	S	.	.	P	Polyproline II helix	trans	-56.2	117.8	175.6	-119.6	-89.7	0	0	0	110.7	L452 I455 L594 K597 L598 D601 T621	L452-F623 WeakPolarHBondContact O-CZ 3.48Å; I455-F623 VanDerWaalsContact O-CE1 3.27Å; I455-F623 WeakPolarHBondContact O-CE1 3.32Å; L594-F623 HydrophobicContact CD1-CE2 4.27Å; L594-F623 HydrophobicContact CD1-CZ 3.89Å; K597-F623 HydrophobicContact CD-CD2 4.31Å; K597-F623 HydrophobicContact CD-CE2 3.94Å; K597-F623 HydrophobicContact CG-CE2 4.49Å; L598-F623 HydrophobicContact CD2-CB 3.87Å; L598-F623 HydrophobicContact CD2-CD1 4.04Å; L598-F623 HydrophobicContact CD2-CD2 3.77Å; L598-F623 HydrophobicContact CD2-CE2 4.28Å; L598-F623 HydrophobicContact CD2-CG 3.61Å; D601-F623 PolarHBondContact OD2-N 2.9Å; T621-F623 PolarHBondContact O-N 2.9Å
624	S	71	Confident	64.7	Low	88 Å²	88	63.4 Å²	63.4	62%	0.615	40%	0.396	S	S	*	.	S	Bend	trans	-86.2	-17.4	-175.4	53.8	0	0	0	0	114	P622	P622-S624 PolarHBondContact O-N 3.44Å; P622-S624 VanDerWaalsContact O-N 3.11Å
625	H	79.8	Confident	67.9	Low	58 Å²	58	57.6 Å²	57.6	27%	0.269	36%	0.361	S	S	.	.	S	Bend	trans	-118.7	59.3	-166.2	-67.4	-72.7	0	0	0	113.2	W456 P457 E458	W456-H625 HydrophobicContact CB-CB 3.84Å; W456-H625 AromaticContact CD1-CG 3.91Å; W456-H625 HydrophobicContact CD2-CB 3.74Å; W456-H625 AromaticContact CD2-CG 3.61Å; W456-H625 AromaticContact CD2-ND1 3.86Å; W456-H625 AromaticContact CE2-CD2 3.49Å; W456-H625 VanDerWaalsContact CE2-CD2 3.49Å; W456-H625 AromaticContact CE2-CG 3.57Å; W456-H625 AromaticContact CE2-ND1 3.95Å; W456-H625 AromaticContact CE2-NE2 3.91Å; W456-H625 HydrophobicContact CE3-CB 4.37Å; W456-H625 AromaticContact CE3-ND1 3.85Å; W456-H625 HydrophobicContact CG-CB 3.45Å; W456-H625 VanDerWaalsContact CG-CB 3.45Å; W456-H625 AromaticContact CG-CG 3.87Å; W456-H625 AromaticContact CH2-CE1 3.83Å; W456-H625 AromaticContact CZ2-CD2 3.77Å; W456-H625 AromaticContact CZ2-CE1 3.82Å; W456-H625 AromaticContact CZ2-NE2 3.66Å; W456-H625 AromaticContact CZ3-ND1 3.99Å; W456-H625 AromaticContact NE1-CD2 3.5Å; W456-H625 AromaticContact NE1-CG 3.74Å; P457-H625 WeakPolarHBondContact CD-O 3.38Å; E458-H625 PolarHBondContact N-O 3.28Å; E458-H625 WeakPolarHBondContact OE1-CB 3.31Å; E458-H625 IonicContact OE1-CG 3.7Å; E458-H625 IonicContact OE1-ND1 2.87Å; E458-H625 PolarHBondContact OE1-ND1 2.96Å
626	G	80.9	Confident	71.1	Confident	21 Å²	21	50.7 Å²	50.7	22%	0.216	32%	0.318	C	S	.	.			trans	100.7	178.9	178.9	0	0	0	0	0	114.1	D630	G626-D630 VanDerWaalsContact CA-OD2 3.31Å; G626-D630 WeakPolarHBondContact CA-OD2 3.45Å
627	C	88.5	Confident	74.2	Confident	17 Å²	17	46.3 Å²	46.3	12%	0.115	29%	0.286	C	S	.	.			trans	-142.2	-177.1	-175.6	70.6	0	0	0	0	112.5	P457 S629 D630	P457-C627 WeakPolarHBondContact CB-O 3.38Å; C627-S629 PolarHBondContact O-N 2.91Å; C627-S629 PolarHBondContact SG-OG 3.49Å; C627-D630 PolarHBondContact N-OD2 2.88Å; C627-D630 WeakPolarHBondContact O-CB 3.41Å; C627-D630 PolarHBondContact O-N 3.41Å; C627-D630 VanDerWaalsContact O-N 3.13Å
628	L	90.1	Very high	77.2	Confident	1 Å²	1	40.4 Å²	40.4	1%	0.005	25%	0.249	C	C	.	.	G	3₁₀ helix	trans	-59.7	-31.7	-177.2	-169.1	66.6	0	0	0	113.2	L479 L595 L598 I602 D630 L631 F674 L680	L479-L628 HydrophobicContact CD1-CD1 3.89Å; L595-L628 HydrophobicContact CD2-CD1 3.88Å; L598-L628 HydrophobicContact CB-CB 4.48Å; L598-L628 HydrophobicContact CB-CD1 4.39Å; I602-L628 HydrophobicContact CD1-CB 3.65Å; I602-L628 HydrophobicContact CD1-CD2 4.23Å; L628-D630 PolarHBondContact O-N 3.4Å; L628-L631 HydrophobicContact CD1-CD1 4.41Å; L628-L631 PolarHBondContact O-N 3.15Å; L628-F674 HydrophobicContact CD1-CE1 4.04Å; L628-F674 HydrophobicContact CD1-CZ 3.97Å; L628-F674 HydrophobicContact CD2-CE1 3.92Å; L628-F674 HydrophobicContact CD2-CZ 4.08Å; L628-L680 HydrophobicContact CD2-CB 3.93Å; L628-L680 HydrophobicContact CD2-CD2 3.84Å; L628-L680 HydrophobicContact CD2-CG 4.42Å; L628-L680 WeakPolarHBondContact CD2-O 3.28Å
629	S	89.1	Confident	80.4	Confident	14 Å²	14	35.3 Å²	35.3	10%	0.098	21%	0.214	C	C	.	.	G	3₁₀ helix	trans	-71.7	-13.8	179.6	61.1	0	0	0	0	114.1	P481 C627 L631	P481-S629 WeakPolarHBondContact O-CB 2.9Å; C627-S629 PolarHBondContact O-N 2.91Å; C627-S629 PolarHBondContact SG-OG 3.49Å; S629-L631 VanDerWaalsContact C-N 3.34Å
630	D	90.2	Very high	83.2	Confident	26 Å²	26	28 Å²	28	14%	0.139	18%	0.175	C	C	.	.	G	3₁₀ helix	trans	-78	-23.5	174.2	-62	-55.1	0	0	0	112	P457 A460 T461 R478 G626 C627 L628	P457-D630 HydrophobicContact CB-CB 3.91Å; P457-D630 WeakPolarHBondContact O-CB 3.03Å; A460-D630 VanDerWaalsContact CB-O 3.27Å; A460-D630 WeakPolarHBondContact CB-O 3.23Å; T461-D630 HydrophobicContact CG2-CB 3.96Å; T461-D630 WeakPolarHBondContact CG2-OD1 3.27Å; T461-D630 PolarHBondContact OG1-OD1 3.13Å; R478-D630 WeakPolarHBondContact CD-O 3.44Å; R478-D630 PolarHBondContact NE-O 2.93Å; R478-D630 VanDerWaalsContact NE-O 3.12Å; G626-D630 VanDerWaalsContact CA-OD2 3.31Å; G626-D630 WeakPolarHBondContact CA-OD2 3.45Å; C627-D630 PolarHBondContact N-OD2 2.88Å; C627-D630 WeakPolarHBondContact O-CB 3.41Å; C627-D630 PolarHBondContact O-N 3.41Å; C627-D630 VanDerWaalsContact O-N 3.13Å; L628-D630 PolarHBondContact O-N 3.4Å
631	L	93.9	Very high	85.6	Confident	0 Å²	0	24.7 Å²	24.7	0%	0	15%	0.149	C	C	.	.	S	Bend	trans	-82.3	139.2	-172	-66.9	179.9	0	0	0	112.7	P457 R478 L479 F510 L595 L598 L628 S629 L635	P457-L631 HydrophobicContact CB-CD2 3.84Å; P457-L631 HydrophobicContact CB-CG 4.03Å; P457-L631 HydrophobicContact CG-CD2 4.23Å; P457-L631 HydrophobicContact CG-CG 4.38Å; R478-L631 WeakPolarHBondContact CA-O 3.45Å; R478-L631 WeakPolarHBondContact CD-O 3.35Å; L479-L631 HydrophobicContact CD1-CB 3.76Å; L479-L631 HydrophobicContact CG-CB 4.45Å; L479-L631 PolarHBondContact N-O 2.85Å; F510-L631 HydrophobicContact CE1-CD2 4.06Å; F510-L631 HydrophobicContact CZ-CD2 3.79Å; L595-L631 HydrophobicContact CD2-CD1 3.67Å; L598-L631 HydrophobicContact CD1-CD1 3.67Å; L628-L631 HydrophobicContact CD1-CD1 4.41Å; L628-L631 PolarHBondContact O-N 3.15Å; S629-L631 VanDerWaalsContact C-N 3.34Å; L631-L635 HydrophobicContact CB-CD2 4.36Å; L631-L635 HydrophobicContact CD2-CD2 4.11Å
632	P	93.4	Very high	87.7	Confident	0 Å²	0	20.3 Å²	20.3	0%	0	12%	0.122	C	C	.	.	B	Isolated β-bridge	trans	-80.1	152.4	178.8	24.3	-22.4	0	0	0	113.6	L473 E476 T477 Y634 L635	L473-P632 HydrophobicContact CD1-CG 3.88Å; E476-P632 HydrophobicContact CB-CB 3.84Å; T477-P632 CarbonylContact O-C 2.87Å; T477-P632 WeakPolarHBondContact O-CA 3.32Å; P632-Y634 VanDerWaalsContact C-N 3.32Å; P632-Y634 HydrophobicContact CB-CD1 3.63Å; P632-Y634 HydrophobicContact CB-CE1 3.48Å; P632-Y634 VanDerWaalsContact CB-CE1 3.48Å; P632-Y634 HydrophobicContact CG-CD1 3.93Å; P632-Y634 HydrophobicContact CG-CE1 3.31Å; P632-Y634 PolarHBondContact O-N 3.48Å; P632-L635 HydrophobicContact CG-CD1 3.69Å; P632-L635 PolarHBondContact O-N 3.22Å
633	E	93	Very high	89.5	Confident	19 Å²	19	16.4 Å²	16.4	9%	0.089	10%	0.097	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-35.1	-176.9	-71.6	-170.9	178.5	0	0	113.4	T477 R478 L479 L635 V636 D637 N683 L686	T477-E633 VanDerWaalsContact CG2-CD 3.46Å; T477-E633 HydrophobicContact CG2-CG 4.14Å; T477-E633 WeakPolarHBondContact CG2-OE1 3Å; T477-E633 PolarHBondContact O-N 3.43Å; R478-E633 WeakPolarHBondContact O-CG 3.4Å; R478-E633 VanDerWaalsContact O-OE1 3.12Å; L479-E633 HydrophobicContact CD2-CB 4.44Å; L479-E633 HydrophobicContact CD2-CG 4.27Å; E633-L635 PolarHBondContact O-N 3.12Å; E633-V636 WeakPolarHBondContact O-CB 3.23Å; E633-V636 PolarHBondContact O-N 3.23Å; E633-D637 PolarHBondContact O-N 2.88Å; E633-N683 WeakPolarHBondContact OE1-CB 3.44Å; E633-N683 PolarHBondContact OE2-ND2 3.37Å; E633-L686 HydrophobicContact CB-CD2 3.83Å; E633-L686 HydrophobicContact CG-CD2 4.27Å
634	Y	91.7	Very high	90.8	Very high	13 Å²	13	15.6 Å²	15.6	5%	0.051	9%	0.094	C	C	.	.	H	α-helix	trans	-64.1	-14.3	-174.9	75.5	-98.3	0	0	0	114	L473 E476 H513 P632 V636 N638	L473-Y634 HydrophobicContact CD1-CE1 4.18Å; L473-Y634 WeakPolarHBondContact CD1-OH 3.35Å; E476-Y634 HydrophobicContact CB-CD1 4.34Å; E476-Y634 HydrophobicContact CB-CE1 4.3Å; E476-Y634 HydrophobicContact CG-CD1 4.18Å; E476-Y634 HydrophobicContact CG-CE1 3.96Å; H513-Y634 HydrophobicContact CB-CE2 3.76Å; P632-Y634 VanDerWaalsContact C-N 3.32Å; P632-Y634 HydrophobicContact CB-CD1 3.63Å; P632-Y634 HydrophobicContact CB-CE1 3.48Å; P632-Y634 VanDerWaalsContact CB-CE1 3.48Å; P632-Y634 HydrophobicContact CG-CD1 3.93Å; P632-Y634 HydrophobicContact CG-CE1 3.31Å; P632-Y634 PolarHBondContact O-N 3.48Å; Y634-V636 VanDerWaalsContact C-N 3.28Å; Y634-N638 WeakPolarHBondContact O-CB 3.22Å; Y634-N638 PolarHBondContact O-N 3.02Å; Y634-N638 PolarHBondContact O-ND2 2.78Å; Y634-N638 VanDerWaalsContact O-ND2 3.17Å
635	L	95.9	Very high	91.7	Very high	0 Å²	0	11.6 Å²	11.6	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-61.8	-41.8	170.4	-86.4	51.4	0	0	0	110.4	F509 H513 L631 P632 E633 V639	F509-L635 HydrophobicContact CE1-CD2 3.88Å; F509-L635 HydrophobicContact CZ-CD2 3.91Å; F509-L635 HydrophobicContact CZ-CG 4.42Å; H513-L635 HydrophobicContact CB-CD1 4.15Å; L631-L635 HydrophobicContact CB-CD2 4.36Å; L631-L635 HydrophobicContact CD2-CD2 4.11Å; P632-L635 HydrophobicContact CG-CD1 3.69Å; P632-L635 PolarHBondContact O-N 3.22Å; E633-L635 PolarHBondContact O-N 3.12Å; L635-V639 WeakPolarHBondContact O-CG2 3.49Å; L635-V639 PolarHBondContact O-N 3.37Å
636	V	95.8	Very high	92.3	Very high	0 Å²	0	8.8 Å²	8.8	0%	0	5%	0.053	C	C	.	.	H	α-helix	trans	-72.4	-44.3	177.4	169.9	0	0	0	0	110.5	L479 L595 E633 Y634 N638 V639 V640 F670 L686 L690	L479-V636 HydrophobicContact CD2-CB 4.27Å; L479-V636 HydrophobicContact CD2-CG2 3.51Å; L595-V636 HydrophobicContact CD1-CG2 3.92Å; E633-V636 WeakPolarHBondContact O-CB 3.23Å; E633-V636 PolarHBondContact O-N 3.23Å; Y634-V636 VanDerWaalsContact C-N 3.28Å; V636-N638 VanDerWaalsContact C-N 3.29Å; V636-N638 PolarHBondContact O-N 3.07Å; V636-V639 PolarHBondContact O-N 3.41Å; V636-V639 VanDerWaalsContact O-N 3.08Å; V636-V640 HydrophobicContact CG1-CG2 4.15Å; V636-V640 WeakPolarHBondContact O-CG2 3.5Å; V636-V640 PolarHBondContact O-N 3.1Å; V636-F670 HydrophobicContact CB-CZ 4.23Å; V636-F670 HydrophobicContact CG1-CE1 4.44Å; V636-F670 HydrophobicContact CG1-CZ 3.72Å; V636-F670 HydrophobicContact CG2-CE2 4Å; V636-F670 HydrophobicContact CG2-CZ 3.7Å; V636-L686 HydrophobicContact CB-CD1 4.46Å; V636-L686 HydrophobicContact CB-CD2 4.07Å; V636-L686 HydrophobicContact CB-CG 4.34Å; V636-L686 HydrophobicContact CG1-CD1 3.78Å; V636-L686 HydrophobicContact CG1-CD2 4.05Å; V636-L686 HydrophobicContact CG1-CG 3.76Å; V636-L690 HydrophobicContact CG1-CD2 3.85Å
637	D	93.2	Very high	92.7	Very high	26 Å²	26	8.4 Å²	8.4	14%	0.139	5%	0.045	C	C	.	.	H	α-helix	trans	-55.3	-45	175.6	-80.4	-54.4	0	0	0	111.7	E633 V639 V640 E641 L686 R689	E633-D637 PolarHBondContact O-N 2.88Å; D637-V639 VanDerWaalsContact C-N 3.28Å; D637-V639 PolarHBondContact O-N 3.37Å; D637-V640 PolarHBondContact O-N 3.43Å; D637-E641 WeakPolarHBondContact O-CB 3.34Å; D637-E641 WeakPolarHBondContact O-CG 3.26Å; D637-E641 PolarHBondContact O-N 3.29Å; D637-L686 WeakPolarHBondContact OD1-CD1 3.41Å; D637-R689 IonicContact OD1-NH1 3.74Å; D637-R689 PolarHBondContact OD1-NH1 3.47Å
638	N	95	Very high	92.5	Very high	9 Å²	9	14.8 Å²	14.8	5%	0.048	7%	0.066	C	C	.	.	H	α-helix	trans	-57.7	-40	178	-77.7	-29.1	0	0	0	112.8	H513 I516 Y634 V636 L642	H513-N638 PolarHBondContact ND1-ND2 3.27Å; H513-N638 PolarHBondContact O-ND2 2.76Å; I516-N638 HydrophobicContact CG2-CB 4.01Å; I516-N638 WeakPolarHBondContact CG2-OD1 3.37Å; Y634-N638 WeakPolarHBondContact O-CB 3.22Å; Y634-N638 PolarHBondContact O-N 3.02Å; Y634-N638 PolarHBondContact O-ND2 2.78Å; Y634-N638 VanDerWaalsContact O-ND2 3.17Å; V636-N638 VanDerWaalsContact C-N 3.29Å; V636-N638 PolarHBondContact O-N 3.07Å; N638-L642 PolarHBondContact O-N 3Å
639	V	97	Very high	92.1	Very high	1 Å²	1	16.3 Å²	16.3	1%	0.006	8%	0.082	C	C	.	.	H	α-helix	trans	-68	-47.2	176.9	172.4	0	0	0	0	110.4	A588 T591 L635 V636 D637 L642 V643 L667 F670	A588-V639 HydrophobicContact CB-CG2 4.09Å; T591-V639 HydrophobicContact CG2-CG2 4.38Å; L635-V639 WeakPolarHBondContact O-CG2 3.49Å; L635-V639 PolarHBondContact O-N 3.37Å; V636-V639 PolarHBondContact O-N 3.41Å; V636-V639 VanDerWaalsContact O-N 3.08Å; D637-V639 VanDerWaalsContact C-N 3.28Å; D637-V639 PolarHBondContact O-N 3.37Å; V639-L642 PolarHBondContact O-N 2.8Å; V639-V643 HydrophobicContact CG1-CG2 4.45Å; V639-V643 WeakPolarHBondContact O-CG2 3.43Å; V639-V643 PolarHBondContact O-N 3.2Å; V639-L667 HydrophobicContact CG1-CD2 3.98Å; V639-F670 HydrophobicContact CG1-CE1 4.38Å
640	V	95.3	Very high	92	Very high	0 Å²	0	18.2 Å²	18.2	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-59.4	-50.6	179.2	172.3	0	0	0	0	110.4	V636 D637 L642 V643 S644 R689 L690 V693	V636-V640 HydrophobicContact CG1-CG2 4.15Å; V636-V640 WeakPolarHBondContact O-CG2 3.5Å; V636-V640 PolarHBondContact O-N 3.1Å; D637-V640 PolarHBondContact O-N 3.43Å; V640-L642 VanDerWaalsContact C-N 3.29Å; V640-L642 PolarHBondContact O-N 3.01Å; V640-V643 PolarHBondContact O-N 3.34Å; V640-S644 VanDerWaalsContact O-CB 3.26Å; V640-S644 WeakPolarHBondContact O-CB 3.37Å; V640-S644 PolarHBondContact O-N 2.84Å; V640-S644 PolarHBondContact O-OG 2.96Å; V640-R689 HydrophobicContact CG1-CB 3.83Å; V640-R689 HydrophobicContact CG2-CB 4.41Å; V640-L690 HydrophobicContact CG2-CD2 4Å; V640-V693 HydrophobicContact CB-CG2 4.45Å; V640-V693 HydrophobicContact CG2-CG2 3.93Å
641	E	92.4	Very high	91.9	Very high	18 Å²	18	17.2 Å²	17.2	8%	0.084	8%	0.084	C	C	.	.	H	α-helix	trans	-56.6	-42	179.6	-72.9	-57.6	144.9	0	0	112.4	T521 D637 Y645 R689	T521-E641 HydrophobicContact CG2-CB 3.81Å; T521-E641 HydrophobicContact CG2-CG 3.96Å; D637-E641 WeakPolarHBondContact O-CB 3.34Å; D637-E641 WeakPolarHBondContact O-CG 3.26Å; D637-E641 PolarHBondContact O-N 3.29Å; E641-Y645 VanDerWaalsContact O-CB 3.23Å; E641-Y645 WeakPolarHBondContact O-CB 3.39Å; E641-Y645 PolarHBondContact O-N 2.83Å; E641-R689 IonicContact OE1-CZ 3.78Å; E641-R689 IonicContact OE1-NH1 2.82Å; E641-R689 PolarHBondContact OE1-NH1 3.34Å; E641-R689 IonicContact OE1-NH2 3.17Å; E641-R689 PolarHBondContact OE1-NH2 3.22Å
642	L	95.1	Very high	91.6	Very high	6 Å²	6	22.9 Å²	22.9	3%	0.031	11%	0.11	C	C	.	.	H	α-helix	trans	-62.8	-53.4	176.6	175.4	64.8	0	0	0	111.4	L581 Q584 A588 N638 V639 V640 Y645 L646	L581-L642 HydrophobicContact CD1-CD1 3.97Å; Q584-L642 HydrophobicContact CB-CD1 4.3Å; Q584-L642 HydrophobicContact CB-CD2 4.1Å; A588-L642 HydrophobicContact CB-CD2 3.69Å; N638-L642 PolarHBondContact O-N 3Å; V639-L642 PolarHBondContact O-N 2.8Å; V640-L642 VanDerWaalsContact C-N 3.29Å; V640-L642 PolarHBondContact O-N 3.01Å; L642-Y645 WeakPolarHBondContact O-CB 3.37Å; L642-Y645 PolarHBondContact O-N 2.97Å; L642-L646 WeakPolarHBondContact O-CG 3.22Å; L642-L646 PolarHBondContact O-N 3.26Å
643	V	94.8	Very high	91.5	Very high	2 Å²	2	23.5 Å²	23.5	1%	0.012	11%	0.113	C	C	.	.	H	α-helix	trans	-67.1	-41.9	-174.5	176.8	0	0	0	0	110.9	V639 V640 Y645 L646 R647 L667 V693 S696	V639-V643 HydrophobicContact CG1-CG2 4.45Å; V639-V643 WeakPolarHBondContact O-CG2 3.43Å; V639-V643 PolarHBondContact O-N 3.2Å; V640-V643 PolarHBondContact O-N 3.34Å; V643-Y645 VanDerWaalsContact C-N 3.32Å; V643-Y645 PolarHBondContact O-N 3.06Å; V643-L646 WeakPolarHBondContact O-CB 3.25Å; V643-L646 PolarHBondContact O-N 3.03Å; V643-L646 VanDerWaalsContact O-N 3.15Å; V643-R647 PolarHBondContact O-N 3.39Å; V643-L667 HydrophobicContact CG2-CD1 4.4Å; V643-L667 HydrophobicContact CG2-CD2 4.09Å; V643-V693 HydrophobicContact CB-CG2 4.34Å; V643-V693 HydrophobicContact CG1-CB 4.41Å; V643-V693 HydrophobicContact CG1-CG1 4.19Å; V643-V693 HydrophobicContact CG1-CG2 4.45Å; V643-S696 VanDerWaalsContact CG1-CB 3.42Å
644	S	90	Very high	91.5	Very high	8 Å²	8	22.7 Å²	22.7	6%	0.056	11%	0.109	C	C	.	.	H	α-helix	trans	-62.9	-37.8	174.9	-61.8	0	0	0	0	112.1	V640 R648 E692	V640-S644 VanDerWaalsContact O-CB 3.26Å; V640-S644 WeakPolarHBondContact O-CB 3.37Å; V640-S644 PolarHBondContact O-N 2.84Å; V640-S644 PolarHBondContact O-OG 2.96Å; S644-R648 WeakPolarHBondContact O-CB 3.44Å; S644-R648 WeakPolarHBondContact O-CD 3.39Å; S644-R648 VanDerWaalsContact O-CG 3.25Å; S644-R648 WeakPolarHBondContact O-CG 3.48Å; S644-R648 PolarHBondContact O-N 3.42Å; S644-R648 VanDerWaalsContact O-N 3.09Å; S644-E692 WeakPolarHBondContact CB-OE2 3.38Å; S644-E692 WeakPolarHBondContact OG-CB 3.31Å; S644-E692 PolarHBondContact OG-OE2 3.29Å
645	Y	91.1	Very high	91.5	Very high	4 Å²	4	24 Å²	24	2%	0.016	12%	0.115	C	C	.	.	H	α-helix	trans	-62.9	-45.4	171.8	169.7	-101.3	0	0	0	111.7	I524 F528 L575 E641 L642 V643 R647 R648 G649 K650	I524-Y645 HydrophobicContact CD1-CG 4.08Å; I524-Y645 HydrophobicContact CG1-CD2 4.22Å; I524-Y645 HydrophobicContact CG1-CG 4.18Å; I524-Y645 HydrophobicContact CG2-CD2 4.17Å; F528-Y645 HydrophobicContact CE2-CD2 4.23Å; F528-Y645 HydrophobicContact CZ-CD2 4.16Å; L575-Y645 HydrophobicContact CB-CE1 4.05Å; L575-Y645 HydrophobicContact CB-CE2 4.22Å; L575-Y645 WeakPolarHBondContact CB-OH 3.04Å; L575-Y645 HydrophobicContact CD1-CE2 3.94Å; E641-Y645 VanDerWaalsContact O-CB 3.23Å; E641-Y645 WeakPolarHBondContact O-CB 3.39Å; E641-Y645 PolarHBondContact O-N 2.83Å; L642-Y645 WeakPolarHBondContact O-CB 3.37Å; L642-Y645 PolarHBondContact O-N 2.97Å; V643-Y645 VanDerWaalsContact C-N 3.32Å; V643-Y645 PolarHBondContact O-N 3.06Å; Y645-R647 VanDerWaalsContact C-N 3.35Å; Y645-R647 PolarHBondContact O-N 2.84Å; Y645-R648 PolarHBondContact O-N 3.48Å; Y645-G649 PolarHBondContact O-N 2.86Å; Y645-K650 HydrophobicContact CE1-CG 4.41Å
646	L	92.2	Very high	91.3	Very high	0 Å²	0	25 Å²	25	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-57.7	-48.4	177.5	-68.6	177.6	0	0	0	110.8	L581 L585 L642 V643 R648 K650 D651 F653 L654	L581-L646 HydrophobicContact CD1-CD2 3.75Å; L581-L646 HydrophobicContact CD2-CD2 3.73Å; L581-L646 HydrophobicContact CG-CD2 3.99Å; L585-L646 HydrophobicContact CD1-CD1 4.26Å; L642-L646 WeakPolarHBondContact O-CG 3.22Å; L642-L646 PolarHBondContact O-N 3.26Å; V643-L646 WeakPolarHBondContact O-CB 3.25Å; V643-L646 PolarHBondContact O-N 3.03Å; V643-L646 VanDerWaalsContact O-N 3.15Å; L646-R648 VanDerWaalsContact C-N 3.34Å; L646-R648 PolarHBondContact O-N 3.26Å; L646-K650 HydrophobicContact CD2-CB 4.14Å; L646-K650 CarbonylContact O-C 3.58Å; L646-K650 VanDerWaalsContact O-CA 3.27Å; L646-K650 WeakPolarHBondContact O-CA 3.49Å; L646-K650 PolarHBondContact O-N 3.26Å; L646-D651 WeakPolarHBondContact O-CA 3.32Å; L646-D651 PolarHBondContact O-N 3.13Å; L646-F653 HydrophobicContact CD1-CD1 4.04Å; L646-F653 HydrophobicContact CD1-CE1 4.46Å; L646-F653 HydrophobicContact CD2-CB 4.29Å; L646-F653 HydrophobicContact CD2-CD1 3.58Å; L646-F653 HydrophobicContact CD2-CE1 4.26Å; L646-F653 HydrophobicContact CD2-CG 4.22Å; L646-F653 HydrophobicContact CG-CD1 4.45Å; L646-L654 HydrophobicContact CD1-CD2 3.91Å; L646-L654 HydrophobicContact CD1-CG 4.42Å
647	R	89.5	Confident	91	Very high	12 Å²	12	30.8 Å²	30.8	5%	0.045	16%	0.158	C	C	.	.	H	α-helix	trans	-60.5	-41.5	178.9	-179.7	53.2	168.2	-163.3	-13.4	113.5	V643 Y645 D651 E695 S696 Q700	V643-R647 PolarHBondContact O-N 3.39Å; Y645-R647 VanDerWaalsContact C-N 3.35Å; Y645-R647 PolarHBondContact O-N 2.84Å; R647-D651 IonicContact CZ-OD2 3.89Å; R647-D651 IonicContact NH1-OD1 2.96Å; R647-D651 IonicContact NH1-OD2 3.81Å; R647-D651 PolarHBondContact NH1-OD2 3.08Å; R647-E695 WeakPolarHBondContact CG-OE2 3.3Å; R647-E695 IonicContact CZ-OE1 3.13Å; R647-E695 IonicContact NE-OE1 3.63Å; R647-E695 PolarHBondContact NE-OE1 2.82Å; R647-E695 IonicContact NE-OE2 2.62Å; R647-E695 IonicContact NH2-OE1 3.36Å; R647-E695 PolarHBondContact NH2-OE1 2.75Å; R647-S696 WeakPolarHBondContact CB-OG 3.42Å; R647-Q700 PolarHBondContact NH2-O 3.48Å
648	R	84.5	Confident	90.8	Very high	152 Å²	152	33.7 Å²	33.7	57%	0.574	17%	0.17	S	C	*	.	H	α-helix	trans	-77.1	-39.3	-177.5	-69	171.4	67	172.4	-0.3	113.2	F528 S644 Y645 L646	F528-R648 HydrophobicContact CE1-CB 4.29Å; F528-R648 HydrophobicContact CZ-CB 3.94Å; S644-R648 WeakPolarHBondContact O-CB 3.44Å; S644-R648 WeakPolarHBondContact O-CD 3.39Å; S644-R648 VanDerWaalsContact O-CG 3.25Å; S644-R648 WeakPolarHBondContact O-CG 3.48Å; S644-R648 PolarHBondContact O-N 3.42Å; S644-R648 VanDerWaalsContact O-N 3.09Å; Y645-R648 PolarHBondContact O-N 3.48Å; L646-R648 VanDerWaalsContact C-N 3.34Å; L646-R648 PolarHBondContact O-N 3.26Å
649	G	81.2	Confident	90.7	Very high	33 Å²	33	33.3 Å²	33.3	34%	0.34	17%	0.168	S	C	.	.	H	α-helix	trans	-114.8	-26.2	-169.4	0	0	0	0	0	115.9	Y645	Y645-G649 PolarHBondContact O-N 2.86Å
650	K	86.7	Confident	90.4	Very high	53 Å²	53	36.7 Å²	36.7	23%	0.23	19%	0.192	C	C	.	.			trans	-145.4	48.2	-169.9	-69	-61.3	-177.7	-179.8	0	113.3	S576 Y645 L646 E652 F653	S576-K650 VanDerWaalsContact CB-CE 3.44Å; S576-K650 WeakPolarHBondContact OG-CE 3.45Å; S576-K650 PolarHBondContact OG-NZ 2.8Å; Y645-K650 HydrophobicContact CE1-CG 4.41Å; L646-K650 HydrophobicContact CD2-CB 4.14Å; L646-K650 CarbonylContact O-C 3.58Å; L646-K650 VanDerWaalsContact O-CA 3.27Å; L646-K650 WeakPolarHBondContact O-CA 3.49Å; L646-K650 PolarHBondContact O-N 3.26Å; K650-E652 PolarHBondContact O-N 3.39Å; K650-F653 HydrophobicContact CB-CB 4.22Å; K650-F653 WeakPolarHBondContact O-CB 3.37Å; K650-F653 PolarHBondContact O-N 3.41Å
651	D	87.4	Confident	90.2	Very high	6 Å²	6	39.7 Å²	39.7	3%	0.032	21%	0.213	C	C	.	.	G	3₁₀ helix	trans	-62.5	-30.7	-171.3	-162.6	22.2	0	0	0	112.8	L646 R647 F653 L721 R726	L646-D651 WeakPolarHBondContact O-CA 3.32Å; L646-D651 PolarHBondContact O-N 3.13Å; R647-D651 IonicContact CZ-OD2 3.89Å; R647-D651 IonicContact NH1-OD1 2.96Å; R647-D651 IonicContact NH1-OD2 3.81Å; R647-D651 PolarHBondContact NH1-OD2 3.08Å; D651-F653 PolarHBondContact O-N 3.27Å; D651-L721 HydrophobicContact CB-CD2 4.12Å; D651-R726 PolarHBondContact O-NH2 3.36Å; D651-R726 IonicContact OD1-CZ 3.76Å; D651-R726 IonicContact OD1-NH1 3.93Å; D651-R726 PolarHBondContact OD1-NH1 3.01Å; D651-R726 IonicContact OD1-NH2 2.93Å; D651-R726 PolarHBondContact OD1-NH2 3.37Å; D651-R726 IonicContact OD2-NH1 3.29Å
652	E	87.5	Confident	90.3	Very high	119 Å²	119	39 Å²	39	56%	0.556	21%	0.21	S	C	*	.	G	3₁₀ helix	trans	-65.3	-22.3	175.6	-63.4	178.1	-170.6	0	0	113.3	K650 L654 E655 S656 L721	K650-E652 PolarHBondContact O-N 3.39Å; E652-L654 VanDerWaalsContact C-N 3.3Å; E652-L654 PolarHBondContact O-N 3.36Å; E652-E655 PolarHBondContact O-N 2.97Å; E652-E655 VanDerWaalsContact O-N 3.07Å; E652-S656 PolarHBondContact O-N 2.97Å; E652-L721 HydrophobicContact CB-CD2 4.42Å; E652-L721 HydrophobicContact CG-CD1 4.44Å; E652-L721 HydrophobicContact CG-CD2 3.41Å; E652-L721 VanDerWaalsContact CG-CD2 3.41Å; E652-L721 HydrophobicContact CG-CG 3.73Å
653	F	92.1	Very high	90.3	Very high	12 Å²	12	39.5 Å²	39.5	5%	0.053	21%	0.213	C	C	.	.	G	3₁₀ helix	trans	-61.7	-37	-175.7	177.9	-109.1	0	0	0	112.3	M578 L581 K582 L585 L646 K650 D651 E655 S656 V659	M578-F653 HydrophobicContact SD-CD2 3.64Å; M578-F653 HydrophobicContact SD-CE2 3.39Å; M578-F653 WeakPolarHBondContact SD-CE2 3.39Å; L581-F653 HydrophobicContact CB-CE1 4.32Å; L581-F653 HydrophobicContact CB-CE2 4.29Å; L581-F653 HydrophobicContact CB-CZ 3.88Å; L581-F653 HydrophobicContact CD2-CB 4.46Å; L581-F653 HydrophobicContact CD2-CD1 3.72Å; L581-F653 HydrophobicContact CD2-CD2 3.76Å; L581-F653 HydrophobicContact CD2-CE1 3.75Å; L581-F653 HydrophobicContact CD2-CE2 3.8Å; L581-F653 HydrophobicContact CD2-CG 3.7Å; L581-F653 HydrophobicContact CD2-CZ 3.77Å; L581-F653 HydrophobicContact CG-CD1 4Å; L581-F653 HydrophobicContact CG-CD2 4.5Å; L581-F653 HydrophobicContact CG-CE1 3.55Å; L581-F653 HydrophobicContact CG-CE2 4.11Å; L581-F653 HydrophobicContact CG-CG 4.43Å; L581-F653 HydrophobicContact CG-CZ 3.6Å; K582-F653 HydrophobicContact CB-CZ 4.39Å; L585-F653 HydrophobicContact CB-CE1 4.29Å; L585-F653 HydrophobicContact CD2-CD1 4.46Å; L585-F653 HydrophobicContact CD2-CE1 3.84Å; L646-F653 HydrophobicContact CD1-CD1 4.04Å; L646-F653 HydrophobicContact CD1-CE1 4.46Å; L646-F653 HydrophobicContact CD2-CB 4.29Å; L646-F653 HydrophobicContact CD2-CD1 3.58Å; L646-F653 HydrophobicContact CD2-CE1 4.26Å; L646-F653 HydrophobicContact CD2-CG 4.22Å; L646-F653 HydrophobicContact CG-CD1 4.45Å; K650-F653 HydrophobicContact CB-CB 4.22Å; K650-F653 WeakPolarHBondContact O-CB 3.37Å; K650-F653 PolarHBondContact O-N 3.41Å; D651-F653 PolarHBondContact O-N 3.27Å; F653-E655 PolarHBondContact O-N 2.83Å; F653-S656 VanDerWaalsContact O-CB 3.3Å; F653-S656 WeakPolarHBondContact O-CB 3.49Å; F653-S656 PolarHBondContact O-N 3.44Å; F653-S656 VanDerWaalsContact O-N 3.08Å; F653-S656 PolarHBondContact O-OG 3.27Å; F653-V659 HydrophobicContact CE1-CG1 3.75Å; F653-V659 HydrophobicContact CE2-CG1 3.74Å; F653-V659 HydrophobicContact CZ-CG1 3.27Å; F653-V659 WeakPolarHBondContact O-CG2 3.38Å
654	L	92.7	Very high	90.3	Very high	2 Å²	2	39.6 Å²	39.6	1%	0.01	21%	0.214	C	C	.	.	G	3₁₀ helix	trans	-65.3	-22.8	178.8	-67.3	178.9	0	0	0	113.1	L585 L646 E652 L664 R725	L585-L654 HydrophobicContact CD1-CD2 4.21Å; L585-L654 HydrophobicContact CD2-CD2 3.88Å; L646-L654 HydrophobicContact CD1-CD2 3.91Å; L646-L654 HydrophobicContact CD1-CG 4.42Å; E652-L654 VanDerWaalsContact C-N 3.3Å; E652-L654 PolarHBondContact O-N 3.36Å; L654-L664 HydrophobicContact CD2-CD2 4.2Å; L654-R725 WeakPolarHBondContact O-CD 3.48Å; L654-R725 PolarHBondContact O-NH1 2.97Å
655	E	91.9	Very high	90.4	Very high	41 Å²	41	42 Å²	42	19%	0.192	22%	0.224	C	C	.	.	G	3₁₀ helix	trans	-95.9	-1.1	178.4	-54.9	-61.2	158	0	0	112.3	E652 F653 S722 H724 R725 R726	E652-E655 PolarHBondContact O-N 2.97Å; E652-E655 VanDerWaalsContact O-N 3.07Å; F653-E655 PolarHBondContact O-N 2.83Å; E655-S722 WeakPolarHBondContact CG-O 3.19Å; E655-H724 PolarHBondContact OE2-N 3.09Å; E655-R725 VanDerWaalsContact OE2-CB 3.32Å; E655-R725 WeakPolarHBondContact OE2-CB 3.49Å; E655-R725 WeakPolarHBondContact OE2-CG 3.27Å; E655-R725 PolarHBondContact OE2-N 2.72Å; E655-R726 WeakPolarHBondContact OE1-CG 3.44Å; E655-R726 IonicContact OE1-CZ 3.69Å; E655-R726 IonicContact OE1-NE 2.7Å; E655-R726 PolarHBondContact OE1-NE 2.97Å; E655-R726 IonicContact OE1-NH2 3.42Å
656	S	91.8	Very high	90.6	Very high	22 Å²	22	41.8 Å²	41.8	15%	0.154	22%	0.223	C	C	.	.	S	Bend	trans	-75.1	154.2	-174	98.2	0	0	0	0	112.6	E652 F653 E658 V659 S660	E652-S656 PolarHBondContact O-N 2.97Å; F653-S656 VanDerWaalsContact O-CB 3.3Å; F653-S656 WeakPolarHBondContact O-CB 3.49Å; F653-S656 PolarHBondContact O-N 3.44Å; F653-S656 VanDerWaalsContact O-N 3.08Å; F653-S656 PolarHBondContact O-OG 3.27Å; S656-E658 WeakPolarHBondContact CB-OE2 3.48Å; S656-E658 PolarHBondContact O-N 3.12Å; S656-E658 PolarHBondContact OG-OE2 2.94Å; S656-V659 PolarHBondContact O-N 3.42Å; S656-S660 PolarHBondContact O-N 3.43Å
657	V	90.6	Very high	90.8	Very high	121 Å²	121	41.8 Å²	41.8	73%	0.733	22%	0.224	S	C	*	.	G	3₁₀ helix	trans	-64.5	-31.8	-178.1	-178.4	0	0	0	0	111	V659 S660	V657-V659 VanDerWaalsContact C-N 3.27Å; V657-V659 PolarHBondContact O-N 2.99Å; V657-S660 WeakPolarHBondContact O-CB 3.32Å; V657-S660 PolarHBondContact O-N 3.38Å; V657-S660 PolarHBondContact O-OG 3.33Å
658	E	88.4	Confident	91.1	Very high	87 Å²	87	41.4 Å²	41.4	41%	0.407	22%	0.222	S	C	.	.	G	3₁₀ helix	trans	-63.3	-30.3	-175.9	-62.2	78.1	-169.5	0	0	113.3	M578 K582 S656	M578-E658 HydrophobicContact CG-CB 4.28Å; M578-E658 HydrophobicContact CG-CG 3.88Å; M578-E658 HydrophobicContact SD-CB 4.26Å; M578-E658 HydrophobicContact SD-CG 4.07Å; K582-E658 WeakPolarHBondContact CD-O 3.31Å; K582-E658 WeakPolarHBondContact CE-O 3.43Å; K582-E658 PolarHBondContact NZ-O 3.33Å; S656-E658 WeakPolarHBondContact CB-OE2 3.48Å; S656-E658 PolarHBondContact O-N 3.12Å; S656-E658 PolarHBondContact OG-OE2 2.94Å
659	V	92.7	Very high	91.6	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	21%	0.206	C	C	.	.	G	3₁₀ helix	trans	-111.4	9	-179.4	-59.3	0	0	0	0	113.7	K582 L585 F653 S656 V657 S661 I662 R725	K582-V659 HydrophobicContact CB-CG1 4.25Å; K582-V659 HydrophobicContact CG-CG1 4.23Å; L585-V659 HydrophobicContact CD2-CB 4.1Å; L585-V659 HydrophobicContact CD2-CG1 4.03Å; L585-V659 HydrophobicContact CD2-CG2 4.42Å; F653-V659 HydrophobicContact CE1-CG1 3.75Å; F653-V659 HydrophobicContact CE2-CG1 3.74Å; F653-V659 HydrophobicContact CZ-CG1 3.27Å; F653-V659 WeakPolarHBondContact O-CG2 3.38Å; S656-V659 PolarHBondContact O-N 3.42Å; V657-V659 VanDerWaalsContact C-N 3.27Å; V657-V659 PolarHBondContact O-N 2.99Å; V659-S661 PolarHBondContact O-N 2.91Å; V659-S661 VanDerWaalsContact O-N 3.13Å; V659-I662 HydrophobicContact CB-CD1 4.08Å; V659-I662 HydrophobicContact CG1-CD1 4.03Å; V659-I662 PolarHBondContact O-N 2.88Å; V659-R725 PolarHBondContact O-NH1 3.35Å; V659-R725 VanDerWaalsContact O-NH1 3.09Å; V659-R725 PolarHBondContact O-NH2 2.9Å
660	S	91	Very high	92.3	Very high	72 Å²	72	35 Å²	35	50%	0.503	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.4	-31.6	176.7	58.2	0	0	0	0	113.4	S656 V657 I662 R725	S656-S660 PolarHBondContact O-N 3.43Å; V657-S660 WeakPolarHBondContact O-CB 3.32Å; V657-S660 PolarHBondContact O-N 3.38Å; V657-S660 PolarHBondContact O-OG 3.33Å; S660-I662 VanDerWaalsContact C-N 3.34Å; S660-R725 PolarHBondContact O-NH2 3.03Å
661	S	91.2	Very high	92.8	Very high	64 Å²	64	32.5 Å²	32.5	45%	0.448	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.4	-11.5	176.6	56.6	0	0	0	0	115.2	V659 P663	V659-S661 PolarHBondContact O-N 2.91Å; V659-S661 VanDerWaalsContact O-N 3.13Å; S661-P663 WeakPolarHBondContact O-CD 3.46Å
662	I	94.9	Very high	93.2	Very high	2 Å²	2	32.3 Å²	32.3	1%	0.01	18%	0.178	C	C	.	.	S	Bend	trans	-94.8	113.5	-177.6	-59.7	171.9	0	0	0	108.8	P447 K582 L585 V589 V659 S660 R725	P447-I662 HydrophobicContact CB-CG2 4.46Å; P447-I662 HydrophobicContact CG-CG1 4.25Å; K582-I662 HydrophobicContact CG-CD1 4.02Å; L585-I662 HydrophobicContact CB-CD1 4.47Å; L585-I662 HydrophobicContact CD2-CD1 4.29Å; L585-I662 HydrophobicContact CG-CD1 4.39Å; L585-I662 HydrophobicContact CG-CG2 4.32Å; V589-I662 HydrophobicContact CB-CG2 4.07Å; V589-I662 HydrophobicContact CG1-CG2 4.18Å; V589-I662 HydrophobicContact CG2-CG2 3.75Å; V659-I662 HydrophobicContact CB-CD1 4.08Å; V659-I662 HydrophobicContact CG1-CD1 4.03Å; V659-I662 PolarHBondContact O-N 2.88Å; S660-I662 VanDerWaalsContact C-N 3.34Å; I662-R725 PolarHBondContact O-NH2 2.95Å
663	P	93.5	Very high	93.5	Very high	17 Å²	17	27.3 Å²	27.3	11%	0.11	16%	0.155	C	C	.	.			trans	-66.9	137.7	-178.6	26.2	-31.1	0	0	0	111.7	V589 S661 E665 P666	V589-P663 HydrophobicContact CG1-CG 4.29Å; V589-P663 VanDerWaalsContact CG1-O 3.31Å; V589-P663 WeakPolarHBondContact CG1-O 3.33Å; S661-P663 WeakPolarHBondContact O-CD 3.46Å; P663-E665 WeakPolarHBondContact CA-OE2 3.45Å; P663-E665 WeakPolarHBondContact CB-OE2 3.44Å; P663-P666 WeakPolarHBondContact O-CD 3.33Å
664	L	94.4	Very high	93.7	Very high	4 Å²	4	26.7 Å²	26.7	2%	0.021	15%	0.152	C	C	.	.	S	Bend	trans	-91.5	-15.3	179.4	-60.7	-176.3	0	0	0	112.4	L654 P666 L667 L668 L697 R725 R726 L729	L654-L664 HydrophobicContact CD2-CD2 4.2Å; L664-P666 VanDerWaalsContact C-CD 3.44Å; L664-P666 VanDerWaalsContact C-N 3.34Å; L664-L667 HydrophobicContact CD2-CD1 4.4Å; L664-L667 WeakPolarHBondContact O-CB 3.47Å; L664-L667 PolarHBondContact O-N 2.78Å; L664-L667 VanDerWaalsContact O-N 3.11Å; L664-L668 PolarHBondContact O-N 2.72Å; L664-L697 HydrophobicContact CB-CD2 4.42Å; L664-R725 HydrophobicContact CD1-CB 4.25Å; L664-R726 HydrophobicContact CD1-CG 4.3Å; L664-L729 HydrophobicContact CB-CD2 3.89Å
665	E	93.5	Very high	93.8	Very high	58 Å²	58	26.6 Å²	26.6	27%	0.271	15%	0.152	S	C	.	.	H	α-helix	trans	-48.5	-48.7	177.9	-67.6	75.7	-174.6	0	0	112.7	P663 L667 L668 E669 L729 R732	P663-E665 WeakPolarHBondContact CA-OE2 3.45Å; P663-E665 WeakPolarHBondContact CB-OE2 3.44Å; E665-L667 PolarHBondContact O-N 3.25Å; E665-L667 VanDerWaalsContact O-N 3.12Å; E665-L668 WeakPolarHBondContact O-CA 3.08Å; E665-L668 WeakPolarHBondContact O-CB 3.37Å; E665-L668 PolarHBondContact O-N 2.83Å; E665-E669 WeakPolarHBondContact O-CG 3.38Å; E665-E669 PolarHBondContact O-N 3.18Å; E665-L729 HydrophobicContact CG-CD1 3.92Å; E665-R732 VanDerWaalsContact CD-NH2 3.33Å; E665-R732 IonicContact OE1-NH2 3.59Å; E665-R732 PolarHBondContact OE1-NH2 3.15Å
666	P	95	Very high	93.8	Very high	0 Å²	0	26 Å²	26	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-61.5	-29.7	-176	-25.6	39.1	0	0	0	113.6	V589 C592 R593 P663 L664 F670	V589-P666 HydrophobicContact CG1-CB 4.07Å; V589-P666 HydrophobicContact CG1-CG 3.76Å; C592-P666 HydrophobicContact CB-CB 4.04Å; C592-P666 WeakPolarHBondContact CB-O 3.3Å; R593-P666 HydrophobicContact CG-CB 3.49Å; R593-P666 VanDerWaalsContact CG-CB 3.49Å; R593-P666 HydrophobicContact CG-CG 3.39Å; R593-P666 VanDerWaalsContact CZ-CG 3.48Å; P663-P666 WeakPolarHBondContact O-CD 3.33Å; L664-P666 VanDerWaalsContact C-CD 3.44Å; L664-P666 VanDerWaalsContact C-N 3.34Å; P666-F670 WeakPolarHBondContact O-CB 3.3Å; P666-F670 PolarHBondContact O-N 3.15Å
667	L	96.5	Very high	93.7	Very high	1 Å²	1	28.8 Å²	28.8	1%	0.005	16%	0.162	C	C	.	.	H	α-helix	trans	-69	-40.6	174.7	-66.1	168.4	0	0	0	111	L585 V589 V639 V643 L664 E665 S671 V693 L697	L585-L667 HydrophobicContact CD1-CD1 4.39Å; V589-L667 HydrophobicContact CG2-CD1 4.05Å; V589-L667 HydrophobicContact CG2-CG 4.06Å; V639-L667 HydrophobicContact CG1-CD2 3.98Å; V643-L667 HydrophobicContact CG2-CD1 4.4Å; V643-L667 HydrophobicContact CG2-CD2 4.09Å; L664-L667 HydrophobicContact CD2-CD1 4.4Å; L664-L667 WeakPolarHBondContact O-CB 3.47Å; L664-L667 PolarHBondContact O-N 2.78Å; L664-L667 VanDerWaalsContact O-N 3.11Å; E665-L667 PolarHBondContact O-N 3.25Å; E665-L667 VanDerWaalsContact O-N 3.12Å; L667-S671 WeakPolarHBondContact O-CB 3.46Å; L667-S671 PolarHBondContact O-N 3.23Å; L667-S671 PolarHBondContact O-OG 3.22Å; L667-S671 VanDerWaalsContact O-OG 3.06Å; L667-V693 HydrophobicContact CB-CG1 4.27Å; L667-V693 HydrophobicContact CD2-CG1 4.48Å; L667-L697 HydrophobicContact CB-CD1 3.95Å; L667-L697 HydrophobicContact CB-CD2 4.44Å; L667-L697 HydrophobicContact CD1-CD2 4.39Å
668	L	95.5	Very high	93.6	Very high	3 Å²	3	26.5 Å²	26.5	2%	0.016	15%	0.149	C	C	.	.	H	α-helix	trans	-65	-51.1	175.9	-178	69.4	0	0	0	111	L664 E665 F670 S671 I672 L694 L697 L729 M730 L742	L664-L668 PolarHBondContact O-N 2.72Å; E665-L668 WeakPolarHBondContact O-CA 3.08Å; E665-L668 WeakPolarHBondContact O-CB 3.37Å; E665-L668 PolarHBondContact O-N 2.83Å; L668-F670 VanDerWaalsContact C-N 3.33Å; L668-F670 PolarHBondContact O-N 2.85Å; L668-S671 PolarHBondContact O-N 3.08Å; L668-S671 PolarHBondContact O-OG 3.07Å; L668-I672 HydrophobicContact CD1-CD1 3.69Å; L668-I672 HydrophobicContact CD1-CG1 4.39Å; L668-I672 HydrophobicContact CG-CD1 3.92Å; L668-I672 WeakPolarHBondContact O-CG1 3.47Å; L668-I672 PolarHBondContact O-N 3.3Å; L668-L694 HydrophobicContact CD1-CD1 3.67Å; L668-L697 HydrophobicContact CB-CD1 3.96Å; L668-L697 HydrophobicContact CD1-CD1 4.31Å; L668-L729 HydrophobicContact CB-CD2 4.35Å; L668-L729 HydrophobicContact CD2-CD1 3.96Å; L668-L729 HydrophobicContact CD2-CD2 4.47Å; L668-L729 HydrophobicContact CD2-CG 4.01Å; L668-M730 HydrophobicContact CD1-CE 3.89Å; L668-M730 HydrophobicContact CD1-SD 4.34Å; L668-L742 HydrophobicContact CD2-CD1 4.33Å
669	E	95.4	Very high	93.4	Very high	51 Å²	51	24.5 Å²	24.5	24%	0.238	15%	0.152	C	C	.	.	H	α-helix	trans	-59.7	-46.2	179.6	-58.8	-175.5	169.1	0	0	111	V596 E665 I672 I673 I741	V596-E669 HydrophobicContact CG1-CB 4.27Å; V596-E669 HydrophobicContact CG2-CB 3.99Å; E665-E669 WeakPolarHBondContact O-CG 3.38Å; E665-E669 PolarHBondContact O-N 3.18Å; E669-I672 PolarHBondContact O-N 3.29Å; E669-I673 HydrophobicContact CB-CD1 4.39Å; E669-I673 VanDerWaalsContact O-CB 3.28Å; E669-I673 WeakPolarHBondContact O-CB 3.44Å; E669-I673 WeakPolarHBondContact O-CD1 3.48Å; E669-I673 VanDerWaalsContact O-CG1 3.22Å; E669-I673 WeakPolarHBondContact O-CG1 3.19Å; E669-I673 PolarHBondContact O-N 3.13Å; E669-I741 HydrophobicContact CB-CD1 3.95Å; E669-I741 HydrophobicContact CG-CD1 3.39Å; E669-I741 HydrophobicContact CG-CG2 4.43Å
670	F	96.2	Very high	93.3	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-57.3	-52.5	176.2	167.6	-112.5	0	0	0	111.9	C592 L595 V596 V636 V639 P666 L668 I672 F674 L690	C592-F670 HydrophobicContact CB-CB 3.82Å; C592-F670 HydrophobicContact CB-CG 4.13Å; L595-F670 HydrophobicContact CB-CD2 4.16Å; L595-F670 HydrophobicContact CB-CE2 4.39Å; L595-F670 HydrophobicContact CD1-CD2 4.03Å; L595-F670 HydrophobicContact CD1-CE2 3.59Å; L595-F670 HydrophobicContact CD1-CZ 4.25Å; V596-F670 HydrophobicContact CG2-CB 3.88Å; V636-F670 HydrophobicContact CB-CZ 4.23Å; V636-F670 HydrophobicContact CG1-CE1 4.44Å; V636-F670 HydrophobicContact CG1-CZ 3.72Å; V636-F670 HydrophobicContact CG2-CE2 4Å; V636-F670 HydrophobicContact CG2-CZ 3.7Å; V639-F670 HydrophobicContact CG1-CE1 4.38Å; P666-F670 WeakPolarHBondContact O-CB 3.3Å; P666-F670 PolarHBondContact O-N 3.15Å; L668-F670 VanDerWaalsContact C-N 3.33Å; L668-F670 PolarHBondContact O-N 2.85Å; F670-I672 PolarHBondContact O-N 3.31Å; F670-F674 AromaticContact CD2-CD2 3.57Å; F670-F674 HydrophobicContact CD2-CD2 3.57Å; F670-F674 AromaticContact CD2-CE2 3.81Å; F670-F674 HydrophobicContact CD2-CE2 3.81Å; F670-F674 HydrophobicContact CD2-CG 4.01Å; F670-F674 HydrophobicContact CD2-CZ 4.44Å; F670-F674 HydrophobicContact CE2-CB 4.37Å; F670-F674 HydrophobicContact CE2-CD1 4.05Å; F670-F674 AromaticContact CE2-CD2 3.86Å; F670-F674 HydrophobicContact CE2-CD2 3.86Å; F670-F674 HydrophobicContact CE2-CE1 4.35Å; F670-F674 HydrophobicContact CE2-CE2 4.16Å; F670-F674 AromaticContact CE2-CG 3.83Å; F670-F674 HydrophobicContact CE2-CG 3.83Å; F670-F674 HydrophobicContact CE2-CZ 4.42Å; F670-F674 WeakPolarHBondContact O-CB 3.44Å; F670-F674 WeakPolarHBondContact O-CD2 3.45Å; F670-F674 PolarHBondContact O-N 2.7Å; F670-F674 VanDerWaalsContact O-N 3.12Å; F670-L690 HydrophobicContact CD1-CD2 4.42Å; F670-L690 HydrophobicContact CE1-CD2 3.44Å; F670-L690 VanDerWaalsContact CE1-CD2 3.44Å; F670-L690 HydrophobicContact CZ-CD1 4.48Å; F670-L690 HydrophobicContact CZ-CD2 3.57Å
671	S	96.1	Very high	93.4	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-61.1	-45.7	-178.9	60.9	0	0	0	0	111.9	L667 L668 M675	L667-S671 WeakPolarHBondContact O-CB 3.46Å; L667-S671 PolarHBondContact O-N 3.23Å; L667-S671 PolarHBondContact O-OG 3.22Å; L667-S671 VanDerWaalsContact O-OG 3.06Å; L668-S671 PolarHBondContact O-N 3.08Å; L668-S671 PolarHBondContact O-OG 3.07Å; S671-M675 VanDerWaalsContact O-CB 3.22Å; S671-M675 WeakPolarHBondContact O-CB 3.48Å; S671-M675 VanDerWaalsContact O-CE 3.29Å; S671-M675 WeakPolarHBondContact O-CE 3.28Å; S671-M675 WeakPolarHBondContact O-CG 3.3Å; S671-M675 PolarHBondContact O-N 3.28Å; S671-M675 VanDerWaalsContact O-N 3.08Å
672	I	95.5	Very high	93.3	Very high	2 Å²	2	21.2 Å²	21.2	1%	0.01	13%	0.126	C	C	.	.	H	α-helix	trans	-69.5	-46.8	-177.4	-68.4	173.9	0	0	0	112	L668 E669 F670 S676 I741 L742 N744 A745 A748	L668-I672 HydrophobicContact CD1-CD1 3.69Å; L668-I672 HydrophobicContact CD1-CG1 4.39Å; L668-I672 HydrophobicContact CG-CD1 3.92Å; L668-I672 WeakPolarHBondContact O-CG1 3.47Å; L668-I672 PolarHBondContact O-N 3.3Å; E669-I672 PolarHBondContact O-N 3.29Å; F670-I672 PolarHBondContact O-N 3.31Å; I672-S676 WeakPolarHBondContact O-CB 3.36Å; I672-S676 PolarHBondContact O-N 3.36Å; I672-S676 PolarHBondContact O-OG 3.42Å; I672-I741 HydrophobicContact CB-CG2 3.93Å; I672-I741 HydrophobicContact CD1-CG2 3.85Å; I672-I741 HydrophobicContact CG1-CG2 4.45Å; I672-I741 HydrophobicContact CG2-CG2 3.93Å; I672-L742 HydrophobicContact CD1-CD1 4.33Å; I672-N744 HydrophobicContact CG2-CB 4.5Å; I672-A745 HydrophobicContact CD1-CB 3.81Å; I672-A745 HydrophobicContact CG1-CB 4.39Å; I672-A748 HydrophobicContact CG2-CB 3.98Å; I672-A748 WeakPolarHBondContact O-CB 3.4Å
673	I	95.1	Very high	93	Very high	14 Å²	14	23 Å²	23	7%	0.072	14%	0.135	C	C	.	.	H	α-helix	trans	-65.2	-46.9	-176.3	-68.7	169	0	0	0	110.6	V596 A599 L603 E669 S676 H677 L680	V596-I673 HydrophobicContact CG1-CD1 3.81Å; V596-I673 HydrophobicContact CG2-CD1 4.38Å; A599-I673 HydrophobicContact CB-CG2 4.04Å; L603-I673 HydrophobicContact CD1-CG2 4.19Å; E669-I673 HydrophobicContact CB-CD1 4.39Å; E669-I673 VanDerWaalsContact O-CB 3.28Å; E669-I673 WeakPolarHBondContact O-CB 3.44Å; E669-I673 WeakPolarHBondContact O-CD1 3.48Å; E669-I673 VanDerWaalsContact O-CG1 3.22Å; E669-I673 WeakPolarHBondContact O-CG1 3.19Å; E669-I673 PolarHBondContact O-N 3.13Å; I673-S676 PolarHBondContact O-N 3.28Å; I673-H677 PolarHBondContact O-CD2 3.25Å; I673-H677 PolarHBondContact O-N 3.3Å; I673-H677 VanDerWaalsContact O-N 3.13Å; I673-L680 HydrophobicContact CG2-CD1 3.86Å
674	F	95.6	Very high	92.8	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-75.6	-24.6	-176.5	-76	-110.1	0	0	0	112.6	L595 A599 L628 F670 L680 L681 R687 L690	L595-F674 HydrophobicContact CB-CE2 4.05Å; L595-F674 HydrophobicContact CB-CZ 3.75Å; L595-F674 WeakPolarHBondContact O-CZ 3.42Å; A599-F674 HydrophobicContact CB-CE2 3.8Å; A599-F674 HydrophobicContact CB-CZ 3.96Å; L628-F674 HydrophobicContact CD1-CE1 4.04Å; L628-F674 HydrophobicContact CD1-CZ 3.97Å; L628-F674 HydrophobicContact CD2-CE1 3.92Å; L628-F674 HydrophobicContact CD2-CZ 4.08Å; F670-F674 AromaticContact CD2-CD2 3.57Å; F670-F674 HydrophobicContact CD2-CD2 3.57Å; F670-F674 AromaticContact CD2-CE2 3.81Å; F670-F674 HydrophobicContact CD2-CE2 3.81Å; F670-F674 HydrophobicContact CD2-CG 4.01Å; F670-F674 HydrophobicContact CD2-CZ 4.44Å; F670-F674 HydrophobicContact CE2-CB 4.37Å; F670-F674 HydrophobicContact CE2-CD1 4.05Å; F670-F674 AromaticContact CE2-CD2 3.86Å; F670-F674 HydrophobicContact CE2-CD2 3.86Å; F670-F674 HydrophobicContact CE2-CE1 4.35Å; F670-F674 HydrophobicContact CE2-CE2 4.16Å; F670-F674 AromaticContact CE2-CG 3.83Å; F670-F674 HydrophobicContact CE2-CG 3.83Å; F670-F674 HydrophobicContact CE2-CZ 4.42Å; F670-F674 WeakPolarHBondContact O-CB 3.44Å; F670-F674 WeakPolarHBondContact O-CD2 3.45Å; F670-F674 PolarHBondContact O-N 2.7Å; F670-F674 VanDerWaalsContact O-N 3.12Å; F674-L680 HydrophobicContact CD1-CB 4.38Å; F674-L680 HydrophobicContact CE1-CB 4.41Å; F674-L681 HydrophobicContact CD1-CB 4.07Å; F674-R687 WeakPolarHBondContact O-CD 3.4Å; F674-L690 HydrophobicContact CB-CD1 3.48Å; F674-L690 VanDerWaalsContact CB-CD1 3.48Å
675	M	94.7	Very high	92.5	Very high	0 Å²	0	25.1 Å²	25.1	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-73.1	-34.9	167.2	-75.7	-168	-64.8	0	0	113.1	S671 R687 L690 A691 L694 A748 L749 T751 A752	S671-M675 VanDerWaalsContact O-CB 3.22Å; S671-M675 WeakPolarHBondContact O-CB 3.48Å; S671-M675 VanDerWaalsContact O-CE 3.29Å; S671-M675 WeakPolarHBondContact O-CE 3.28Å; S671-M675 WeakPolarHBondContact O-CG 3.3Å; S671-M675 PolarHBondContact O-N 3.28Å; S671-M675 VanDerWaalsContact O-N 3.08Å; M675-R687 HydrophobicContact CG-CG 4.25Å; M675-L690 HydrophobicContact CG-CB 3.67Å; M675-L690 HydrophobicContact CG-CD1 4.03Å; M675-L690 HydrophobicContact CG-CG 4.42Å; M675-L690 HydrophobicContact SD-CB 4.03Å; M675-A691 HydrophobicContact SD-CB 4.38Å; M675-L694 HydrophobicContact CE-CB 4.31Å; M675-L694 HydrophobicContact CE-CD2 3.74Å; M675-A748 HydrophobicContact CB-CB 4Å; M675-L749 HydrophobicContact SD-CD1 4.42Å; M675-T751 WeakPolarHBondContact O-CG2 3.38Å; M675-A752 HydrophobicContact CB-CB 4.21Å; M675-A752 HydrophobicContact CG-CB 3.96Å; M675-A752 HydrophobicContact SD-CB 3.89Å
676	S	91.6	Very high	92.4	Very high	28 Å²	28	22.5 Å²	22.5	20%	0.196	13%	0.134	C	C	.	.	H	α-helix	trans	-72.8	-39.5	-177.3	-61.3	0	0	0	0	113.4	I672 I673 A748	I672-S676 WeakPolarHBondContact O-CB 3.36Å; I672-S676 PolarHBondContact O-N 3.36Å; I672-S676 PolarHBondContact O-OG 3.42Å; I673-S676 PolarHBondContact O-N 3.28Å; S676-A748 WeakPolarHBondContact OG-CA 3.38Å; S676-A748 WeakPolarHBondContact OG-CB 3.35Å
677	H	90.3	Very high	92.3	Very high	80 Å²	80	23.1 Å²	23.1	37%	0.37	14%	0.136	S	C	.	.			trans	-109.8	101.3	-171.2	-63.4	-72.5	0	0	0	111.8	I673 G679 L680	I673-H677 PolarHBondContact O-CD2 3.25Å; I673-H677 PolarHBondContact O-N 3.3Å; I673-H677 VanDerWaalsContact O-N 3.13Å; H677-G679 PolarHBondContact O-N 3.08Å; H677-G679 VanDerWaalsContact O-N 3.1Å; H677-L680 HydrophobicContact CB-CB 4.36Å; H677-L680 HydrophobicContact CB-CD1 3.7Å; H677-L680 HydrophobicContact CB-CG 3.76Å; H677-L680 PolarHBondContact O-N 2.7Å
678	T	87.6	Confident	92	Very high	73 Å²	73	23.1 Å²	23.1	45%	0.448	14%	0.136	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-18.8	-173.3	60.9	0	0	0	0	114.9	L681 R687 T751	T678-L681 CarbonylContact O-C 3.57Å; T678-R687 PolarHBondContact O-NH1 2.86Å; T678-T751 HydrophobicContact CG2-CG2 3.87Å
679	G	86	Confident	91.9	Very high	45 Å²	45	24.6 Å²	24.6	46%	0.464	14%	0.141	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.8	-16.5	175.1	0	0	0	0	0	115.1	H677	H677-G679 PolarHBondContact O-N 3.08Å; H677-G679 VanDerWaalsContact O-N 3.1Å
680	L	90.7	Very high	92	Very high	8 Å²	8	22.1 Å²	22.1	4%	0.042	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83	-29.3	177.9	-63.1	-177.2	0	0	0	112.4	A599 I602 L603 L628 I673 F674 H677	A599-L680 HydrophobicContact CB-CD1 3.74Å; I602-L680 HydrophobicContact CB-CD2 4.37Å; I602-L680 HydrophobicContact CD1-CD2 4.18Å; I602-L680 HydrophobicContact CG2-CD2 4.18Å; L603-L680 HydrophobicContact CD1-CD1 4.2Å; L603-L680 HydrophobicContact CD2-CD1 4.4Å; L603-L680 HydrophobicContact CG-CD1 4.35Å; L628-L680 HydrophobicContact CD2-CB 3.93Å; L628-L680 HydrophobicContact CD2-CD2 3.84Å; L628-L680 HydrophobicContact CD2-CG 4.42Å; L628-L680 WeakPolarHBondContact CD2-O 3.28Å; I673-L680 HydrophobicContact CG2-CD1 3.86Å; F674-L680 HydrophobicContact CD1-CB 4.38Å; F674-L680 HydrophobicContact CE1-CB 4.41Å; H677-L680 HydrophobicContact CB-CB 4.36Å; H677-L680 HydrophobicContact CB-CD1 3.7Å; H677-L680 HydrophobicContact CB-CG 3.76Å; H677-L680 PolarHBondContact O-N 2.7Å
681	L	91.6	Very high	91.9	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	13%	0.13	C	C	.	.	S	Bend	trans	-134.1	98.7	172.8	-176.5	56	0	0	0	109.2	L479 F674 T678 L686 R687 L690	L479-L681 HydrophobicContact CB-CD1 4.5Å; L479-L681 HydrophobicContact CD2-CD1 3.65Å; L479-L681 CarbonylContact O-C 3.55Å; L479-L681 VanDerWaalsContact O-CA 3.28Å; L479-L681 WeakPolarHBondContact O-CA 3.5Å; F674-L681 HydrophobicContact CD1-CB 4.07Å; T678-L681 CarbonylContact O-C 3.57Å; L681-L686 HydrophobicContact CD1-CD2 4.11Å; L681-L686 HydrophobicContact CD1-CG 4.42Å; L681-L686 HydrophobicContact CD2-CB 4.45Å; L681-L686 HydrophobicContact CD2-CG 4.26Å; L681-R687 HydrophobicContact CD2-CB 3.89Å; L681-R687 HydrophobicContact CG-CB 4.27Å; L681-R687 PolarHBondContact O-NH1 3.37Å; L681-L690 HydrophobicContact CD2-CD1 3.95Å
682	T	89	Confident	91.7	Very high	59 Å²	59	23.9 Å²	23.9	36%	0.362	14%	0.138	S	C	.	.			trans	-68.9	-35.6	-173.1	40.9	0	0	0	0	112.9	L479 P481 P684	L479-T682 PolarHBondContact O-N 3.24Å; L479-T682 PolarHBondContact O-OG1 3.21Å; L479-T682 VanDerWaalsContact O-OG1 3.13Å; P481-T682 VanDerWaalsContact CD-CG2 3.44Å; P481-T682 HydrophobicContact CG-CG2 3.65Å; T682-P684 WeakPolarHBondContact O-CD 3.12Å
683	N	89.6	Confident	91.7	Very high	41 Å²	41	23.8 Å²	23.8	22%	0.219	14%	0.137	C	C	.	.			trans	-69.9	110.3	-179.1	-176.3	-21	0	0	0	111	E633 H685 L686 R687	E633-N683 WeakPolarHBondContact OE1-CB 3.44Å; E633-N683 PolarHBondContact OE2-ND2 3.37Å; N683-H685 PolarHBondContact O-N 3.4Å; N683-H685 WeakPolarHBondContact OD1-CB 3.42Å; N683-H685 PolarHBondContact OD1-N 2.92Å; N683-H685 VanDerWaalsContact OD1-N 3.08Å; N683-L686 HydrophobicContact CB-CB 3.98Å; N683-L686 PolarHBondContact O-N 3.32Å; N683-L686 PolarHBondContact OD1-N 3.34Å; N683-R687 WeakPolarHBondContact O-CB 3.32Å; N683-R687 PolarHBondContact O-N 3.02Å
684	P	89.5	Confident	91.7	Very high	25 Å²	25	23.1 Å²	23.1	16%	0.162	13%	0.134	C	C	.	.	H	α-helix	trans	-70	-31.4	-175.6	28	-32.6	0	0	0	112.5	T682 R687 A688 S759	T682-P684 WeakPolarHBondContact O-CD 3.12Å; P684-R687 PolarHBondContact O-N 3.27Å; P684-A688 WeakPolarHBondContact O-CB 3.35Å; P684-A688 PolarHBondContact O-N 3.08Å; P684-S759 WeakPolarHBondContact CG-OG 3.41Å
685	H	88.4	Confident	91.6	Very high	39 Å²	39	24 Å²	24	18%	0.181	14%	0.138	C	C	.	.	H	α-helix	trans	-66.8	-47.2	176.8	-57.6	-63.2	0	0	0	110.4	N683 R687 A688 R689 V830	N683-H685 PolarHBondContact O-N 3.4Å; N683-H685 WeakPolarHBondContact OD1-CB 3.42Å; N683-H685 PolarHBondContact OD1-N 2.92Å; N683-H685 VanDerWaalsContact OD1-N 3.08Å; H685-R687 VanDerWaalsContact C-N 3.31Å; H685-R687 PolarHBondContact O-N 3.43Å; H685-A688 WeakPolarHBondContact O-CB 3.44Å; H685-A688 PolarHBondContact O-N 3.16Å; H685-A688 VanDerWaalsContact O-N 3.14Å; H685-R689 WeakPolarHBondContact O-CG 3.47Å; H685-R689 PolarHBondContact O-N 3.1Å; H685-R689 VanDerWaalsContact O-N 3.11Å; H685-V830 WeakPolarHBondContact CE1-CG2 3.48Å
686	L	90.5	Very high	91.5	Very high	4 Å²	4	24.1 Å²	24.1	2%	0.021	14%	0.139	C	C	.	.	H	α-helix	trans	-63.7	-39.3	177.5	-170.3	51.1	0	0	0	111.7	E633 V636 D637 L681 N683 A688 R689 L690	E633-L686 HydrophobicContact CB-CD2 3.83Å; E633-L686 HydrophobicContact CG-CD2 4.27Å; V636-L686 HydrophobicContact CB-CD1 4.46Å; V636-L686 HydrophobicContact CB-CD2 4.07Å; V636-L686 HydrophobicContact CB-CG 4.34Å; V636-L686 HydrophobicContact CG1-CD1 3.78Å; V636-L686 HydrophobicContact CG1-CD2 4.05Å; V636-L686 HydrophobicContact CG1-CG 3.76Å; D637-L686 WeakPolarHBondContact OD1-CD1 3.41Å; L681-L686 HydrophobicContact CD1-CD2 4.11Å; L681-L686 HydrophobicContact CD1-CG 4.42Å; L681-L686 HydrophobicContact CD2-CB 4.45Å; L681-L686 HydrophobicContact CD2-CG 4.26Å; N683-L686 HydrophobicContact CB-CB 3.98Å; N683-L686 PolarHBondContact O-N 3.32Å; N683-L686 PolarHBondContact OD1-N 3.34Å; L686-A688 VanDerWaalsContact C-N 3.31Å; L686-A688 PolarHBondContact O-N 2.92Å; L686-R689 WeakPolarHBondContact O-CB 3.47Å; L686-R689 PolarHBondContact O-N 3.28Å; L686-L690 PolarHBondContact O-N 3.2Å
687	R	92.4	Very high	91.6	Very high	13 Å²	13	22.8 Å²	22.8	5%	0.049	13%	0.129	C	C	.	.	H	α-helix	trans	-60.7	-40.1	173.4	-175.2	167.8	61.5	-129.7	8	112.2	F674 M675 T678 L681 N683 P684 H685 R689 L690 A752 S755	F674-R687 WeakPolarHBondContact O-CD 3.4Å; M675-R687 HydrophobicContact CG-CG 4.25Å; T678-R687 PolarHBondContact O-NH1 2.86Å; L681-R687 HydrophobicContact CD2-CB 3.89Å; L681-R687 HydrophobicContact CG-CB 4.27Å; L681-R687 PolarHBondContact O-NH1 3.37Å; N683-R687 WeakPolarHBondContact O-CB 3.32Å; N683-R687 PolarHBondContact O-N 3.02Å; P684-R687 PolarHBondContact O-N 3.27Å; H685-R687 VanDerWaalsContact C-N 3.31Å; H685-R687 PolarHBondContact O-N 3.43Å; R687-R689 VanDerWaalsContact C-N 3.32Å; R687-R689 PolarHBondContact O-N 3.04Å; R687-L690 VanDerWaalsContact O-CB 3.26Å; R687-L690 WeakPolarHBondContact O-CB 3.5Å; R687-L690 WeakPolarHBondContact O-CG 3.42Å; R687-L690 PolarHBondContact O-N 2.86Å; R687-A752 HydrophobicContact CG-CB 4.4Å; R687-S755 PolarHBondContact NH2-OG 3.22Å
688	A	91.6	Very high	91.6	Very high	0 Å²	0	19.1 Å²	19.1	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-64.4	-36.3	176.5	0	0	0	0	0	113.1	P684 H685 L686 L690 A691 I756 Y838 M842	P684-A688 WeakPolarHBondContact O-CB 3.35Å; P684-A688 PolarHBondContact O-N 3.08Å; H685-A688 WeakPolarHBondContact O-CB 3.44Å; H685-A688 PolarHBondContact O-N 3.16Å; H685-A688 VanDerWaalsContact O-N 3.14Å; L686-A688 VanDerWaalsContact C-N 3.31Å; L686-A688 PolarHBondContact O-N 2.92Å; A688-L690 PolarHBondContact O-N 3.21Å; A688-A691 VanDerWaalsContact O-CB 3.22Å; A688-A691 WeakPolarHBondContact O-CB 3.4Å; A688-A691 PolarHBondContact O-N 3.49Å; A688-I756 HydrophobicContact CB-CD1 3.24Å; A688-I756 HydrophobicContact CB-CG1 3.46Å; A688-I756 VanDerWaalsContact CB-CG1 3.46Å; A688-Y838 HydrophobicContact CB-CD1 3.94Å; A688-Y838 HydrophobicContact CB-CG 4.05Å; A688-M842 HydrophobicContact CB-CE 4.08Å
689	R	93.3	Very high	91.6	Very high	34 Å²	34	16.1 Å²	16.1	13%	0.128	10%	0.095	C	C	.	.	H	α-helix	trans	-63.9	-19.5	175	-61.4	-167.6	70.9	-168.8	1.8	113.6	D637 V640 E641 H685 L686 R687 A691 E692 Y838	D637-R689 IonicContact OD1-NH1 3.74Å; D637-R689 PolarHBondContact OD1-NH1 3.47Å; V640-R689 HydrophobicContact CG1-CB 3.83Å; V640-R689 HydrophobicContact CG2-CB 4.41Å; E641-R689 IonicContact OE1-CZ 3.78Å; E641-R689 IonicContact OE1-NH1 2.82Å; E641-R689 PolarHBondContact OE1-NH1 3.34Å; E641-R689 IonicContact OE1-NH2 3.17Å; E641-R689 PolarHBondContact OE1-NH2 3.22Å; H685-R689 WeakPolarHBondContact O-CG 3.47Å; H685-R689 PolarHBondContact O-N 3.1Å; H685-R689 VanDerWaalsContact O-N 3.11Å; L686-R689 WeakPolarHBondContact O-CB 3.47Å; L686-R689 PolarHBondContact O-N 3.28Å; R687-R689 VanDerWaalsContact C-N 3.32Å; R687-R689 PolarHBondContact O-N 3.04Å; R689-A691 PolarHBondContact O-N 3.19Å; R689-E692 WeakPolarHBondContact CB-OE1 3.36Å; R689-E692 WeakPolarHBondContact CG-OE1 3.27Å; R689-E692 IonicContact CZ-OE1 2.63Å; R689-E692 IonicContact NE-OE1 2.96Å; R689-E692 PolarHBondContact NE-OE1 3.41Å; R689-E692 IonicContact NH2-OE1 3.19Å; R689-E692 IonicContact NH2-OE2 2.79Å; R689-E692 WeakPolarHBondContact O-CB 3.5Å; R689-E692 WeakPolarHBondContact O-CG 3.16Å; R689-E692 PolarHBondContact O-N 3.43Å; R689-Y838 HydrophobicContact CG-CD1 3.78Å; R689-Y838 HydrophobicContact CG-CE1 3.44Å; R689-Y838 VanDerWaalsContact CG-CE1 3.44Å
690	L	96.1	Very high	91.2	Very high	0 Å²	0	17.7 Å²	17.7	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-63.3	-20	172.1	-57.3	-176.8	0	0	0	112.4	V636 V640 F670 F674 M675 L681 L686 R687 A688 E692 V693 L694	V636-L690 HydrophobicContact CG1-CD2 3.85Å; V640-L690 HydrophobicContact CG2-CD2 4Å; F670-L690 HydrophobicContact CD1-CD2 4.42Å; F670-L690 HydrophobicContact CE1-CD2 3.44Å; F670-L690 VanDerWaalsContact CE1-CD2 3.44Å; F670-L690 HydrophobicContact CZ-CD1 4.48Å; F670-L690 HydrophobicContact CZ-CD2 3.57Å; F674-L690 HydrophobicContact CB-CD1 3.48Å; F674-L690 VanDerWaalsContact CB-CD1 3.48Å; M675-L690 HydrophobicContact CG-CB 3.67Å; M675-L690 HydrophobicContact CG-CD1 4.03Å; M675-L690 HydrophobicContact CG-CG 4.42Å; M675-L690 HydrophobicContact SD-CB 4.03Å; L681-L690 HydrophobicContact CD2-CD1 3.95Å; L686-L690 PolarHBondContact O-N 3.2Å; R687-L690 VanDerWaalsContact O-CB 3.26Å; R687-L690 WeakPolarHBondContact O-CB 3.5Å; R687-L690 WeakPolarHBondContact O-CG 3.42Å; R687-L690 PolarHBondContact O-N 2.86Å; A688-L690 PolarHBondContact O-N 3.21Å; L690-E692 PolarHBondContact O-N 3.43Å; L690-V693 WeakPolarHBondContact O-CB 3.38Å; L690-V693 PolarHBondContact O-N 3.34Å; L690-L694 PolarHBondContact O-N 3.42Å
691	A	94	Very high	90.2	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-65.9	-27.2	169.3	0	0	0	0	0	112.4	M675 A688 R689 V693 L694 E695 L749 P841 M842	M675-A691 HydrophobicContact SD-CB 4.38Å; A688-A691 VanDerWaalsContact O-CB 3.22Å; A688-A691 WeakPolarHBondContact O-CB 3.4Å; A688-A691 PolarHBondContact O-N 3.49Å; R689-A691 PolarHBondContact O-N 3.19Å; A691-V693 VanDerWaalsContact C-N 3.35Å; A691-L694 PolarHBondContact O-N 3.43Å; A691-E695 WeakPolarHBondContact O-CB 3.5Å; A691-E695 PolarHBondContact O-N 2.82Å; A691-L749 HydrophobicContact CB-CD1 3.98Å; A691-P841 HydrophobicContact CB-CB 4.22Å; A691-M842 HydrophobicContact CB-CE 3.92Å; A691-M842 HydrophobicContact CB-CG 3.58Å
692	E	92.9	Very high	88.5	Confident	36 Å²	36	21.3 Å²	21.3	17%	0.168	11%	0.105	C	C	.	.	H	α-helix	trans	-65.6	-40.5	171.7	-57.1	172.8	-136.3	0	0	110.7	S644 R689 L690 S696 P841	S644-E692 WeakPolarHBondContact CB-OE2 3.38Å; S644-E692 WeakPolarHBondContact OG-CB 3.31Å; S644-E692 PolarHBondContact OG-OE2 3.29Å; R689-E692 WeakPolarHBondContact CB-OE1 3.36Å; R689-E692 WeakPolarHBondContact CG-OE1 3.27Å; R689-E692 IonicContact CZ-OE1 2.63Å; R689-E692 IonicContact NE-OE1 2.96Å; R689-E692 PolarHBondContact NE-OE1 3.41Å; R689-E692 IonicContact NH2-OE1 3.19Å; R689-E692 IonicContact NH2-OE2 2.79Å; R689-E692 WeakPolarHBondContact O-CB 3.5Å; R689-E692 WeakPolarHBondContact O-CG 3.16Å; R689-E692 PolarHBondContact O-N 3.43Å; L690-E692 PolarHBondContact O-N 3.43Å; E692-S696 WeakPolarHBondContact O-CB 3.44Å; E692-S696 PolarHBondContact O-N 3.28Å; E692-S696 PolarHBondContact O-OG 2.85Å; E692-P841 HydrophobicContact CB-CG 4.49Å; E692-P841 HydrophobicContact CG-CB 4.42Å; E692-P841 HydrophobicContact CG-CG 3.74Å
693	V	95.9	Very high	86.8	Confident	0 Å²	0	21.4 Å²	21.4	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-64.3	-47	175.5	-179.8	0	0	0	0	109.9	V640 V643 L667 L690 A691 S696 L697	V640-V693 HydrophobicContact CB-CG2 4.45Å; V640-V693 HydrophobicContact CG2-CG2 3.93Å; V643-V693 HydrophobicContact CB-CG2 4.34Å; V643-V693 HydrophobicContact CG1-CB 4.41Å; V643-V693 HydrophobicContact CG1-CG1 4.19Å; V643-V693 HydrophobicContact CG1-CG2 4.45Å; L667-V693 HydrophobicContact CB-CG1 4.27Å; L667-V693 HydrophobicContact CD2-CG1 4.48Å; L690-V693 WeakPolarHBondContact O-CB 3.38Å; L690-V693 PolarHBondContact O-N 3.34Å; A691-V693 VanDerWaalsContact C-N 3.35Å; V693-S696 WeakPolarHBondContact O-CB 3.03Å; V693-S696 PolarHBondContact O-N 2.85Å; V693-L697 WeakPolarHBondContact O-CG 3.37Å; V693-L697 PolarHBondContact O-N 3.22Å
694	L	95.1	Very high	84.7	Confident	1 Å²	1	25.4 Å²	25.4	1%	0.005	12%	0.12	C	C	.	.	H	α-helix	trans	-63	-43.8	178.9	-176	61.2	0	0	0	112.1	L668 M675 L690 A691 S696 L697 V698 M730 L749 W849	L668-L694 HydrophobicContact CD1-CD1 3.67Å; M675-L694 HydrophobicContact CE-CB 4.31Å; M675-L694 HydrophobicContact CE-CD2 3.74Å; L690-L694 PolarHBondContact O-N 3.42Å; A691-L694 PolarHBondContact O-N 3.43Å; L694-S696 VanDerWaalsContact C-N 3.29Å; L694-S696 PolarHBondContact O-N 2.96Å; L694-L697 PolarHBondContact O-N 2.82Å; L694-L697 VanDerWaalsContact O-N 3.11Å; L694-V698 PolarHBondContact O-N 2.84Å; L694-M730 HydrophobicContact CD1-CE 4.09Å; L694-L749 HydrophobicContact CD2-CD1 4.23Å; L694-W849 HydrophobicContact CD2-CH2 4.01Å; L694-W849 HydrophobicContact CD2-CZ2 3.92Å
695	E	92.8	Very high	82.3	Confident	19 Å²	19	27.2 Å²	27.2	9%	0.089	14%	0.137	C	C	.	.	H	α-helix	trans	-61.2	-37.1	176.1	-178.9	-89.6	152.3	0	0	112	R647 A691 L697 V698 P841 A844	R647-E695 WeakPolarHBondContact CG-OE2 3.3Å; R647-E695 IonicContact CZ-OE1 3.13Å; R647-E695 IonicContact NE-OE1 3.63Å; R647-E695 PolarHBondContact NE-OE1 2.82Å; R647-E695 IonicContact NE-OE2 2.62Å; R647-E695 IonicContact NH2-OE1 3.36Å; R647-E695 PolarHBondContact NH2-OE1 2.75Å; A691-E695 WeakPolarHBondContact O-CB 3.5Å; A691-E695 PolarHBondContact O-N 2.82Å; E695-L697 PolarHBondContact O-N 3.03Å; E695-V698 WeakPolarHBondContact O-CB 3.42Å; E695-V698 PolarHBondContact O-N 3.09Å; E695-V698 VanDerWaalsContact O-N 3.12Å; E695-P841 HydrophobicContact CB-CB 3.89Å; E695-P841 HydrophobicContact CG-CB 4.21Å; E695-A844 HydrophobicContact CG-CB 3.6Å
696	S	92.5	Very high	79.9	Confident	1 Å²	1	27.6 Å²	27.6	1%	0.007	14%	0.137	C	C	.	.	H	α-helix	trans	-64.7	-28.5	176.1	-58	0	0	0	0	113	V643 R647 E692 V693 L694 R726	V643-S696 VanDerWaalsContact CG1-CB 3.42Å; R647-S696 WeakPolarHBondContact CB-OG 3.42Å; E692-S696 WeakPolarHBondContact O-CB 3.44Å; E692-S696 PolarHBondContact O-N 3.28Å; E692-S696 PolarHBondContact O-OG 2.85Å; V693-S696 WeakPolarHBondContact O-CB 3.03Å; V693-S696 PolarHBondContact O-N 2.85Å; L694-S696 VanDerWaalsContact C-N 3.29Å; L694-S696 PolarHBondContact O-N 2.96Å; S696-R726 WeakPolarHBondContact O-CD 3.38Å; S696-R726 PolarHBondContact O-NH1 2.66Å
697	L	93.5	Very high	77.3	Confident	0 Å²	0	30.5 Å²	30.5	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-84.1	-10.9	177.1	-61.4	174.4	0	0	0	113	L664 L667 L668 V693 L694 E695 R726 L729 M730	L664-L697 HydrophobicContact CB-CD2 4.42Å; L667-L697 HydrophobicContact CB-CD1 3.95Å; L667-L697 HydrophobicContact CB-CD2 4.44Å; L667-L697 HydrophobicContact CD1-CD2 4.39Å; L668-L697 HydrophobicContact CB-CD1 3.96Å; L668-L697 HydrophobicContact CD1-CD1 4.31Å; V693-L697 WeakPolarHBondContact O-CG 3.37Å; V693-L697 PolarHBondContact O-N 3.22Å; L694-L697 PolarHBondContact O-N 2.82Å; L694-L697 VanDerWaalsContact O-N 3.11Å; E695-L697 PolarHBondContact O-N 3.03Å; L697-R726 WeakPolarHBondContact O-CB 3.5Å; L697-R726 WeakPolarHBondContact O-CD 3.49Å; L697-R726 WeakPolarHBondContact O-CG 3.48Å; L697-L729 HydrophobicContact CB-CD2 4.35Å; L697-L729 HydrophobicContact CD1-CD2 4.31Å; L697-L729 HydrophobicContact CD2-CD2 4.2Å; L697-M730 HydrophobicContact CB-CE 3.43Å; L697-M730 VanDerWaalsContact CB-CE 3.43Å; L697-M730 WeakPolarHBondContact O-CE 3.39Å
698	V	90.3	Very high	74.2	Confident	3 Å²	3	35.2 Å²	35.2	2%	0.018	18%	0.183	C	C	.	.	S	Bend	trans	-75.5	129.7	176.6	167.9	0	0	0	0	110.2	L694 E695 Q700 M730 Y848	L694-V698 PolarHBondContact O-N 2.84Å; E695-V698 WeakPolarHBondContact O-CB 3.42Å; E695-V698 PolarHBondContact O-N 3.09Å; E695-V698 VanDerWaalsContact O-N 3.12Å; V698-Q700 HydrophobicContact CG1-CB 4.24Å; V698-Q700 PolarHBondContact O-N 3.05Å; V698-M730 HydrophobicContact CG2-CE 4.3Å; V698-Y848 VanDerWaalsContact CG1-CB 3.49Å; V698-Y848 HydrophobicContact CG1-CD1 3.73Å; V698-Y848 HydrophobicContact CG1-CD2 3.66Å; V698-Y848 HydrophobicContact CG1-CE1 4.39Å; V698-Y848 HydrophobicContact CG1-CE2 4.3Å; V698-Y848 HydrophobicContact CG1-CG 3.33Å; V698-Y848 HydrophobicContact CG2-CD1 4.12Å; V698-Y848 HydrophobicContact CG2-CG 4.48Å
699	P	87.5	Confident	71.1	Confident	11 Å²	11	42.3 Å²	42.3	7%	0.071	22%	0.221	C	C	.	.	S	Bend	trans	-79.6	46.7	-176.6	34.2	-38.3	0	0	0	113.1	F723 R726 E727 Y848	P699-F723 VanDerWaalsContact C-CD2 3.48Å; P699-F723 HydrophobicContact CB-CB 3.28Å; P699-F723 HydrophobicContact CB-CD2 4.22Å; P699-F723 HydrophobicContact CB-CG 3.86Å; P699-F723 WeakPolarHBondContact O-CD2 3.18Å; P699-R726 HydrophobicContact CB-CB 3.95Å; P699-E727 HydrophobicContact CB-CG 3.61Å; P699-E727 HydrophobicContact CG-CG 3.81Å; P699-Y848 HydrophobicContact CG-CD2 4.5Å; P699-Y848 HydrophobicContact CG-CE2 3.53Å; P699-Y848 WeakPolarHBondContact CG-OH 3.29Å
700	Q	78.2	Confident	68.1	Low	77 Å²	77	45.3 Å²	45.3	36%	0.36	24%	0.243	S	C	.	.			trans	-157.8	139	178.8	-176.5	175.4	12.5	0	0	109.8	R647 V698 Y848	R647-Q700 PolarHBondContact NH2-O 3.48Å; V698-Q700 HydrophobicContact CG1-CB 4.24Å; V698-Q700 PolarHBondContact O-N 3.05Å; Q700-Y848 HydrophobicContact CB-CD2 4.29Å
701	R	68.5	Low	64.8	Low	62 Å²	62	51.8 Å²	51.8	23%	0.234	29%	0.289	C	S	.	.			trans	-97.2	144	170.6	-78.1	-177.5	74.4	139.5	-0.2	112	D703	R701-D703 IonicContact CZ-OD2 2.7Å; R701-D703 IonicContact NE-OD2 2.81Å; R701-D703 PolarHBondContact NE-OD2 3.32Å; R701-D703 VanDerWaalsContact NE-OD2 3.15Å; R701-D703 IonicContact NH2-OD2 3.44Å; R701-D703 PolarHBondContact NH2-OD2 3.43Å; R701-D703 PolarHBondContact O-N 2.87Å
702	D	56.5	Low	61.8	Low	23 Å²	23	54.1 Å²	54.1	12%	0.123	31%	0.312	C	S	.	.	G	3₁₀ helix	trans	-62.8	-28.6	174.4	-80.3	-25.5	0	0	0	113.4	E704 A844 R847	D702-E704 VanDerWaalsContact C-N 3.29Å; D702-E704 PolarHBondContact O-N 3.15Å; D702-A844 WeakPolarHBondContact OD1-CB 3.26Å; D702-A844 WeakPolarHBondContact OD2-CB 3.41Å; D702-R847 IonicContact OD1-CZ 3.69Å; D702-R847 IonicContact OD1-NE 3.3Å; D702-R847 IonicContact OD1-NH1 3.75Å
703	D	53.8	Low	58.9	Low	61 Å²	61	56.5 Å²	56.5	33%	0.326	33%	0.333	S	S	.	.	G	3₁₀ helix	trans	-69	-24.6	-168.2	-57.1	-39.4	0	0	0	113.5	R701 A705	R701-D703 IonicContact CZ-OD2 2.7Å; R701-D703 IonicContact NE-OD2 2.81Å; R701-D703 PolarHBondContact NE-OD2 3.32Å; R701-D703 VanDerWaalsContact NE-OD2 3.15Å; R701-D703 IonicContact NH2-OD2 3.44Å; R701-D703 PolarHBondContact NH2-OD2 3.43Å; R701-D703 PolarHBondContact O-N 2.87Å; D703-A705 PolarHBondContact O-N 3.14Å
704	E	44.9	Very low	56	Low	125 Å²	125	59.1 Å²	59.1	58%	0.584	36%	0.36	S	S	*	.	G	3₁₀ helix	trans	-66.6	-21.9	-172	-70.3	-169.6	163.4	0	0	114	D702	D702-E704 VanDerWaalsContact C-N 3.29Å; D702-E704 PolarHBondContact O-N 3.15Å
705	A	40.6	Very low	53.4	Low	63 Å²	63	63.6 Å²	63.6	52%	0.521	38%	0.383	S	S	.	.	G	3₁₀ helix	trans	-99.3	-24.8	-175	0	0	0	0	0	113.8	D703	D703-A705 PolarHBondContact O-N 3.14Å
706	W	37.7	Very low	50.8	Low	46 Å²	46	68.5 Å²	68.5	17%	0.174	41%	0.41	C	S	.	.	T	Hydrogen-bonded Turn	trans	-120.2	-31.5	-161.7	-72.4	38	0	0	0	115.1	M938 L941 D942 K997	W706-M938 HydrophobicContact CE3-CE 4.47Å; W706-M938 HydrophobicContact CZ3-CB 4.44Å; W706-M938 WeakPolarHBondContact CZ3-O 3.35Å; W706-L941 HydrophobicContact CE3-CD2 4.12Å; W706-L941 HydrophobicContact CH2-CB 3.36Å; W706-L941 HydrophobicContact CH2-CD2 3.29Å; W706-L941 HydrophobicContact CH2-CG 3.16Å; W706-L941 HydrophobicContact CZ2-CB 4.35Å; W706-L941 HydrophobicContact CZ2-CD2 3.65Å; W706-L941 HydrophobicContact CZ2-CG 3.68Å; W706-L941 HydrophobicContact CZ3-CB 3.68Å; W706-L941 HydrophobicContact CZ3-CD2 3.52Å; W706-L941 HydrophobicContact CZ3-CG 3.78Å; W706-D942 HydrophobicContact CH2-CB 4.45Å; W706-D942 WeakPolarHBondContact CH2-OD1 3.31Å; W706-D942 VanDerWaalsContact CZ2-OD1 3.31Å; W706-D942 WeakPolarHBondContact CZ2-OD1 3.32Å; W706-K997 PolarHBondContact O-NZ 3.32Å; W706-K997 VanDerWaalsContact O-NZ 3.14Å
707	N	34.5	Very low	48.3	Very low	66 Å²	66	75.3 Å²	75.3	35%	0.353	45%	0.446	S	S	.	.			trans	-106.2	34.2	-171.8	-81.7	-25.7	0	0	0	113.9	N709 R934	N707-N709 PolarHBondContact O-N 3.48Å; N707-R934 PolarHBondContact OD1-NH2 3.15Å
708	T	27.4	Very low	45.8	Very low	111 Å²	111	79.1 Å²	79.1	68%	0.681	47%	0.473	S	S	*	.	S	Bend	trans	-67.5	2.8	178	45	0	0	0	0	115
709	N	27.9	Very low	43.6	Very low	149 Å²	149	85.7 Å²	85.7	80%	0.797	51%	0.507	S	S	*	.			trans	-154.2	103.5	167.7	-85	-38.3	0	0	0	111.7	N707	N707-N709 PolarHBondContact O-N 3.48Å
710	T	28.6	Very low	41.9	Very low	97 Å²	97	92.9 Å²	92.9	60%	0.595	55%	0.545	S	S	*	.			trans	-162.5	114.2	134.3	19.6	0	0	0	0	109.2	G712	T710-G712 PolarHBondContact O-N 3.41Å; T710-G712 VanDerWaalsContact O-N 3.09Å
711	S	28.4	Very low	41.1	Very low	137 Å²	137	90.8 Å²	90.8	96%	0.958	54%	0.536	S	S	*	.			trans	-47.7	102.3	170.3	-47.8	0	0	0	0	111.9
712	G	30.6	Very low	41.4	Very low	48 Å²	48	92.2 Å²	92.2	50%	0.495	56%	0.556	S	S	.	*			trans	-151.5	96.7	170.9	0	0	0	0	0	108.2	T710 G714	T710-G712 PolarHBondContact O-N 3.41Å; T710-G712 VanDerWaalsContact O-N 3.09Å; G712-G714 VanDerWaalsContact C-N 3.32Å; G712-G714 PolarHBondContact O-N 3.04Å
713	S	30.9	Very low	42.8	Very low	86 Å²	86	92 Å²	92	60%	0.601	55%	0.553	S	S	*	*			trans	8.6	62.9	168.6	-151.6	0	0	0	0	117.8
714	G	35.9	Very low	44.4	Very low	55 Å²	55	94.3 Å²	94.3	57%	0.567	56%	0.562	S	S	*	*			trans	-97.3	89	168.9	0	0	0	0	0	109.3	G712 L716	G712-G714 VanDerWaalsContact C-N 3.32Å; G712-G714 PolarHBondContact O-N 3.04Å; G714-L716 PolarHBondContact O-N 3.11Å
715	L	40	Very low	46.7	Very low	95 Å²	95	90.4 Å²	90.4	50%	0.497	54%	0.542	S	S	.	.	S	Bend	trans	-61.2	1.4	174.7	-98.2	154.5	0	0	0	114.3	K346	K346-L715 HydrophobicContact CB-CD2 3.78Å; K346-L715 HydrophobicContact CD-CD2 3.94Å; K346-L715 HydrophobicContact CG-CD2 4.04Å; K346-L715 PolarHBondContact NZ-O 3.11Å
716	L	39.7	Very low	49.1	Very low	123 Å²	123	87.4 Å²	87.4	64%	0.644	52%	0.517	S	S	*	.	S	Bend	trans	-130.3	73.3	-180	-60.3	174.6	0	0	0	110.1	G714 S718	G714-L716 PolarHBondContact O-N 3.11Å; L716-S718 PolarHBondContact O-N 3.48Å
717	N	38.1	Very low	51.6	Low	144 Å²	144	89.5 Å²	89.5	77%	0.77	53%	0.529	S	S	*	.			trans	-56.4	121.8	164.5	-99	-7.7	0	0	0	109.5	L719	N717-L719 PolarHBondContact O-N 2.76Å
718	S	41.8	Very low	54.2	Low	79 Å²	79	91.8 Å²	91.8	55%	0.552	54%	0.537	S	S	*	.			trans	-63.2	95.5	172.7	55.1	0	0	0	0	110.3	L716	L716-S718 PolarHBondContact O-N 3.48Å
719	L	44.2	Very low	57.2	Low	142 Å²	142	86.7 Å²	86.7	74%	0.743	51%	0.506	S	S	*	.			trans	-85.4	116.1	167.5	-77.8	155	0	0	0	107.5	N717 L721	N717-L719 PolarHBondContact O-N 2.76Å; L719-L721 PolarHBondContact O-N 2.68Å; L719-L721 VanDerWaalsContact O-N 3.08Å
720	N	51.6	Low	60	Low	162 Å²	162	79.7 Å²	79.7	87%	0.866	47%	0.468	S	S	*	.			trans	25.5	70	165.2	-63.6	-17.2	0	0	0	115.5	S722	N720-S722 PolarHBondContact O-N 2.9Å
721	L	62.1	Low	62.5	Low	32 Å²	32	78.6 Å²	78.6	17%	0.168	46%	0.459	C	S	.	.			trans	-66	121.5	173	-79.1	89.2	0	0	0	109.2	D651 E652 L719 F723	D651-L721 HydrophobicContact CB-CD2 4.12Å; E652-L721 HydrophobicContact CB-CD2 4.42Å; E652-L721 HydrophobicContact CG-CD1 4.44Å; E652-L721 HydrophobicContact CG-CD2 3.41Å; E652-L721 VanDerWaalsContact CG-CD2 3.41Å; E652-L721 HydrophobicContact CG-CG 3.73Å; L719-L721 PolarHBondContact O-N 2.68Å; L719-L721 VanDerWaalsContact O-N 3.08Å; L721-F723 HydrophobicContact CB-CE1 3.94Å; L721-F723 HydrophobicContact CB-CE2 4.05Å; L721-F723 HydrophobicContact CB-CZ 3.64Å; L721-F723 HydrophobicContact CD2-CE1 3.93Å; L721-F723 HydrophobicContact CD2-CZ 4.12Å; L721-F723 HydrophobicContact CG-CZ 4.48Å
722	S	75	Confident	64.7	Low	93 Å²	93	75.5 Å²	75.5	65%	0.65	43%	0.426	S	S	*	.			trans	-89.2	121.2	168.7	65.6	0	0	0	0	109.6	E655 N720 H724	E655-S722 WeakPolarHBondContact CG-O 3.19Å; N720-S722 PolarHBondContact O-N 2.9Å; S722-H724 PolarHBondContact O-N 2.72Å
723	F	85.3	Confident	65.9	Low	17 Å²	17	78.1 Å²	78.1	8%	0.075	43%	0.429	C	S	.	.			trans	-98.2	46.3	-174.5	-62	-69.2	0	0	0	113.2	P699 L721 R725 R726 E727	P699-F723 VanDerWaalsContact C-CD2 3.48Å; P699-F723 HydrophobicContact CB-CB 3.28Å; P699-F723 HydrophobicContact CB-CD2 4.22Å; P699-F723 HydrophobicContact CB-CG 3.86Å; P699-F723 WeakPolarHBondContact O-CD2 3.18Å; L721-F723 HydrophobicContact CB-CE1 3.94Å; L721-F723 HydrophobicContact CB-CE2 4.05Å; L721-F723 HydrophobicContact CB-CZ 3.64Å; L721-F723 HydrophobicContact CD2-CE1 3.93Å; L721-F723 HydrophobicContact CD2-CZ 4.12Å; L721-F723 HydrophobicContact CG-CZ 4.48Å; F723-R725 PolarHBondContact O-N 3.43Å; F723-R726 HydrophobicContact CB-CB 4.45Å; F723-R726 VanDerWaalsContact CD1-NH2 3.25Å; F723-R726 PolarHBondContact O-N 2.88Å; F723-E727 HydrophobicContact CB-CG 4.39Å; F723-E727 WeakPolarHBondContact O-CB 3.23Å; F723-E727 VanDerWaalsContact O-CG 3.32Å; F723-E727 WeakPolarHBondContact O-CG 3.28Å; F723-E727 PolarHBondContact O-N 2.85Å
724	H	87.9	Confident	67	Low	111 Å²	111	77.8 Å²	77.8	51%	0.514	43%	0.425	S	S	.	.	H	α-helix	trans	-60.1	-44.4	-164.9	-167.9	46.5	0	0	0	113.6	E655 S722 Q728	E655-H724 PolarHBondContact OE2-N 3.09Å; S722-H724 PolarHBondContact O-N 2.72Å; H724-Q728 PolarHBondContact CE1-NE2 3.41Å; H724-Q728 VanDerWaalsContact CE1-NE2 3.33Å; H724-Q728 PolarHBondContact NE2-NE2 3.07Å; H724-Q728 WeakPolarHBondContact O-CG 3.47Å; H724-Q728 PolarHBondContact O-N 3Å
725	R	91.6	Very high	67.6	Low	43 Å²	43	84.2 Å²	84.2	16%	0.162	44%	0.44	C	S	.	.	H	α-helix	trans	-70.3	-40.3	-177.9	-60.3	-179.3	69.6	-155.2	4.2	111.4	L654 E655 V659 S660 I662 L664 F723 Q728 L729	L654-R725 WeakPolarHBondContact O-CD 3.48Å; L654-R725 PolarHBondContact O-NH1 2.97Å; E655-R725 VanDerWaalsContact OE2-CB 3.32Å; E655-R725 WeakPolarHBondContact OE2-CB 3.49Å; E655-R725 WeakPolarHBondContact OE2-CG 3.27Å; E655-R725 PolarHBondContact OE2-N 2.72Å; V659-R725 PolarHBondContact O-NH1 3.35Å; V659-R725 VanDerWaalsContact O-NH1 3.09Å; V659-R725 PolarHBondContact O-NH2 2.9Å; S660-R725 PolarHBondContact O-NH2 3.03Å; I662-R725 PolarHBondContact O-NH2 2.95Å; L664-R725 HydrophobicContact CD1-CB 4.25Å; F723-R725 PolarHBondContact O-N 3.43Å; R725-Q728 PolarHBondContact O-N 3.32Å; R725-L729 WeakPolarHBondContact O-CB 3.37Å; R725-L729 PolarHBondContact O-N 2.98Å
726	R	92.5	Very high	68.2	Low	0 Å²	0	86.3 Å²	86.3	0%	0	45%	0.45	C	S	.	.	H	α-helix	trans	-69.2	-36.9	176.9	-78	179.9	-81.7	-174.1	-14.5	112.7	D651 E655 L664 S696 L697 P699 F723 L729 M730	D651-R726 PolarHBondContact O-NH2 3.36Å; D651-R726 IonicContact OD1-CZ 3.76Å; D651-R726 IonicContact OD1-NH1 3.93Å; D651-R726 PolarHBondContact OD1-NH1 3.01Å; D651-R726 IonicContact OD1-NH2 2.93Å; D651-R726 PolarHBondContact OD1-NH2 3.37Å; D651-R726 IonicContact OD2-NH1 3.29Å; E655-R726 WeakPolarHBondContact OE1-CG 3.44Å; E655-R726 IonicContact OE1-CZ 3.69Å; E655-R726 IonicContact OE1-NE 2.7Å; E655-R726 PolarHBondContact OE1-NE 2.97Å; E655-R726 IonicContact OE1-NH2 3.42Å; L664-R726 HydrophobicContact CD1-CG 4.3Å; S696-R726 WeakPolarHBondContact O-CD 3.38Å; S696-R726 PolarHBondContact O-NH1 2.66Å; L697-R726 WeakPolarHBondContact O-CB 3.5Å; L697-R726 WeakPolarHBondContact O-CD 3.49Å; L697-R726 WeakPolarHBondContact O-CG 3.48Å; P699-R726 HydrophobicContact CB-CB 3.95Å; F723-R726 HydrophobicContact CB-CB 4.45Å; F723-R726 VanDerWaalsContact CD1-NH2 3.25Å; F723-R726 PolarHBondContact O-N 2.88Å; R726-L729 PolarHBondContact O-N 3.47Å; R726-M730 WeakPolarHBondContact O-CB 3.43Å; R726-M730 WeakPolarHBondContact O-CG 3.46Å; R726-M730 PolarHBondContact O-N 2.69Å
727	E	89.3	Confident	68.6	Low	89 Å²	89	83.6 Å²	83.6	42%	0.416	44%	0.439	S	S	.	.	H	α-helix	trans	-62.7	-44.2	171.8	-76.4	-178.7	161.2	0	0	111.9	P699 F723 L729 M730 N731	P699-E727 HydrophobicContact CB-CG 3.61Å; P699-E727 HydrophobicContact CG-CG 3.81Å; F723-E727 HydrophobicContact CB-CG 4.39Å; F723-E727 WeakPolarHBondContact O-CB 3.23Å; F723-E727 VanDerWaalsContact O-CG 3.32Å; F723-E727 WeakPolarHBondContact O-CG 3.28Å; F723-E727 PolarHBondContact O-N 2.85Å; E727-L729 VanDerWaalsContact C-N 3.31Å; E727-L729 PolarHBondContact O-N 3.08Å; E727-M730 PolarHBondContact O-N 2.94Å; E727-N731 VanDerWaalsContact O-CB 3.28Å; E727-N731 WeakPolarHBondContact O-CB 3.25Å; E727-N731 PolarHBondContact O-N 3.48Å; E727-N731 PolarHBondContact O-ND2 3.48Å
728	Q	88.2	Confident	69.4	Low	114 Å²	114	84.4 Å²	84.4	53%	0.533	44%	0.444	S	S	.	.	H	α-helix	trans	-61.8	-39.7	174.4	-73.8	176.1	-6.9	0	0	112	H724 R725 R732	H724-Q728 PolarHBondContact CE1-NE2 3.41Å; H724-Q728 VanDerWaalsContact CE1-NE2 3.33Å; H724-Q728 PolarHBondContact NE2-NE2 3.07Å; H724-Q728 WeakPolarHBondContact O-CG 3.47Å; H724-Q728 PolarHBondContact O-N 3Å; R725-Q728 PolarHBondContact O-N 3.32Å; Q728-R732 WeakPolarHBondContact O-CG 3.38Å
729	L	90.4	Very high	70.7	Confident	4 Å²	4	82 Å²	82	2%	0.021	42%	0.424	C	S	.	.	H	α-helix	trans	-65.4	-42.5	177.6	-175.5	69.5	0	0	0	112.1	L664 E665 L668 L697 R725 R726 E727	L664-L729 HydrophobicContact CB-CD2 3.89Å; E665-L729 HydrophobicContact CG-CD1 3.92Å; L668-L729 HydrophobicContact CB-CD2 4.35Å; L668-L729 HydrophobicContact CD2-CD1 3.96Å; L668-L729 HydrophobicContact CD2-CD2 4.47Å; L668-L729 HydrophobicContact CD2-CG 4.01Å; L697-L729 HydrophobicContact CB-CD2 4.35Å; L697-L729 HydrophobicContact CD1-CD2 4.31Å; L697-L729 HydrophobicContact CD2-CD2 4.2Å; R725-L729 WeakPolarHBondContact O-CB 3.37Å; R725-L729 PolarHBondContact O-N 2.98Å; R726-L729 PolarHBondContact O-N 3.47Å; E727-L729 VanDerWaalsContact C-N 3.31Å; E727-L729 PolarHBondContact O-N 3.08Å
730	M	88.5	Confident	72.3	Confident	2 Å²	2	79.4 Å²	79.4	1%	0.01	42%	0.416	C	S	.	.	H	α-helix	trans	-89.2	-20	-173.4	-68.1	-64.8	177.1	0	0	114.9	L668 L694 L697 V698 R726 E727 L742 Y848 Y855	L668-M730 HydrophobicContact CD1-CE 3.89Å; L668-M730 HydrophobicContact CD1-SD 4.34Å; L694-M730 HydrophobicContact CD1-CE 4.09Å; L697-M730 HydrophobicContact CB-CE 3.43Å; L697-M730 VanDerWaalsContact CB-CE 3.43Å; L697-M730 WeakPolarHBondContact O-CE 3.39Å; V698-M730 HydrophobicContact CG2-CE 4.3Å; R726-M730 WeakPolarHBondContact O-CB 3.43Å; R726-M730 WeakPolarHBondContact O-CG 3.46Å; R726-M730 PolarHBondContact O-N 2.69Å; E727-M730 PolarHBondContact O-N 2.94Å; M730-L742 HydrophobicContact SD-CD1 4.45Å; M730-Y848 HydrophobicContact CB-CE1 4.12Å; M730-Y848 HydrophobicContact CG-CE1 4.38Å; M730-Y855 PolarHBondContact O-OH 3.17Å
731	N	80.4	Confident	73.9	Confident	75 Å²	75	73 Å²	73	40%	0.401	38%	0.382	S	S	.	.			trans	-112.3	34.2	-179.8	-59	-44.2	0	0	0	112.4	E727 D733 K852	E727-N731 VanDerWaalsContact O-CB 3.28Å; E727-N731 WeakPolarHBondContact O-CB 3.25Å; E727-N731 PolarHBondContact O-N 3.48Å; E727-N731 PolarHBondContact O-ND2 3.48Å; N731-D733 PolarHBondContact O-N 3.46Å; N731-K852 PolarHBondContact OD1-NZ 3.33Å
732	R	73.6	Confident	75.2	Confident	71 Å²	71	71.7 Å²	71.7	27%	0.268	38%	0.375	S	S	.	.			trans	-55.6	128.3	174	-70.2	176.3	167.1	-167.2	-10.7	110.1	E665 Q728 P734 D739	E665-R732 VanDerWaalsContact CD-NH2 3.33Å; E665-R732 IonicContact OE1-NH2 3.59Å; E665-R732 PolarHBondContact OE1-NH2 3.15Å; Q728-R732 WeakPolarHBondContact O-CG 3.38Å; R732-P734 WeakPolarHBondContact O-CD 3.42Å; R732-D739 WeakPolarHBondContact CD-OD2 3.39Å; R732-D739 IonicContact CZ-OD2 3.9Å; R732-D739 IonicContact NH1-OD2 3Å; R732-D739 PolarHBondContact NH1-OD2 3.42Å
733	D	56.7	Low	75.8	Confident	103 Å²	103	69.1 Å²	69.1	55%	0.551	36%	0.357	S	S	*	.			trans	-59	118.8	-172.2	-94.5	-40.6	0	0	0	111.1	N731 E735 I736 T737	N731-D733 PolarHBondContact O-N 3.46Å; D733-E735 PolarHBondContact O-N 3.22Å; D733-I736 HydrophobicContact CB-CB 4.29Å; D733-I736 HydrophobicContact CB-CD1 3.99Å; D733-I736 HydrophobicContact CB-CG1 4.15Å; D733-I736 PolarHBondContact O-N 3.04Å; D733-T737 PolarHBondContact O-N 3.37Å; D733-T737 PolarHBondContact O-OG1 2.93Å
734	P	53.8	Low	76.1	Confident	79 Å²	79	71 Å²	71	51%	0.513	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66	-23	-176.8	24.3	-32.2	0	0	0	112.8	R732 L854	R732-P734 WeakPolarHBondContact O-CD 3.42Å; P734-L854 HydrophobicContact CB-CD1 4.43Å
735	E	49.5	Very low	76.3	Confident	191 Å²	191	65.7 Å²	65.7	89%	0.893	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.8	-22.2	178.5	-66.5	-170.8	168.7	0	0	113.4	D733	D733-E735 PolarHBondContact O-N 3.22Å
736	I	51.5	Low	76.5	Confident	138 Å²	138	63.7 Å²	63.7	71%	0.708	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99	-30.8	-175.7	-59.9	174.9	0	0	0	110.9	D733	D733-I736 HydrophobicContact CB-CB 4.29Å; D733-I736 HydrophobicContact CB-CD1 3.99Å; D733-I736 HydrophobicContact CB-CG1 4.15Å; D733-I736 PolarHBondContact O-N 3.04Å
737	T	48	Very low	76.6	Confident	66 Å²	66	67.8 Å²	67.8	41%	0.405	35%	0.351	S	S	.	.			trans	-135.1	109.1	-177	36.2	0	0	0	0	109.4	D733 D739	D733-T737 PolarHBondContact O-N 3.37Å; D733-T737 PolarHBondContact O-OG1 2.93Å; T737-D739 PolarHBondContact O-N 3.45Å
738	N	55.7	Low	76.8	Confident	162 Å²	162	63.6 Å²	63.6	87%	0.866	33%	0.331	S	S	*	.			trans	-62.3	69.5	153.5	-88.8	-26.2	0	0	0	107.5	P740	N738-P740 WeakPolarHBondContact O-CD 3.32Å
739	D	68.7	Low	77.2	Confident	28 Å²	28	58.2 Å²	58.2	15%	0.15	31%	0.306	C	S	.	.			trans	-68.5	102.7	-179.2	-169.6	-31	0	0	0	107	R732 T737 I741 L742 S743	R732-D739 WeakPolarHBondContact CD-OD2 3.39Å; R732-D739 IonicContact CZ-OD2 3.9Å; R732-D739 IonicContact NH1-OD2 3Å; R732-D739 PolarHBondContact NH1-OD2 3.42Å; T737-D739 PolarHBondContact O-N 3.45Å; D739-I741 PolarHBondContact O-N 2.96Å; D739-I741 VanDerWaalsContact O-N 3.12Å; D739-I741 WeakPolarHBondContact OD1-CB 2.91Å; D739-I741 PolarHBondContact OD1-N 3.27Å; D739-I741 VanDerWaalsContact OD1-N 3.16Å; D739-L742 HydrophobicContact CB-CB 4.49Å; D739-S743 WeakPolarHBondContact O-CB 3.31Å; D739-S743 PolarHBondContact O-N 2.97Å
740	P	77.9	Confident	77.4	Confident	88 Å²	88	58 Å²	58	57%	0.571	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.2	-20.9	-169.5	28.8	-31.2	0	0	0	110.7	N738 S743 N744	N738-P740 WeakPolarHBondContact O-CD 3.32Å; P740-S743 PolarHBondContact O-OG 3.42Å; P740-N744 PolarHBondContact O-ND2 3.07Å
741	I	85.5	Confident	77.6	Confident	28 Å²	28	58.8 Å²	58.8	14%	0.144	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.4	-54.7	-174.7	-59.5	179.7	0	0	0	109.1	E669 I672 D739 S743 N744	E669-I741 HydrophobicContact CB-CD1 3.95Å; E669-I741 HydrophobicContact CG-CD1 3.39Å; E669-I741 HydrophobicContact CG-CG2 4.43Å; I672-I741 HydrophobicContact CB-CG2 3.93Å; I672-I741 HydrophobicContact CD1-CG2 3.85Å; I672-I741 HydrophobicContact CG1-CG2 4.45Å; I672-I741 HydrophobicContact CG2-CG2 3.93Å; D739-I741 PolarHBondContact O-N 2.96Å; D739-I741 VanDerWaalsContact O-N 3.12Å; D739-I741 WeakPolarHBondContact OD1-CB 2.91Å; D739-I741 PolarHBondContact OD1-N 3.27Å; D739-I741 VanDerWaalsContact OD1-N 3.16Å; I741-S743 PolarHBondContact O-N 2.89Å; I741-N744 PolarHBondContact O-N 2.89Å
742	L	88.7	Confident	78.2	Confident	4 Å²	4	55.2 Å²	55.2	2%	0.021	29%	0.291	C	S	.	.	G	3₁₀ helix	trans	-65	-27.6	-178.8	-159.1	63.3	0	0	0	112.4	L668 I672 M730 D739 N744 A745 L854 Y855 Q858	L668-L742 HydrophobicContact CD2-CD1 4.33Å; I672-L742 HydrophobicContact CD1-CD1 4.33Å; M730-L742 HydrophobicContact SD-CD1 4.45Å; D739-L742 HydrophobicContact CB-CB 4.49Å; L742-N744 PolarHBondContact O-N 3.36Å; L742-N744 VanDerWaalsContact O-N 3.14Å; L742-A745 HydrophobicContact CD1-CB 4.23Å; L742-A745 WeakPolarHBondContact O-CB 3.41Å; L742-A745 PolarHBondContact O-N 3.27Å; L742-A745 VanDerWaalsContact O-N 3.15Å; L742-L854 HydrophobicContact CD2-CD2 3.48Å; L742-L854 VanDerWaalsContact CD2-CD2 3.48Å; L742-L854 HydrophobicContact CG-CD2 3.9Å; L742-Y855 HydrophobicContact CD1-CE1 4.18Å; L742-Y855 HydrophobicContact CG-CE1 4.22Å; L742-Q858 PolarHBondContact O-NE2 3.09Å
743	S	88.5	Confident	79.2	Confident	39 Å²	39	51.9 Å²	51.9	27%	0.273	28%	0.278	S	S	.	.	G	3₁₀ helix	trans	-63.7	-12.6	173.2	83.1	0	0	0	0	114.8	D739 P740 I741 Q858 R861	D739-S743 WeakPolarHBondContact O-CB 3.31Å; D739-S743 PolarHBondContact O-N 2.97Å; P740-S743 PolarHBondContact O-OG 3.42Å; I741-S743 PolarHBondContact O-N 2.89Å; S743-Q858 VanDerWaalsContact C-CD 3.49Å; S743-Q858 WeakPolarHBondContact O-CG 3.36Å; S743-Q858 PolarHBondContact O-OE1 3.12Å; S743-Q858 VanDerWaalsContact O-OE1 3.1Å; S743-R861 PolarHBondContact O-NH2 3.47Å
744	N	90.5	Very high	80.8	Confident	56 Å²	56	47.2 Å²	47.2	30%	0.299	25%	0.253	S	S	.	.	G	3₁₀ helix	trans	-114.1	3.3	178.1	-70.1	-47.4	0	0	0	113	I672 P740 I741 L742 V746 R747 A748 R861	I672-N744 HydrophobicContact CG2-CB 4.5Å; P740-N744 PolarHBondContact O-ND2 3.07Å; I741-N744 PolarHBondContact O-N 2.89Å; L742-N744 PolarHBondContact O-N 3.36Å; L742-N744 VanDerWaalsContact O-N 3.14Å; N744-V746 VanDerWaalsContact C-N 3.34Å; N744-V746 PolarHBondContact O-N 3.36Å; N744-R747 PolarHBondContact O-N 2.92Å; N744-A748 WeakPolarHBondContact O-CB 3.45Å; N744-A748 PolarHBondContact O-N 2.97Å; N744-R861 PolarHBondContact OD1-NH2 3.35Å
745	A	93.2	Very high	82.4	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-57.3	-43.5	-175.7	0	0	0	0	0	113	I672 L742 A748 L749 W849 Y855	I672-A745 HydrophobicContact CD1-CB 3.81Å; I672-A745 HydrophobicContact CG1-CB 4.39Å; L742-A745 HydrophobicContact CD1-CB 4.23Å; L742-A745 WeakPolarHBondContact O-CB 3.41Å; L742-A745 PolarHBondContact O-N 3.27Å; L742-A745 VanDerWaalsContact O-N 3.15Å; A745-A748 WeakPolarHBondContact O-CB 3.26Å; A745-A748 PolarHBondContact O-N 3.43Å; A745-L749 PolarHBondContact O-N 2.88Å; A745-W849 HydrophobicContact CB-CH2 4.11Å; A745-W849 HydrophobicContact CB-CZ2 3.93Å; A745-W849 WeakPolarHBondContact O-CH2 3.39Å; A745-Y855 HydrophobicContact CB-CE1 4.26Å
746	V	94.4	Very high	84	Confident	0 Å²	0	35.1 Å²	35.1	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-65	-50.2	178.6	178.1	0	0	0	0	110.1	N744 A748 L749 L750 W849 Y855 Q858 F859 L862	N744-V746 VanDerWaalsContact C-N 3.34Å; N744-V746 PolarHBondContact O-N 3.36Å; V746-A748 VanDerWaalsContact C-N 3.27Å; V746-A748 PolarHBondContact O-N 3.45Å; V746-L749 PolarHBondContact O-N 2.71Å; V746-L750 HydrophobicContact CG1-CD1 4.24Å; V746-L750 HydrophobicContact CG1-CG 4.27Å; V746-L750 WeakPolarHBondContact O-CG 3.27Å; V746-L750 PolarHBondContact O-N 2.97Å; V746-W849 HydrophobicContact CB-CZ3 4.33Å; V746-W849 HydrophobicContact CG2-CE3 3.83Å; V746-W849 HydrophobicContact CG2-CZ3 3.9Å; V746-Y855 HydrophobicContact CG2-CD1 4.12Å; V746-Q858 HydrophobicContact CB-CB 3.95Å; V746-Q858 HydrophobicContact CG2-CB 3.89Å; V746-F859 HydrophobicContact CG1-CD1 3.92Å; V746-F859 HydrophobicContact CG1-CD2 4.21Å; V746-F859 HydrophobicContact CG1-CE1 3.56Å; V746-F859 HydrophobicContact CG1-CE2 3.87Å; V746-F859 HydrophobicContact CG1-CG 4.23Å; V746-F859 HydrophobicContact CG1-CZ 3.51Å; V746-F859 HydrophobicContact CG2-CD2 4.33Å; V746-F859 HydrophobicContact CG2-CE2 3.95Å; V746-F859 HydrophobicContact CG2-CZ 4.33Å; V746-L862 HydrophobicContact CG1-CD1 3.83Å
747	R	94.6	Very high	85.2	Confident	87 Å²	87	30.7 Å²	30.7	33%	0.328	17%	0.168	S	C	.	.	H	α-helix	trans	-57.5	-41.8	178.5	-175.3	178.6	179.9	101.6	-1	111.5	N744 L750 T751 L862 E865 L877	N744-R747 PolarHBondContact O-N 2.92Å; R747-L750 PolarHBondContact O-N 3.46Å; R747-T751 WeakPolarHBondContact O-CB 3.36Å; R747-T751 PolarHBondContact O-N 3.18Å; R747-T751 PolarHBondContact O-OG1 2.89Å; R747-L862 HydrophobicContact CB-CD2 4.37Å; R747-L862 HydrophobicContact CG-CD2 4.27Å; R747-E865 IonicContact CZ-OE1 2.72Å; R747-E865 VanDerWaalsContact NH1-CD 3.3Å; R747-E865 IonicContact NH1-OE1 2.72Å; R747-E865 PolarHBondContact NH1-OE1 2.85Å; R747-E865 IonicContact NH1-OE2 3.22Å; R747-E865 PolarHBondContact NH1-OE2 2.68Å; R747-E865 IonicContact NH2-OE1 3.89Å; R747-L877 HydrophobicContact CG-CD2 3.88Å
748	A	95.1	Very high	85.9	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-58.6	-52.5	177.1	0	0	0	0	0	111.4	I672 M675 S676 N744 A745 V746 L750 T751 A752	I672-A748 HydrophobicContact CG2-CB 3.98Å; I672-A748 WeakPolarHBondContact O-CB 3.4Å; M675-A748 HydrophobicContact CB-CB 4Å; S676-A748 WeakPolarHBondContact OG-CA 3.38Å; S676-A748 WeakPolarHBondContact OG-CB 3.35Å; N744-A748 WeakPolarHBondContact O-CB 3.45Å; N744-A748 PolarHBondContact O-N 2.97Å; A745-A748 WeakPolarHBondContact O-CB 3.26Å; A745-A748 PolarHBondContact O-N 3.43Å; V746-A748 VanDerWaalsContact C-N 3.27Å; V746-A748 PolarHBondContact O-N 3.45Å; A748-L750 PolarHBondContact O-N 2.85Å; A748-T751 WeakPolarHBondContact O-CB 3.38Å; A748-T751 PolarHBondContact O-N 3.22Å; A748-A752 PolarHBondContact O-N 3.25Å
749	L	95.6	Very high	85.7	Confident	1 Å²	1	26.4 Å²	26.4	1%	0.005	14%	0.143	C	C	.	.	H	α-helix	trans	-60.9	-44.8	-179.2	-169.4	75.3	0	0	0	111.6	M675 A691 L694 A745 V746 T751 A752 F753 M842 C845 L846 W849	M675-L749 HydrophobicContact SD-CD1 4.42Å; A691-L749 HydrophobicContact CB-CD1 3.98Å; L694-L749 HydrophobicContact CD2-CD1 4.23Å; A745-L749 PolarHBondContact O-N 2.88Å; V746-L749 PolarHBondContact O-N 2.71Å; L749-T751 VanDerWaalsContact C-N 3.32Å; L749-T751 PolarHBondContact O-N 3.45Å; L749-A752 PolarHBondContact O-N 3.26Å; L749-F753 PolarHBondContact O-N 3.02Å; L749-M842 HydrophobicContact CD1-CB 3.96Å; L749-M842 HydrophobicContact CD1-CG 3.82Å; L749-M842 HydrophobicContact CD2-CB 4.18Å; L749-M842 HydrophobicContact CG-CB 4.16Å; L749-M842 HydrophobicContact CG-CG 4.35Å; L749-C845 HydrophobicContact CD2-CB 3.87Å; L749-L846 HydrophobicContact CD2-CD1 4.48Å; L749-L846 HydrophobicContact CD2-CD2 3.96Å; L749-L846 HydrophobicContact CD2-CG 3.82Å; L749-W849 HydrophobicContact CB-CH2 3.94Å; L749-W849 HydrophobicContact CB-CZ3 4.02Å; L749-W849 HydrophobicContact CD2-CE3 4.38Å; L749-W849 HydrophobicContact CD2-CH2 3.81Å; L749-W849 HydrophobicContact CD2-CZ3 3.46Å; L749-W849 VanDerWaalsContact CD2-CZ3 3.46Å; L749-W849 HydrophobicContact CG-CH2 4.4Å; L749-W849 HydrophobicContact CG-CZ3 4.36Å
750	L	94.8	Very high	84.3	Confident	1 Å²	1	31.7 Å²	31.7	1%	0.005	18%	0.178	C	C	.	.	H	α-helix	trans	-66.3	-35.9	178.6	-60.3	-166.1	0	0	0	112	V746 R747 A748 A752 F753 V754 L862 L877 F878 F881	V746-L750 HydrophobicContact CG1-CD1 4.24Å; V746-L750 HydrophobicContact CG1-CG 4.27Å; V746-L750 WeakPolarHBondContact O-CG 3.27Å; V746-L750 PolarHBondContact O-N 2.97Å; R747-L750 PolarHBondContact O-N 3.46Å; A748-L750 PolarHBondContact O-N 2.85Å; L750-A752 VanDerWaalsContact C-N 3.35Å; L750-F753 WeakPolarHBondContact O-CB 3.22Å; L750-F753 PolarHBondContact O-N 3Å; L750-V754 WeakPolarHBondContact O-CG2 3.44Å; L750-V754 PolarHBondContact O-N 2.59Å; L750-L862 HydrophobicContact CD1-CD1 3.99Å; L750-L877 HydrophobicContact CB-CD2 4.19Å; L750-L877 HydrophobicContact CB-CG 4.34Å; L750-F878 HydrophobicContact CD1-CD2 3.63Å; L750-F878 HydrophobicContact CD1-CE2 4.08Å; L750-F881 HydrophobicContact CD1-CB 4.43Å; L750-F881 HydrophobicContact CD1-CD1 4.01Å; L750-F881 HydrophobicContact CD1-CG 4.15Å; L750-F881 HydrophobicContact CD2-CD1 3.94Å; L750-F881 HydrophobicContact CD2-CD2 3.64Å; L750-F881 HydrophobicContact CD2-CE1 3.91Å; L750-F881 HydrophobicContact CD2-CE2 3.62Å; L750-F881 HydrophobicContact CD2-CG 3.78Å; L750-F881 HydrophobicContact CD2-CZ 3.75Å; L750-F881 HydrophobicContact CG-CG 4.39Å
751	T	93.9	Very high	82.4	Confident	17 Å²	17	29.2 Å²	29.2	10%	0.104	17%	0.169	C	C	.	.	H	α-helix	trans	-61.2	-45.7	174.6	-57.5	0	0	0	0	110.6	M675 T678 R747 A748 L749 S755 L877	M675-T751 WeakPolarHBondContact O-CG2 3.38Å; T678-T751 HydrophobicContact CG2-CG2 3.87Å; R747-T751 WeakPolarHBondContact O-CB 3.36Å; R747-T751 PolarHBondContact O-N 3.18Å; R747-T751 PolarHBondContact O-OG1 2.89Å; A748-T751 WeakPolarHBondContact O-CB 3.38Å; A748-T751 PolarHBondContact O-N 3.22Å; L749-T751 VanDerWaalsContact C-N 3.32Å; L749-T751 PolarHBondContact O-N 3.45Å; T751-S755 VanDerWaalsContact O-CB 3.26Å; T751-S755 WeakPolarHBondContact O-CB 3.29Å; T751-S755 PolarHBondContact O-N 2.94Å; T751-S755 PolarHBondContact O-OG 3.44Å; T751-L877 WeakPolarHBondContact OG1-CD2 3.44Å
752	A	92.8	Very high	80.1	Confident	0 Å²	0	29.3 Å²	29.3	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-62.6	-43.4	174.8	0	0	0	0	0	111.9	M675 R687 A748 L749 L750 V754 S755 I756 M842	M675-A752 HydrophobicContact CB-CB 4.21Å; M675-A752 HydrophobicContact CG-CB 3.96Å; M675-A752 HydrophobicContact SD-CB 3.89Å; R687-A752 HydrophobicContact CG-CB 4.4Å; A748-A752 PolarHBondContact O-N 3.25Å; L749-A752 PolarHBondContact O-N 3.26Å; L750-A752 VanDerWaalsContact C-N 3.35Å; A752-V754 PolarHBondContact O-N 3.02Å; A752-S755 PolarHBondContact O-N 3.06Å; A752-I756 WeakPolarHBondContact O-CG1 3.37Å; A752-M842 HydrophobicContact CB-CE 3.96Å
753	F	92.8	Very high	77.3	Confident	1 Å²	1	32.4 Å²	32.4	0%	0.004	20%	0.204	C	C	.	.	H	α-helix	trans	-57.3	-47.9	178.6	-170.5	-76.4	0	0	0	112.7	L749 L750 R839 M842 Y843 F881 L884 L885	L749-F753 PolarHBondContact O-N 3.02Å; L750-F753 WeakPolarHBondContact O-CB 3.22Å; L750-F753 PolarHBondContact O-N 3Å; F753-R839 HydrophobicContact CD2-CG 3.92Å; F753-R839 HydrophobicContact CE2-CB 4.11Å; F753-R839 VanDerWaalsContact CE2-CD 3.46Å; F753-R839 HydrophobicContact CE2-CG 3.59Å; F753-R839 VanDerWaalsContact CZ-CD 3.44Å; F753-R839 HydrophobicContact CZ-CG 4.1Å; F753-R839 VanDerWaalsContact CZ-NE 3.25Å; F753-M842 HydrophobicContact CB-SD 3.71Å; F753-M842 HydrophobicContact CD2-CB 4.48Å; F753-M842 HydrophobicContact CD2-SD 3.58Å; F753-M842 VanDerWaalsContact CD2-SD 3.58Å; F753-M842 HydrophobicContact CG-SD 4.07Å; F753-Y843 AromaticContact CE2-CE1 3.98Å; F753-Y843 HydrophobicContact CE2-CE1 3.98Å; F753-F881 HydrophobicContact CB-CD2 4.38Å; F753-F881 AromaticContact CD1-CD2 3.63Å; F753-F881 HydrophobicContact CD1-CD2 3.63Å; F753-F881 HydrophobicContact CD1-CE2 4.04Å; F753-F881 HydrophobicContact CD2-CD2 4.42Å; F753-F881 HydrophobicContact CD2-CE2 4.07Å; F753-F881 AromaticContact CE1-CD2 3.95Å; F753-F881 HydrophobicContact CE1-CD2 3.95Å; F753-F881 HydrophobicContact CE1-CE2 4.11Å; F753-F881 HydrophobicContact CE2-CE2 4.16Å; F753-F881 AromaticContact CG-CD2 3.9Å; F753-F881 HydrophobicContact CG-CD2 3.9Å; F753-F881 HydrophobicContact CG-CE2 4.02Å; F753-F881 HydrophobicContact CZ-CD2 4.48Å; F753-F881 HydrophobicContact CZ-CE2 4.18Å; F753-L884 HydrophobicContact CE1-CB 3.95Å; F753-L885 HydrophobicContact CZ-CD1 4.27Å
754	V	90.6	Very high	74.4	Confident	5 Å²	5	37 Å²	37	3%	0.03	23%	0.23	C	C	.	.	H	α-helix	trans	-70.5	-38.6	-178.6	172	0	0	0	0	111.2	L750 A752 I756 E757 L758 L877 Q880 F881 L884	L750-V754 WeakPolarHBondContact O-CG2 3.44Å; L750-V754 PolarHBondContact O-N 2.59Å; A752-V754 PolarHBondContact O-N 3.02Å; V754-I756 VanDerWaalsContact C-N 3.29Å; V754-I756 PolarHBondContact O-N 3.18Å; V754-E757 PolarHBondContact O-N 2.78Å; V754-L758 HydrophobicContact CG1-CD1 4.06Å; V754-L877 HydrophobicContact CB-CD1 4.15Å; V754-L877 HydrophobicContact CG2-CD1 3.87Å; V754-Q880 HydrophobicContact CG1-CB 3.99Å; V754-Q880 HydrophobicContact CG2-CB 4.07Å; V754-F881 HydrophobicContact CG2-CB 4.01Å; V754-L884 HydrophobicContact CB-CD1 4.32Å; V754-L884 HydrophobicContact CG1-CD1 4.34Å; V754-L884 HydrophobicContact CG2-CD1 4.15Å
755	S	87.2	Confident	71.5	Confident	14 Å²	14	39.5 Å²	39.5	10%	0.098	25%	0.247	C	C	.	.	H	α-helix	trans	-61.3	-31	-175.2	-68.6	0	0	0	0	115.3	R687 T751 A752 E757 L758 S759	R687-S755 PolarHBondContact NH2-OG 3.22Å; T751-S755 VanDerWaalsContact O-CB 3.26Å; T751-S755 WeakPolarHBondContact O-CB 3.29Å; T751-S755 PolarHBondContact O-N 2.94Å; T751-S755 PolarHBondContact O-OG 3.44Å; A752-S755 PolarHBondContact O-N 3.06Å; S755-E757 VanDerWaalsContact C-N 3.27Å; S755-E757 PolarHBondContact O-N 2.94Å; S755-L758 PolarHBondContact O-N 3.33Å; S755-S759 PolarHBondContact O-OG 2.99Å
756	I	84.5	Confident	68.4	Low	2 Å²	2	42.4 Å²	42.4	1%	0.01	28%	0.277	C	S	.	.	H	α-helix	trans	-64.8	-36.6	-178.2	-61.4	157.5	0	0	0	110.7	A688 A752 V754 S759 K835 M842	A688-I756 HydrophobicContact CB-CD1 3.24Å; A688-I756 HydrophobicContact CB-CG1 3.46Å; A688-I756 VanDerWaalsContact CB-CG1 3.46Å; A752-I756 WeakPolarHBondContact O-CG1 3.37Å; V754-I756 VanDerWaalsContact C-N 3.29Å; V754-I756 PolarHBondContact O-N 3.18Å; I756-S759 PolarHBondContact O-OG 3.27Å; I756-S759 VanDerWaalsContact O-OG 3.05Å; I756-K835 HydrophobicContact CG2-CB 4.02Å; I756-M842 HydrophobicContact CD1-CE 3.89Å
757	E	76	Confident	65.4	Low	45 Å²	45	46.2 Å²	46.2	21%	0.21	30%	0.304	C	S	.	.	H	α-helix	trans	-71.8	-33	-176.9	-158.2	77.7	-152.8	0	0	112.2	V754 S755 S759 T762 K835 R839 L884	V754-E757 PolarHBondContact O-N 2.78Å; S755-E757 VanDerWaalsContact C-N 3.27Å; S755-E757 PolarHBondContact O-N 2.94Å; E757-S759 PolarHBondContact O-N 2.84Å; E757-S759 VanDerWaalsContact O-N 3.15Å; E757-T762 PolarHBondContact O-OG1 3.06Å; E757-K835 IonicContact OE1-NZ 2.73Å; E757-K835 PolarHBondContact OE1-NZ 3.14Å; E757-K835 WeakPolarHBondContact OE2-CD 3.32Å; E757-K835 IonicContact OE2-NZ 2.66Å; E757-K835 PolarHBondContact OE2-NZ 3.33Å; E757-R839 IonicContact OE2-CZ 3.19Å; E757-R839 IonicContact OE2-NH1 3.78Å; E757-R839 IonicContact OE2-NH2 2.95Å; E757-R839 PolarHBondContact OE2-NH2 3.34Å; E757-L884 HydrophobicContact CB-CD1 4.09Å; E757-L884 HydrophobicContact CB-CD2 4.18Å; E757-L884 HydrophobicContact CG-CD2 3.73Å
758	L	62.2	Low	62.3	Low	128 Å²	128	44.6 Å²	44.6	67%	0.67	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.4	7.9	-176.5	-66.2	167.4	0	0	0	114	V754 S755	V754-L758 HydrophobicContact CG1-CD1 4.06Å; S755-L758 PolarHBondContact O-N 3.33Å
759	S	53.1	Low	59.2	Low	11 Å²	11	46.3 Å²	46.3	8%	0.077	33%	0.327	C	S	.	.	S	Bend	trans	-82.5	131.1	-176.7	-50.4	0	0	0	0	111.3	P684 S755 I756 E757 G761 T762	P684-S759 WeakPolarHBondContact CG-OG 3.41Å; S755-S759 PolarHBondContact O-OG 2.99Å; I756-S759 PolarHBondContact O-OG 3.27Å; I756-S759 VanDerWaalsContact O-OG 3.05Å; E757-S759 PolarHBondContact O-N 2.84Å; E757-S759 VanDerWaalsContact O-N 3.15Å; S759-G761 PolarHBondContact O-N 3.23Å; S759-G761 VanDerWaalsContact O-N 3.13Å; S759-T762 PolarHBondContact O-N 3.04Å; S759-T762 PolarHBondContact O-OG1 3.27Å; S759-T762 VanDerWaalsContact O-OG1 3.09Å
760	P	38.4	Very low	56.1	Low	138 Å²	138	49.4 Å²	49.4	90%	0.896	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	117.9	179.9	22.2	-29.9	0	0	0	110.9
761	G	38.3	Very low	52.9	Low	36 Å²	36	51.8 Å²	51.8	37%	0.371	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	133	-21.9	-177.5	0	0	0	0	0	114.4	S759 G763	S759-G761 PolarHBondContact O-N 3.23Å; S759-G761 VanDerWaalsContact O-N 3.13Å; G761-G763 VanDerWaalsContact C-N 3.35Å
762	T	37.7	Very low	49.9	Very low	30 Å²	30	52.9 Å²	52.9	18%	0.184	38%	0.379	C	S	.	.	G	3₁₀ helix	trans	-77.1	-22.2	172.3	53.6	0	0	0	0	112.6	E757 S759 V764	E757-T762 PolarHBondContact O-OG1 3.06Å; S759-T762 PolarHBondContact O-N 3.04Å; S759-T762 PolarHBondContact O-OG1 3.27Å; S759-T762 VanDerWaalsContact O-OG1 3.09Å; T762-V764 VanDerWaalsContact C-N 3.31Å; T762-V764 PolarHBondContact O-N 3Å
763	G	29.1	Very low	46.8	Very low	70 Å²	70	56.5 Å²	56.5	72%	0.722	40%	0.399	S	S	*	.	G	3₁₀ helix	trans	-76.3	3.1	-173.1	0	0	0	0	0	117.3	G761	G761-G763 VanDerWaalsContact C-N 3.35Å
764	V	27.6	Very low	43.8	Very low	136 Å²	136	58.7 Å²	58.7	82%	0.824	42%	0.417	S	S	*	.	G	3₁₀ helix	trans	-102.2	-3.4	-178.1	-172.7	0	0	0	0	113.2	T762	T762-V764 VanDerWaalsContact C-N 3.31Å; T762-V764 PolarHBondContact O-N 3Å
765	V	29.8	Very low	40.9	Very low	107 Å²	107	60.7 Å²	60.7	65%	0.648	43%	0.434	S	S	*	.	S	Bend	trans	-97.6	100	162.7	-174.5	0	0	0	0	107.5
766	G	28.9	Very low	38.2	Very low	61 Å²	61	62.1 Å²	62.1	63%	0.629	44%	0.44	S	S	*	.			trans	-54	139.7	-169.2	0	0	0	0	0	114.2	A768	G766-A768 PolarHBondContact O-N 3.18Å
767	S	29.9	Very low	35.5	Very low	80 Å²	80	65.3 Å²	65.3	56%	0.559	47%	0.467	S	S	*	.			trans	40.1	81.2	145.9	-163.7	0	0	0	0	115.3	G769 S770	S767-G769 PolarHBondContact O-N 3.17Å; S767-G769 VanDerWaalsContact O-N 3.15Å; S767-G769 PolarHBondContact OG-N 2.87Å; S767-S770 WeakPolarHBondContact O-CB 3.3Å; S767-S770 PolarHBondContact O-N 3.09Å; S767-S770 PolarHBondContact OG-N 3.25Å
768	A	30.3	Very low	33.2	Very low	54 Å²	54	67 Å²	67	45%	0.446	49%	0.488	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-15.1	152.6	0	0	0	0	0	111.6	G766 S770	G766-A768 PolarHBondContact O-N 3.18Å; A768-S770 VanDerWaalsContact C-N 3.26Å; A768-S770 PolarHBondContact O-N 3.1Å
769	G	29.2	Very low	31.5	Very low	36 Å²	36	65.3 Å²	65.3	37%	0.371	49%	0.487	S	S	.	.	H	α-helix	trans	-67.1	-20.8	166.5	0	0	0	0	0	114.3	S767 D773	S767-G769 PolarHBondContact O-N 3.17Å; S767-G769 VanDerWaalsContact O-N 3.15Å; S767-G769 PolarHBondContact OG-N 2.87Å; G769-D773 PolarHBondContact O-N 3.2Å
770	S	31.1	Very low	30.1	Very low	65 Å²	65	69.4 Å²	69.4	46%	0.455	52%	0.516	S	S	.	.	H	α-helix	trans	-87.1	-19.2	177.7	-170.4	0	0	0	0	113	S767 A768 A774	S767-S770 WeakPolarHBondContact O-CB 3.3Å; S767-S770 PolarHBondContact O-N 3.09Å; S767-S770 PolarHBondContact OG-N 3.25Å; A768-S770 VanDerWaalsContact C-N 3.26Å; A768-S770 PolarHBondContact O-N 3.1Å; S770-A774 WeakPolarHBondContact O-CA 3.35Å; S770-A774 WeakPolarHBondContact O-CB 3.45Å; S770-A774 PolarHBondContact O-N 3.39Å
771	A	28.3	Very low	29.4	Very low	52 Å²	52	67.5 Å²	67.5	43%	0.43	51%	0.506	S	S	.	.	H	α-helix	trans	-74.9	-39.5	177.6	0	0	0	0	0	111.4	A775	A771-A775 WeakPolarHBondContact O-CB 3.34Å; A771-A775 PolarHBondContact O-N 3.14Å
772	A	29.6	Very low	28.8	Very low	40 Å²	40	70.9 Å²	70.9	33%	0.331	52%	0.524	S	S	.	.	H	α-helix	trans	-62.8	-57.7	169.5	0	0	0	0	0	109.6	A774 A775 I776	A772-A774 PolarHBondContact O-N 3.29Å; A772-A775 PolarHBondContact O-N 3.41Å; A772-I776 WeakPolarHBondContact O-CD1 3.43Å; A772-I776 VanDerWaalsContact O-CG1 3.28Å; A772-I776 WeakPolarHBondContact O-CG1 3.25Å; A772-I776 PolarHBondContact O-N 3.4Å
773	D	28.9	Very low	28	Very low	76 Å²	76	76 Å²	76	41%	0.406	56%	0.555	S	S	.	*	H	α-helix	trans	-71.1	-23.4	-174.8	-73.7	-35.8	0	0	0	115.1	G769 A777 R1050	G769-D773 PolarHBondContact O-N 3.2Å; D773-A777 VanDerWaalsContact O-CB 3.32Å; D773-A777 WeakPolarHBondContact O-CB 3.4Å; D773-A777 PolarHBondContact O-N 3.11Å; D773-R1050 IonicContact OD1-CZ 3Å; D773-R1050 IonicContact OD1-NH1 3.67Å; D773-R1050 PolarHBondContact OD1-NH1 2.97Å; D773-R1050 IonicContact OD1-NH2 3.26Å
774	A	28.9	Very low	27.7	Very low	47 Å²	47	77.7 Å²	77.7	39%	0.388	56%	0.556	S	S	.	*	H	α-helix	trans	-84.3	-32.3	172.3	0	0	0	0	0	113.4	S770 A772 I776 A777 A778	S770-A774 WeakPolarHBondContact O-CA 3.35Å; S770-A774 WeakPolarHBondContact O-CB 3.45Å; S770-A774 PolarHBondContact O-N 3.39Å; A772-A774 PolarHBondContact O-N 3.29Å; A774-I776 PolarHBondContact O-N 2.95Å; A774-A777 PolarHBondContact O-N 2.75Å; A774-A778 VanDerWaalsContact O-CB 3.23Å; A774-A778 WeakPolarHBondContact O-CB 3.26Å; A774-A778 PolarHBondContact O-N 2.61Å
775	A	29.5	Very low	27.6	Very low	47 Å²	47	80.3 Å²	80.3	39%	0.388	56%	0.559	S	S	.	*	H	α-helix	trans	-60.9	-25	168.6	0	0	0	0	0	110.9	A771 A772 S779	A771-A775 WeakPolarHBondContact O-CB 3.34Å; A771-A775 PolarHBondContact O-N 3.14Å; A772-A775 PolarHBondContact O-N 3.41Å; A775-S779 PolarHBondContact O-OG 2.86Å
776	I	31.4	Very low	27.2	Very low	43 Å²	43	82.8 Å²	82.8	22%	0.221	57%	0.569	C	S	.	*	H	α-helix	trans	-98.1	-29.7	-178.9	-52.9	138.1	0	0	0	112.8	A772 A774 A778 S779 R1050	A772-I776 WeakPolarHBondContact O-CD1 3.43Å; A772-I776 VanDerWaalsContact O-CG1 3.28Å; A772-I776 WeakPolarHBondContact O-CG1 3.25Å; A772-I776 PolarHBondContact O-N 3.4Å; A774-I776 PolarHBondContact O-N 2.95Å; I776-A778 VanDerWaalsContact C-N 3.27Å; I776-A778 PolarHBondContact O-N 3.5Å; I776-S779 PolarHBondContact O-OG 3.45Å; I776-R1050 HydrophobicContact CB-CG 4.45Å; I776-R1050 VanDerWaalsContact CB-NH1 3.26Å; I776-R1050 VanDerWaalsContact CD1-CD 3.47Å; I776-R1050 HydrophobicContact CG1-CB 4.17Å; I776-R1050 VanDerWaalsContact CG1-CD 3.48Å; I776-R1050 HydrophobicContact CG1-CG 4.24Å; I776-R1050 HydrophobicContact CG2-CB 4.08Å; I776-R1050 HydrophobicContact CG2-CG 3.55Å
777	A	27.4	Very low	27	Very low	70 Å²	70	85 Å²	85	58%	0.579	58%	0.575	S	S	*	*	H	α-helix	trans	-69	-23.4	167.8	0	0	0	0	0	113.3	D773 A774 S780	D773-A777 VanDerWaalsContact O-CB 3.32Å; D773-A777 WeakPolarHBondContact O-CB 3.4Å; D773-A777 PolarHBondContact O-N 3.11Å; A774-A777 PolarHBondContact O-N 2.75Å; A777-S780 PolarHBondContact O-OG 3Å
778	A	27.2	Very low	26.7	Very low	79 Å²	79	86.1 Å²	86.1	65%	0.653	58%	0.583	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88	-4.3	-178	0	0	0	0	0	115	A774 I776	A774-A778 VanDerWaalsContact O-CB 3.23Å; A774-A778 WeakPolarHBondContact O-CB 3.26Å; A774-A778 PolarHBondContact O-N 2.61Å; I776-A778 VanDerWaalsContact C-N 3.27Å; I776-A778 PolarHBondContact O-N 3.5Å
779	S	27	Very low	26.4	Very low	93 Å²	93	88.3 Å²	88.3	65%	0.65	59%	0.594	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.2	2.2	-179.1	43.5	0	0	0	0	114.3	A775 I776	A775-S779 PolarHBondContact O-OG 2.86Å; I776-S779 PolarHBondContact O-OG 3.45Å
780	S	24.3	Very low	26.2	Very low	98 Å²	98	95.6 Å²	95.6	69%	0.685	62%	0.619	S	S	*	*	S	Bend	trans	-113.5	16.7	-175.4	53.1	0	0	0	0	115.7	A777	A777-S780 PolarHBondContact O-OG 3Å
781	S	23.5	Very low	25.7	Very low	97 Å²	97	100.9 Å²	100.9	68%	0.678	64%	0.636	S	S	*	*			trans	-117.6	84.7	172.6	67.7	0	0	0	0	113.1
782	S	25	Very low	26.1	Very low	108 Å²	108	104 Å²	104	76%	0.755	65%	0.652	S	S	*	*			trans	15	122	143.3	59.6	0	0	0	0	120.3
783	T	20.8	Very low	25.9	Very low	136 Å²	136	105.9 Å²	105.9	83%	0.834	68%	0.675	S	S	*	*			trans	-35.7	144.1	138.6	-22.9	0	0	0	0	113.9
784	S	23.4	Very low	25.7	Very low	106 Å²	106	107.2 Å²	107.2	74%	0.741	69%	0.691	S	S	*	*			trans	90.7	104.3	166.6	79	0	0	0	0	118.1
785	Q	26	Very low	25.6	Very low	191 Å²	191	114.6 Å²	114.6	89%	0.893	72%	0.716	S	S	*	*				-176.1	134.4	92	-89.5	-173.1	5.8	0	0	111.6
786	N	21.4	Very low	25.4	Very low	159 Å²	159	119 Å²	119	85%	0.85	73%	0.733	S	S	*	*			trans	-64.7	140.2	165.1	-87.7	-31.9	0	0	0	111
787	S	23.7	Very low	25.1	Very low	109 Å²	109	123.8 Å²	123.8	76%	0.762	76%	0.759	S	S	*	*				155.9	144.5	115.1	55	0	0	0	0	114.7
788	S	24.9	Very low	25	Very low	103 Å²	103	126.4 Å²	126.4	72%	0.72	77%	0.773	S	S	*	*			trans	69.3	100.9	162.4	60.8	0	0	0	0	118.2
789	S	23	Very low	24.8	Very low	99 Å²	99	127.3 Å²	127.3	69%	0.692	78%	0.775	S	S	*	*				72.7	99.5	79.2	72.9	0	0	0	0	115.1
790	H	24.7	Very low	24.7	Very low	190 Å²	190	129.8 Å²	129.8	88%	0.88	78%	0.78	S	S	*	*				-175.2	126.3	127.6	-97.3	-54.4	0	0	0	112.3
791	Q	22	Very low	24.8	Very low	176 Å²	176	131.2 Å²	131.2	82%	0.822	79%	0.791	S	S	*	*			trans	-133	171.3	156.1	-110.1	-162.6	-1.7	0	0	105.3
792	P	35.3	Very low	24.7	Very low	117 Å²	117	135 Å²	135	76%	0.76	80%	0.798	S	S	*	*			cis	-136.4	176.9	-28.9	32.9	-13.6	0	0	0	112.3
793	G	25.3	Very low	24.7	Very low	79 Å²	79	135.2 Å²	135.2	81%	0.814	79%	0.794	S	S	*	*			trans	-153.8	112.9	167.3	0	0	0	0	0	111.8
794	S	24.4	Very low	24.8	Very low	105 Å²	105	136.5 Å²	136.5	73%	0.734	80%	0.796	S	S	*	*			trans	-90.5	149.9	173.3	46.5	0	0	0	0	111.2
795	H	27.5	Very low	24.9	Very low	201 Å²	201	139.7 Å²	139.7	93%	0.931	80%	0.803	S	S	*	*			trans	-144.7	142.4	147.8	-97.9	-71	0	0	0	110.6
796	L	26.1	Very low	24.7	Very low	140 Å²	140	134 Å²	134	73%	0.733	80%	0.795	S	S	*	*			trans	-96	154.7	-164.8	-80.1	138.9	0	0	0	113.7
797	N	23.7	Very low	24.8	Very low	144 Å²	144	133.6 Å²	133.6	77%	0.77	79%	0.793	S	S	*	*			trans	60.9	131	136.3	-68.6	-0.5	0	0	0	122.8
798	S	26.9	Very low	24.7	Very low	125 Å²	125	135.4 Å²	135.4	87%	0.874	79%	0.794	S	S	*	*				-161.8	142.7	104.3	49.2	0	0	0	0	112.4
799	S	22.9	Very low	24.6	Very low	98 Å²	98	136.5 Å²	136.5	69%	0.685	80%	0.802	S	S	*	*			trans	-107.4	155.6	168.7	56.2	0	0	0	0	109.6
800	D	23.7	Very low	24.5	Very low	144 Å²	144	137 Å²	137	77%	0.77	81%	0.806	S	S	*	*			trans	146.4	120.1	133.6	-76	-1.6	0	0	0	112.7
801	S	26.2	Very low	24.4	Very low	129 Å²	129	133.1 Å²	133.1	90%	0.902	80%	0.8	S	S	*	*				171.5	150	104.2	47.1	0	0	0	0	111.9
802	Q	22.5	Very low	24.4	Very low	177 Å²	177	130.7 Å²	130.7	83%	0.827	80%	0.797	S	S	*	*			trans	-126.8	162.4	-172.3	-151.1	-179.4	23.4	0	0	108.4
803	T	24	Very low	23.7	Very low	112 Å²	112	130.2 Å²	130.2	69%	0.687	80%	0.796	S	S	*	*			trans	83.5	121.4	157.9	69.6	0	0	0	0	121
804	D	24.3	Very low	23.5	Very low	163 Å²	163	131.7 Å²	131.7	87%	0.872	79%	0.794	S	S	*	*				-165.4	156.4	105.7	-101.5	-21.5	0	0	0	114.9
805	I	24	Very low	23.4	Very low	173 Å²	173	131.8 Å²	131.8	89%	0.887	80%	0.795	S	S	*	*			trans	-104.5	149.3	-171.1	-69.9	168.3	0	0	0	111.1
806	G	23.4	Very low	23.2	Very low	70 Å²	70	129.7 Å²	129.7	72%	0.722	79%	0.791	S	S	*	*			trans	168.8	96.3	157.5	0	0	0	0	0	120.3
807	N	22.4	Very low	23	Very low	151 Å²	151	131.2 Å²	131.2	81%	0.807	80%	0.799	S	S	*	*			trans	45.8	128.5	137.2	-86.2	-3.7	0	0	0	126.6
808	N	21.2	Very low	23	Very low	148 Å²	148	127.4 Å²	127.4	79%	0.791	80%	0.795	S	S	*	*			trans	46.7	120.9	133	-74.6	-10.7	0	0	0	123
809	S	24.2	Very low	22.6	Very low	125 Å²	125	125 Å²	125	87%	0.874	79%	0.789	S	S	*	*				-176	147.3	115.1	47.6	0	0	0	0	113.6
810	S	20.4	Very low	22.6	Very low	111 Å²	111	128 Å²	128	78%	0.776	80%	0.798	S	S	*	*			trans	-73.8	145.7	176.1	49.6	0	0	0	0	114.4
811	S	22.4	Very low	22.5	Very low	108 Å²	108	126.7 Å²	126.7	76%	0.755	80%	0.8	S	S	*	*			trans	172.7	121.3	130.2	45.5	0	0	0	0	114.3
812	T	21.5	Very low	22.3	Very low	125 Å²	125	124 Å²	124	77%	0.767	79%	0.785	S	S	*	*			trans	49.1	115.3	135.2	53	0	0	0	0	123
813	S	20.3	Very low	22.3	Very low	106 Å²	106	121.5 Å²	121.5	74%	0.741	78%	0.782	S	S	*	*				54.4	111.8	128.7	67.1	0	0	0	0	120.3
814	S	22	Very low	22.2	Very low	111 Å²	111	122.6 Å²	122.6	78%	0.776	78%	0.784	S	S	*	*				-179.5	122.3	120.4	36.3	0	0	0	0	111.7
815	S	21.8	Very low	22.3	Very low	107 Å²	107	120.1 Å²	120.1	75%	0.748	78%	0.775	S	S	*	*			trans	36.4	105.5	141.2	52.3	0	0	0	0	120
816	N	23.8	Very low	22.2	Very low	157 Å²	157	119.6 Å²	119.6	84%	0.84	77%	0.769	S	S	*	*			trans	-162.7	101.7	136.6	-102.3	-12.3	0	0	0	106.8
817	N	22.3	Very low	22.4	Very low	171 Å²	171	122.1 Å²	122.1	91%	0.914	77%	0.77	S	S	*	*				39.1	92.4	91.6	-115.7	13.2	0	0	0	112.6
818	G	22.2	Very low	22.7	Very low	65 Å²	65	118.7 Å²	118.7	67%	0.67	76%	0.763	S	S	*	*			trans	175.8	58.7	-179	0	0	0	0	0	110.6	N820	G818-N820 VanDerWaalsContact C-N 3.31Å; G818-N820 PolarHBondContact O-N 3.03Å
819	G	20.4	Very low	23.1	Very low	74 Å²	74	115 Å²	115	76%	0.763	75%	0.753	S	S	*	*			trans	-67.9	90	169.8	0	0	0	0	0	109.9	S821	G819-S821 PolarHBondContact O-N 3.06Å
820	N	22	Very low	23.9	Very low	161 Å²	161	110.1 Å²	110.1	86%	0.861	72%	0.718	S	S	*	*			trans	-90.5	80.6	162.5	-86.3	4.5	0	0	0	108.7	G818 A822	G818-N820 VanDerWaalsContact C-N 3.31Å; G818-N820 PolarHBondContact O-N 3.03Å; N820-A822 VanDerWaalsContact C-N 3.27Å; N820-A822 PolarHBondContact O-N 3.36Å
821	S	22	Very low	25.2	Very low	117 Å²	117	106.6 Å²	106.6	82%	0.818	70%	0.699	S	S	*	*			trans	-89.5	71.5	153.2	60.7	0	0	0	0	107.9	G819	G819-S821 PolarHBondContact O-N 3.06Å
822	A	21.4	Very low	26.6	Very low	71 Å²	71	104 Å²	104	59%	0.587	67%	0.674	S	S	*	*			trans	-107.7	86.7	158.7	0	0	0	0	0	105.2	N820 D824	N820-A822 VanDerWaalsContact C-N 3.27Å; N820-A822 PolarHBondContact O-N 3.36Å; A822-D824 PolarHBondContact O-N 3.27Å
823	T	23	Very low	28.5	Very low	126 Å²	126	102.2 Å²	102.2	77%	0.773	66%	0.657	S	S	*	*			trans	-63.7	90.9	153.9	43.9	0	0	0	0	105.1	T825	T823-T825 PolarHBondContact O-N 3.29Å; T823-T825 PolarHBondContact O-OG1 3.37Å
824	D	21.1	Very low	30.8	Very low	134 Å²	134	100.3 Å²	100.3	72%	0.717	64%	0.636	S	S	*	*			trans	-60.3	92.1	165.4	-77.8	-26.7	0	0	0	106.4	A822 Q826	A822-D824 PolarHBondContact O-N 3.27Å; D824-Q826 PolarHBondContact O-N 3.22Å
825	T	25.8	Very low	33.5	Very low	111 Å²	111	95.4 Å²	95.4	68%	0.681	60%	0.601	S	S	*	*			trans	-65.4	77.6	159.1	-37.5	0	0	0	0	105.4	T823 T827	T823-T825 PolarHBondContact O-N 3.29Å; T823-T825 PolarHBondContact O-OG1 3.37Å; T825-T827 PolarHBondContact O-N 2.75Å
826	Q	23.8	Very low	36.3	Very low	163 Å²	163	90.3 Å²	90.3	76%	0.762	57%	0.566	S	S	*	*			trans	-58.8	100	157.5	-73.4	-178.4	-3.8	0	0	104.5	D824 A828	D824-Q826 PolarHBondContact O-N 3.22Å; Q826-A828 PolarHBondContact O-N 3.28Å
827	T	27.4	Very low	39.1	Very low	122 Å²	122	86.8 Å²	86.8	75%	0.748	54%	0.544	S	S	*	.			trans	-50.5	93.1	147.7	27	0	0	0	0	104.6	T825 A829	T825-T827 PolarHBondContact O-N 2.75Å; T827-A829 PolarHBondContact O-N 3.18Å
828	A	27	Very low	42.1	Very low	79 Å²	79	80.9 Å²	80.9	65%	0.653	51%	0.509	S	S	*	.			trans	-49.7	117.2	171.6	0	0	0	0	0	104.7	Q826 V830	Q826-A828 PolarHBondContact O-N 3.28Å; A828-V830 PolarHBondContact O-N 3.13Å
829	A	29.9	Very low	45.2	Very low	70 Å²	70	77.8 Å²	77.8	58%	0.579	48%	0.477	S	S	*	.			trans	-54.6	109.1	176.3	0	0	0	0	0	105.8	T827 G831	T827-A829 PolarHBondContact O-N 3.18Å; A829-G831 PolarHBondContact O-N 2.95Å; A829-G831 VanDerWaalsContact O-N 3.15Å
830	V	41.5	Very low	48.4	Very low	23 Å²	23	79.6 Å²	79.6	14%	0.139	46%	0.461	C	S	.	.			trans	-54.4	122.8	-179	167.2	0	0	0	0	106.2	H685 A828 F832 E834 Y838	H685-V830 WeakPolarHBondContact CE1-CG2 3.48Å; A828-V830 PolarHBondContact O-N 3.13Å; V830-F832 PolarHBondContact O-N 3.44Å; V830-E834 WeakPolarHBondContact CA-OE2 3.38Å; V830-E834 HydrophobicContact CG1-CB 3.42Å; V830-E834 VanDerWaalsContact CG1-CB 3.42Å; V830-E834 HydrophobicContact CG1-CG 4.4Å; V830-E834 VanDerWaalsContact CG1-OE2 3.25Å; V830-E834 WeakPolarHBondContact CG1-OE2 3.4Å; V830-Y838 HydrophobicContact CG1-CE2 4.36Å
831	G	47.3	Very low	51.6	Low	37 Å²	37	72.4 Å²	72.4	38%	0.381	42%	0.423	S	S	.	.			trans	-54.6	142.6	-178.1	0	0	0	0	0	108.6	A829 E833 E834	A829-G831 PolarHBondContact O-N 2.95Å; A829-G831 VanDerWaalsContact O-N 3.15Å; G831-E833 PolarHBondContact O-N 3.2Å; G831-E834 PolarHBondContact N-OE2 3.37Å; G831-E834 WeakPolarHBondContact O-CB 3.3Å; G831-E834 PolarHBondContact O-N 3.43Å
832	F	52.5	Low	54.9	Low	53 Å²	53	66.8 Å²	66.8	23%	0.232	38%	0.384	C	S	.	.	T	Hydrogen-bonded Turn	trans	-49.7	-31.5	-178.5	176.1	-92.5	0	0	0	112.7	V830 K835 F836 F891	V830-F832 PolarHBondContact O-N 3.44Å; F832-K835 WeakPolarHBondContact O-CD 3.15Å; F832-K835 VanDerWaalsContact O-CG 3.24Å; F832-K835 WeakPolarHBondContact O-CG 3.28Å; F832-F836 HydrophobicContact CD1-CE2 4.41Å; F832-F836 HydrophobicContact CE1-CE2 4.04Å; F832-F836 HydrophobicContact CE1-CZ 4.24Å; F832-F891 HydrophobicContact CD1-CE1 4.23Å; F832-F891 HydrophobicContact CD1-CE2 4.27Å; F832-F891 AromaticContact CD1-CZ 3.97Å; F832-F891 HydrophobicContact CD1-CZ 3.97Å; F832-F891 AromaticContact CE1-CD1 3.75Å; F832-F891 HydrophobicContact CE1-CD1 3.75Å; F832-F891 AromaticContact CE1-CD2 3.77Å; F832-F891 HydrophobicContact CE1-CD2 3.77Å; F832-F891 AromaticContact CE1-CE1 3.6Å; F832-F891 HydrophobicContact CE1-CE1 3.6Å; F832-F891 AromaticContact CE1-CE2 3.61Å; F832-F891 HydrophobicContact CE1-CE2 3.61Å; F832-F891 AromaticContact CE1-CG 3.84Å; F832-F891 HydrophobicContact CE1-CG 3.84Å; F832-F891 AromaticContact CE1-CZ 3.53Å; F832-F891 HydrophobicContact CE1-CZ 3.53Å; F832-F891 HydrophobicContact CZ-CD1 4.44Å; F832-F891 HydrophobicContact CZ-CD2 4.21Å; F832-F891 HydrophobicContact CZ-CE2 4.43Å; F832-F891 HydrophobicContact CZ-CG 4.22Å
833	E	61.5	Low	58.2	Low	89 Å²	89	63.5 Å²	63.5	42%	0.416	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.1	-26.8	177.7	-65.9	-179.8	179	0	0	114.5	G831 K835 F836	G831-E833 PolarHBondContact O-N 3.2Å; E833-K835 PolarHBondContact O-N 3.15Å; E833-F836 WeakPolarHBondContact O-CD2 3.3Å; E833-F836 PolarHBondContact O-N 3.4Å; E833-F836 VanDerWaalsContact O-N 3.15Å
834	E	69	Low	61.2	Low	65 Å²	65	57.8 Å²	57.8	30%	0.304	32%	0.322	S	S	.	.	H	α-helix	trans	-65.7	-25.5	-177.7	-76	178.5	155.3	0	0	112.2	M410 V830 G831 F836 H837 Y838	M410-E834 HydrophobicContact SD-CG 4.34Å; V830-E834 WeakPolarHBondContact CA-OE2 3.38Å; V830-E834 HydrophobicContact CG1-CB 3.42Å; V830-E834 VanDerWaalsContact CG1-CB 3.42Å; V830-E834 HydrophobicContact CG1-CG 4.4Å; V830-E834 VanDerWaalsContact CG1-OE2 3.25Å; V830-E834 WeakPolarHBondContact CG1-OE2 3.4Å; G831-E834 PolarHBondContact N-OE2 3.37Å; G831-E834 WeakPolarHBondContact O-CB 3.3Å; G831-E834 PolarHBondContact O-N 3.43Å; E834-F836 PolarHBondContact O-N 2.84Å; E834-H837 WeakPolarHBondContact O-CB 3.48Å; E834-H837 PolarHBondContact O-N 2.68Å; E834-Y838 WeakPolarHBondContact O-CD2 3.3Å
835	K	77.5	Confident	64.6	Low	8 Å²	8	51.4 Å²	51.4	4%	0.035	29%	0.288	C	S	.	.	H	α-helix	trans	-58.5	-31.2	175.4	78.9	-169	180	167.5	0	112.9	I756 E757 F832 E833 H837 Y838 R839	I756-K835 HydrophobicContact CG2-CB 4.02Å; E757-K835 IonicContact OE1-NZ 2.73Å; E757-K835 PolarHBondContact OE1-NZ 3.14Å; E757-K835 WeakPolarHBondContact OE2-CD 3.32Å; E757-K835 IonicContact OE2-NZ 2.66Å; E757-K835 PolarHBondContact OE2-NZ 3.33Å; F832-K835 WeakPolarHBondContact O-CD 3.15Å; F832-K835 VanDerWaalsContact O-CG 3.24Å; F832-K835 WeakPolarHBondContact O-CG 3.28Å; E833-K835 PolarHBondContact O-N 3.15Å; K835-H837 VanDerWaalsContact C-N 3.29Å; K835-H837 PolarHBondContact O-N 2.9Å; K835-Y838 PolarHBondContact O-N 3.42Å; K835-R839 WeakPolarHBondContact O-CG 3.43Å; K835-R839 PolarHBondContact O-N 3.3Å; K835-R839 VanDerWaalsContact O-N 3.1Å
836	F	81.3	Confident	67.7	Low	1 Å²	1	46.5 Å²	46.5	0%	0.004	26%	0.258	C	S	.	.	H	α-helix	trans	-71.3	-26.7	179.8	-61.5	-64.1	0	0	0	112.5	F832 E833 E834 Y838 R839 R840 D888 F891 L892 L939	F832-F836 HydrophobicContact CD1-CE2 4.41Å; F832-F836 HydrophobicContact CE1-CE2 4.04Å; F832-F836 HydrophobicContact CE1-CZ 4.24Å; E833-F836 WeakPolarHBondContact O-CD2 3.3Å; E833-F836 PolarHBondContact O-N 3.4Å; E833-F836 VanDerWaalsContact O-N 3.15Å; E834-F836 PolarHBondContact O-N 2.84Å; F836-Y838 VanDerWaalsContact C-N 3.34Å; F836-R839 PolarHBondContact O-N 2.77Å; F836-R840 PolarHBondContact O-N 3.33Å; F836-D888 HydrophobicContact CE1-CB 4.12Å; F836-F891 AromaticContact CE2-CD1 3.74Å; F836-F891 HydrophobicContact CE2-CD1 3.74Å; F836-F891 AromaticContact CE2-CE1 3.66Å; F836-F891 HydrophobicContact CE2-CE1 3.66Å; F836-F891 AromaticContact CZ-CD1 3.58Å; F836-F891 HydrophobicContact CZ-CD1 3.58Å; F836-F891 HydrophobicContact CZ-CE1 4.02Å; F836-L892 HydrophobicContact CD1-CD1 3.88Å; F836-L892 HydrophobicContact CD1-CD2 3.86Å; F836-L892 HydrophobicContact CD1-CG 4.13Å; F836-L892 HydrophobicContact CD2-CD2 3.97Å; F836-L892 HydrophobicContact CE1-CD1 3.73Å; F836-L892 HydrophobicContact CE1-CD2 3.76Å; F836-L892 HydrophobicContact CE1-CG 3.7Å; F836-L892 HydrophobicContact CE2-CD2 3.89Å; F836-L892 HydrophobicContact CG-CD2 3.98Å; F836-L892 HydrophobicContact CZ-CD1 4.46Å; F836-L892 HydrophobicContact CZ-CD2 3.79Å; F836-L892 HydrophobicContact CZ-CG 3.93Å; F836-L939 HydrophobicContact CB-CD1 3.67Å; F836-L939 HydrophobicContact CG-CD1 4.36Å
837	H	81.6	Confident	70.8	Confident	82 Å²	82	40.2 Å²	40.2	38%	0.38	23%	0.227	S	C	.	.	H	α-helix	trans	-63.8	-41.6	171.7	-68.5	-49.9	0	0	0	111.6	M410 E834 K835 R839 P841 H935	M410-H837 VanDerWaalsContact CE-NE2 3.32Å; M410-H837 WeakPolarHBondContact CE-NE2 3.12Å; E834-H837 WeakPolarHBondContact O-CB 3.48Å; E834-H837 PolarHBondContact O-N 2.68Å; K835-H837 VanDerWaalsContact C-N 3.29Å; K835-H837 PolarHBondContact O-N 2.9Å; H837-R839 VanDerWaalsContact C-N 3.35Å; H837-P841 VanDerWaalsContact O-CD 3.32Å; H837-P841 WeakPolarHBondContact O-CD 3.21Å; H837-H935 AromaticContact CE1-CE1 3.62Å; H837-H935 AromaticContact CE1-NE2 3.63Å; H837-H935 AromaticContact ND1-CE1 3.87Å
838	Y	86.1	Confident	73.7	Confident	48 Å²	48	35.3 Å²	35.3	19%	0.188	20%	0.195	C	C	.	.	H	α-helix	trans	-69.8	-30	175.5	-63.4	-69.1	0	0	0	113.3	A688 R689 V830 E834 K835 F836 P841	A688-Y838 HydrophobicContact CB-CD1 3.94Å; A688-Y838 HydrophobicContact CB-CG 4.05Å; R689-Y838 HydrophobicContact CG-CD1 3.78Å; R689-Y838 HydrophobicContact CG-CE1 3.44Å; R689-Y838 VanDerWaalsContact CG-CE1 3.44Å; V830-Y838 HydrophobicContact CG1-CE2 4.36Å; E834-Y838 WeakPolarHBondContact O-CD2 3.3Å; K835-Y838 PolarHBondContact O-N 3.42Å; F836-Y838 VanDerWaalsContact C-N 3.34Å; Y838-P841 WeakPolarHBondContact O-CD 3.18Å
839	R	87.8	Confident	76.7	Confident	0 Å²	0	31.6 Å²	31.6	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-77.8	-28.1	178.9	-72.2	178.8	173.3	151.1	4.3	113.6	F753 E757 K835 F836 H837 M842 Y843 D888	F753-R839 HydrophobicContact CD2-CG 3.92Å; F753-R839 HydrophobicContact CE2-CB 4.11Å; F753-R839 VanDerWaalsContact CE2-CD 3.46Å; F753-R839 HydrophobicContact CE2-CG 3.59Å; F753-R839 VanDerWaalsContact CZ-CD 3.44Å; F753-R839 HydrophobicContact CZ-CG 4.1Å; F753-R839 VanDerWaalsContact CZ-NE 3.25Å; E757-R839 IonicContact OE2-CZ 3.19Å; E757-R839 IonicContact OE2-NH1 3.78Å; E757-R839 IonicContact OE2-NH2 2.95Å; E757-R839 PolarHBondContact OE2-NH2 3.34Å; K835-R839 WeakPolarHBondContact O-CG 3.43Å; K835-R839 PolarHBondContact O-N 3.3Å; K835-R839 VanDerWaalsContact O-N 3.1Å; F836-R839 PolarHBondContact O-N 2.77Å; H837-R839 VanDerWaalsContact C-N 3.35Å; R839-M842 WeakPolarHBondContact O-CA 3.3Å; R839-M842 VanDerWaalsContact O-CB 3.24Å; R839-M842 WeakPolarHBondContact O-CB 3.49Å; R839-M842 PolarHBondContact O-N 3.37Å; R839-Y843 HydrophobicContact CB-CE2 4.11Å; R839-Y843 PolarHBondContact O-N 3.07Å; R839-D888 VanDerWaalsContact CD-OD2 3.29Å; R839-D888 WeakPolarHBondContact CD-OD2 3.07Å; R839-D888 IonicContact CZ-OD1 3.93Å; R839-D888 IonicContact CZ-OD2 2.86Å; R839-D888 IonicContact NE-OD2 3Å; R839-D888 PolarHBondContact NE-OD2 3.38Å; R839-D888 IonicContact NH1-OD1 2.62Å; R839-D888 PolarHBondContact NH1-OD1 2.85Å; R839-D888 IonicContact NH1-OD2 2.79Å; R839-D888 PolarHBondContact NH1-OD2 3.45Å
840	R	86.6	Confident	79.4	Confident	111 Å²	111	32.3 Å²	32.3	42%	0.419	15%	0.152	S	C	.	.	H	α-helix	trans	-51.6	-52.1	-178.6	175.7	-169.9	168.2	-113.5	-7.6	113.2	F836 M842 Y843 A844 L939	F836-R840 PolarHBondContact O-N 3.33Å; R840-M842 PolarHBondContact O-N 3.26Å; R840-Y843 PolarHBondContact O-N 3.1Å; R840-Y843 VanDerWaalsContact O-N 3.16Å; R840-A844 PolarHBondContact O-N 3.03Å; R840-L939 HydrophobicContact CB-CD2 4.09Å; R840-L939 HydrophobicContact CG-CD2 4.46Å
841	P	88.7	Confident	81.5	Confident	10 Å²	10	33.7 Å²	33.7	7%	0.065	17%	0.171	C	C	.	.	H	α-helix	trans	-60.3	-29.1	177	-21.5	31.6	0	0	0	113.7	A691 E692 E695 H837 Y838 A844 C845	A691-P841 HydrophobicContact CB-CB 4.22Å; E692-P841 HydrophobicContact CB-CG 4.49Å; E692-P841 HydrophobicContact CG-CB 4.42Å; E692-P841 HydrophobicContact CG-CG 3.74Å; E695-P841 HydrophobicContact CB-CB 3.89Å; E695-P841 HydrophobicContact CG-CB 4.21Å; H837-P841 VanDerWaalsContact O-CD 3.32Å; H837-P841 WeakPolarHBondContact O-CD 3.21Å; Y838-P841 WeakPolarHBondContact O-CD 3.18Å; P841-A844 WeakPolarHBondContact O-CB 3.39Å; P841-A844 PolarHBondContact O-N 3.07Å; P841-C845 PolarHBondContact O-N 3.47Å; P841-C845 PolarHBondContact O-SG 3.22Å; P841-C845 VanDerWaalsContact O-SG 3.34Å
842	M	92.1	Very high	83.5	Confident	0 Å²	0	34.3 Å²	34.3	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-68	-39.6	178.1	-50.9	-178.1	175.8	0	0	111.2	A688 A691 L749 A752 F753 I756 R839 R840 A844 C845 L846	A688-M842 HydrophobicContact CB-CE 4.08Å; A691-M842 HydrophobicContact CB-CE 3.92Å; A691-M842 HydrophobicContact CB-CG 3.58Å; L749-M842 HydrophobicContact CD1-CB 3.96Å; L749-M842 HydrophobicContact CD1-CG 3.82Å; L749-M842 HydrophobicContact CD2-CB 4.18Å; L749-M842 HydrophobicContact CG-CB 4.16Å; L749-M842 HydrophobicContact CG-CG 4.35Å; A752-M842 HydrophobicContact CB-CE 3.96Å; F753-M842 HydrophobicContact CB-SD 3.71Å; F753-M842 HydrophobicContact CD2-CB 4.48Å; F753-M842 HydrophobicContact CD2-SD 3.58Å; F753-M842 VanDerWaalsContact CD2-SD 3.58Å; F753-M842 HydrophobicContact CG-SD 4.07Å; I756-M842 HydrophobicContact CD1-CE 3.89Å; R839-M842 WeakPolarHBondContact O-CA 3.3Å; R839-M842 VanDerWaalsContact O-CB 3.24Å; R839-M842 WeakPolarHBondContact O-CB 3.49Å; R839-M842 PolarHBondContact O-N 3.37Å; R840-M842 PolarHBondContact O-N 3.26Å; M842-A844 VanDerWaalsContact C-N 3.29Å; M842-A844 PolarHBondContact O-N 2.91Å; M842-C845 PolarHBondContact O-N 3.28Å; M842-L846 VanDerWaalsContact O-CG 3.31Å; M842-L846 WeakPolarHBondContact O-CG 3.05Å; M842-L846 PolarHBondContact O-N 2.93Å
843	Y	90	Very high	85.1	Confident	1 Å²	1	36.7 Å²	36.7	0%	0.004	18%	0.184	C	C	.	.	H	α-helix	trans	-63.7	-34.5	175.7	-62.7	-42.4	0	0	0	112.8	F753 R839 R840 L846 R847 L885 D942 T943 T946	F753-Y843 AromaticContact CE2-CE1 3.98Å; F753-Y843 HydrophobicContact CE2-CE1 3.98Å; R839-Y843 HydrophobicContact CB-CE2 4.11Å; R839-Y843 PolarHBondContact O-N 3.07Å; R840-Y843 PolarHBondContact O-N 3.1Å; R840-Y843 VanDerWaalsContact O-N 3.16Å; Y843-L846 HydrophobicContact CD1-CD1 4.33Å; Y843-L846 PolarHBondContact O-N 3.44Å; Y843-R847 WeakPolarHBondContact O-CB 3.3Å; Y843-R847 PolarHBondContact O-N 3.05Å; Y843-L885 HydrophobicContact CE1-CD1 3.79Å; Y843-D942 HydrophobicContact CD2-CB 4.2Å; Y843-D942 HydrophobicContact CG-CB 4.43Å; Y843-T943 PolarHBondContact OH-OG1 3.32Å; Y843-T946 HydrophobicContact CD1-CG2 4.1Å; Y843-T946 HydrophobicContact CE1-CG2 4.42Å
844	A	87.6	Confident	86.3	Confident	7 Å²	7	35 Å²	35	6%	0.058	18%	0.178	C	C	.	.	H	α-helix	trans	-62.6	-45.9	173.6	0	0	0	0	0	111.6	E695 D702 R840 P841 M842 R847 Y848	E695-A844 HydrophobicContact CG-CB 3.6Å; D702-A844 WeakPolarHBondContact OD1-CB 3.26Å; D702-A844 WeakPolarHBondContact OD2-CB 3.41Å; R840-A844 PolarHBondContact O-N 3.03Å; P841-A844 WeakPolarHBondContact O-CB 3.39Å; P841-A844 PolarHBondContact O-N 3.07Å; M842-A844 VanDerWaalsContact C-N 3.29Å; M842-A844 PolarHBondContact O-N 2.91Å; A844-R847 WeakPolarHBondContact O-CB 3.48Å; A844-R847 PolarHBondContact O-N 3.46Å; A844-Y848 PolarHBondContact O-N 3Å; A844-Y848 VanDerWaalsContact O-N 3.11Å
845	C	91.8	Very high	87.3	Confident	0 Å²	0	32 Å²	32	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-61.1	-48.1	176.2	-62.3	0	0	0	0	111.6	L749 P841 M842 R847 Y848 W849	L749-C845 HydrophobicContact CD2-CB 3.87Å; P841-C845 PolarHBondContact O-N 3.47Å; P841-C845 PolarHBondContact O-SG 3.22Å; P841-C845 VanDerWaalsContact O-SG 3.34Å; M842-C845 PolarHBondContact O-N 3.28Å; C845-R847 VanDerWaalsContact C-N 3.26Å; C845-R847 PolarHBondContact O-N 2.84Å; C845-Y848 PolarHBondContact O-N 3.32Å; C845-Y848 VanDerWaalsContact O-N 3.16Å; C845-W849 HydrophobicContact CB-CH2 4.31Å; C845-W849 HydrophobicContact CB-CZ2 4.28Å; C845-W849 HydrophobicContact CB-CZ3 4.49Å; C845-W849 VanDerWaalsContact O-CG 3.29Å; C845-W849 PolarHBondContact O-N 3.16Å
846	L	91.6	Very high	87.9	Confident	8 Å²	8	33 Å²	33	4%	0.042	17%	0.169	C	C	.	.	H	α-helix	trans	-61.6	-34.7	179.1	-68.7	170.7	0	0	0	112.5	L749 M842 Y843 W849 Y850 F859 F881 T946	L749-L846 HydrophobicContact CD2-CD1 4.48Å; L749-L846 HydrophobicContact CD2-CD2 3.96Å; L749-L846 HydrophobicContact CD2-CG 3.82Å; M842-L846 VanDerWaalsContact O-CG 3.31Å; M842-L846 WeakPolarHBondContact O-CG 3.05Å; M842-L846 PolarHBondContact O-N 2.93Å; Y843-L846 HydrophobicContact CD1-CD1 4.33Å; Y843-L846 PolarHBondContact O-N 3.44Å; L846-W849 HydrophobicContact CD2-CE3 4.15Å; L846-W849 HydrophobicContact CD2-CZ3 4.33Å; L846-Y850 PolarHBondContact O-N 3.1Å; L846-F859 HydrophobicContact CD2-CE1 4.42Å; L846-F859 HydrophobicContact CD2-CZ 3.66Å; L846-F881 HydrophobicContact CD1-CZ 4.27Å; L846-T946 HydrophobicContact CB-CG2 4.15Å; L846-T946 HydrophobicContact CD1-CG2 3.52Å; L846-T946 HydrophobicContact CG-CG2 4.42Å
847	R	88.4	Confident	88.3	Confident	30 Å²	30	37.6 Å²	37.6	11%	0.113	20%	0.197	C	C	.	.	H	α-helix	trans	-64.4	-46.8	174.1	178.2	-173.8	-55.5	-168.4	-1.4	111.6	D702 Y843 A844 C845 W849 Y850 D942	D702-R847 IonicContact OD1-CZ 3.69Å; D702-R847 IonicContact OD1-NE 3.3Å; D702-R847 IonicContact OD1-NH1 3.75Å; Y843-R847 WeakPolarHBondContact O-CB 3.3Å; Y843-R847 PolarHBondContact O-N 3.05Å; A844-R847 WeakPolarHBondContact O-CB 3.48Å; A844-R847 PolarHBondContact O-N 3.46Å; C845-R847 VanDerWaalsContact C-N 3.26Å; C845-R847 PolarHBondContact O-N 2.84Å; R847-W849 VanDerWaalsContact C-N 3.35Å; R847-Y850 PolarHBondContact O-N 3.03Å; R847-D942 IonicContact CZ-OD1 3.44Å; R847-D942 IonicContact NH2-OD1 2.97Å; R847-D942 PolarHBondContact NH2-OD1 3.25Å; R847-D942 IonicContact NH2-OD2 2.97Å
848	Y	88.2	Confident	88.9	Confident	19 Å²	19	34 Å²	34	8%	0.075	18%	0.181	C	C	.	.	H	α-helix	trans	-65.6	-37.4	-179.3	171.8	-104.4	0	0	0	112.9	V698 P699 Q700 M730 A844 C845 Y850 K852	V698-Y848 VanDerWaalsContact CG1-CB 3.49Å; V698-Y848 HydrophobicContact CG1-CD1 3.73Å; V698-Y848 HydrophobicContact CG1-CD2 3.66Å; V698-Y848 HydrophobicContact CG1-CE1 4.39Å; V698-Y848 HydrophobicContact CG1-CE2 4.3Å; V698-Y848 HydrophobicContact CG1-CG 3.33Å; V698-Y848 HydrophobicContact CG2-CD1 4.12Å; V698-Y848 HydrophobicContact CG2-CG 4.48Å; P699-Y848 HydrophobicContact CG-CD2 4.5Å; P699-Y848 HydrophobicContact CG-CE2 3.53Å; P699-Y848 WeakPolarHBondContact CG-OH 3.29Å; Q700-Y848 HydrophobicContact CB-CD2 4.29Å; M730-Y848 HydrophobicContact CB-CE1 4.12Å; M730-Y848 HydrophobicContact CG-CE1 4.38Å; A844-Y848 PolarHBondContact O-N 3Å; A844-Y848 VanDerWaalsContact O-N 3.11Å; C845-Y848 PolarHBondContact O-N 3.32Å; C845-Y848 VanDerWaalsContact O-N 3.16Å; Y848-Y850 VanDerWaalsContact C-N 3.31Å; Y848-Y850 PolarHBondContact O-N 3.01Å; Y848-K852 HydrophobicContact CE1-CD 4.18Å; Y848-K852 PolarHBondContact OH-NZ 2.72Å
849	W	89.2	Confident	89.2	Confident	2 Å²	2	32 Å²	32	1%	0.008	17%	0.173	C	C	.	.	H	α-helix	trans	-72.7	-22.9	-178.9	-66.6	-22.5	0	0	0	114.2	L694 A745 V746 L749 C845 L846 R847 G851 K852 Y855	L694-W849 HydrophobicContact CD2-CH2 4.01Å; L694-W849 HydrophobicContact CD2-CZ2 3.92Å; A745-W849 HydrophobicContact CB-CH2 4.11Å; A745-W849 HydrophobicContact CB-CZ2 3.93Å; A745-W849 WeakPolarHBondContact O-CH2 3.39Å; V746-W849 HydrophobicContact CB-CZ3 4.33Å; V746-W849 HydrophobicContact CG2-CE3 3.83Å; V746-W849 HydrophobicContact CG2-CZ3 3.9Å; L749-W849 HydrophobicContact CB-CH2 3.94Å; L749-W849 HydrophobicContact CB-CZ3 4.02Å; L749-W849 HydrophobicContact CD2-CE3 4.38Å; L749-W849 HydrophobicContact CD2-CH2 3.81Å; L749-W849 HydrophobicContact CD2-CZ3 3.46Å; L749-W849 VanDerWaalsContact CD2-CZ3 3.46Å; L749-W849 HydrophobicContact CG-CH2 4.4Å; L749-W849 HydrophobicContact CG-CZ3 4.36Å; C845-W849 HydrophobicContact CB-CH2 4.31Å; C845-W849 HydrophobicContact CB-CZ2 4.28Å; C845-W849 HydrophobicContact CB-CZ3 4.49Å; C845-W849 VanDerWaalsContact O-CG 3.29Å; C845-W849 PolarHBondContact O-N 3.16Å; L846-W849 HydrophobicContact CD2-CE3 4.15Å; L846-W849 HydrophobicContact CD2-CZ3 4.33Å; R847-W849 VanDerWaalsContact C-N 3.35Å; W849-G851 PolarHBondContact O-N 3.49Å; W849-K852 WeakPolarHBondContact O-CB 3.49Å; W849-K852 PolarHBondContact O-N 3.13Å; W849-K852 VanDerWaalsContact O-N 3.14Å; W849-Y855 HydrophobicContact CB-CD1 4.41Å; W849-Y855 HydrophobicContact CB-CD2 3.93Å; W849-Y855 HydrophobicContact CB-CG 3.78Å; W849-Y855 AromaticContact CD1-CD1 3.73Å; W849-Y855 AromaticContact CD1-CD2 3.53Å; W849-Y855 AromaticContact CD1-CE1 3.62Å; W849-Y855 AromaticContact CD1-CE2 3.44Å; W849-Y855 VanDerWaalsContact CD1-CE2 3.44Å; W849-Y855 AromaticContact CD1-CG 3.68Å; W849-Y855 AromaticContact CD1-CZ 3.47Å; W849-Y855 VanDerWaalsContact CD1-CZ 3.47Å; W849-Y855 AromaticContact CD2-CD1 3.95Å; W849-Y855 HydrophobicContact CD2-CD1 3.95Å; W849-Y855 HydrophobicContact CD2-CE1 4.26Å; W849-Y855 HydrophobicContact CD2-CG 4.22Å; W849-Y855 AromaticContact CE2-CD1 3.98Å; W849-Y855 AromaticContact CE2-CE1 3.83Å; W849-Y855 AromaticContact CG-CD1 3.81Å; W849-Y855 HydrophobicContact CG-CD1 3.81Å; W849-Y855 AromaticContact CG-CD2 3.84Å; W849-Y855 HydrophobicContact CG-CD2 3.84Å; W849-Y855 HydrophobicContact CG-CE1 4.16Å; W849-Y855 HydrophobicContact CG-CE2 4.21Å; W849-Y855 AromaticContact CG-CG 3.63Å; W849-Y855 HydrophobicContact CG-CG 3.63Å; W849-Y855 HydrophobicContact CZ2-CE1 4.43Å; W849-Y855 AromaticContact NE1-CD1 3.85Å; W849-Y855 AromaticContact NE1-CE1 3.42Å; W849-Y855 AromaticContact NE1-CE2 3.96Å; W849-Y855 AromaticContact NE1-CZ 3.48Å
850	Y	87.8	Confident	89.4	Confident	84 Å²	84	37.3 Å²	37.3	33%	0.329	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.8	126.6	-177.5	175.2	-101.5	0	0	0	112.2	L846 R847 Y848 K852 R949 T952 L953	L846-Y850 PolarHBondContact O-N 3.1Å; R847-Y850 PolarHBondContact O-N 3.03Å; Y848-Y850 VanDerWaalsContact C-N 3.31Å; Y848-Y850 PolarHBondContact O-N 3.01Å; Y850-K852 VanDerWaalsContact C-N 3.33Å; Y850-R949 HydrophobicContact CD1-CG 4.03Å; Y850-R949 HydrophobicContact CD2-CB 3.41Å; Y850-R949 VanDerWaalsContact CD2-CB 3.41Å; Y850-R949 HydrophobicContact CD2-CG 3.52Å; Y850-R949 HydrophobicContact CE1-CG 4.38Å; Y850-R949 HydrophobicContact CE2-CB 3.83Å; Y850-R949 HydrophobicContact CE2-CG 3.89Å; Y850-R949 HydrophobicContact CG-CB 3.93Å; Y850-R949 HydrophobicContact CG-CG 3.57Å; Y850-T952 HydrophobicContact CE2-CG2 4.4Å; Y850-L953 HydrophobicContact CD2-CD1 4.37Å
851	G	85.2	Confident	89.7	Confident	53 Å²	53	37.1 Å²	37.1	55%	0.546	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	83.3	7.3	179.7	0	0	0	0	0	114	W849	W849-G851 PolarHBondContact O-N 3.49Å
852	K	88.3	Confident	89.9	Confident	50 Å²	50	36.9 Å²	36.9	22%	0.217	19%	0.193	C	C	.	.			trans	-100.1	120.8	173	-75.6	178.1	177.6	-87.1	0	109.8	N731 Y848 W849 Y850 L854 Y855 D856	N731-K852 PolarHBondContact OD1-NZ 3.33Å; Y848-K852 HydrophobicContact CE1-CD 4.18Å; Y848-K852 PolarHBondContact OH-NZ 2.72Å; W849-K852 WeakPolarHBondContact O-CB 3.49Å; W849-K852 PolarHBondContact O-N 3.13Å; W849-K852 VanDerWaalsContact O-N 3.14Å; Y850-K852 VanDerWaalsContact C-N 3.33Å; K852-L854 VanDerWaalsContact C-N 3.27Å; K852-L854 PolarHBondContact O-N 3.42Å; K852-L854 VanDerWaalsContact O-N 3.09Å; K852-Y855 HydrophobicContact CB-CD2 3.72Å; K852-Y855 HydrophobicContact CB-CE2 4.28Å; K852-Y855 HydrophobicContact CD-CD2 4.15Å; K852-Y855 HydrophobicContact CD-CE2 3.97Å; K852-Y855 PolarHBondContact O-N 2.86Å; K852-D856 PolarHBondContact O-N 3.37Å; K852-D856 VanDerWaalsContact O-N 3.11Å
853	P	87.4	Confident	89.9	Confident	102 Å²	102	37.3 Å²	37.3	66%	0.662	20%	0.196	S	C	*	.	H	α-helix	trans	-53.7	-38.1	-173.2	-29.1	34.3	0	0	0	115.1	Y855 D856 V857	P853-Y855 VanDerWaalsContact C-N 3.28Å; P853-Y855 PolarHBondContact O-N 2.8Å; P853-D856 PolarHBondContact O-N 3.49Å; P853-V857 WeakPolarHBondContact O-CG2 3.3Å; P853-V857 PolarHBondContact O-N 3.46Å; P853-V857 VanDerWaalsContact O-N 3.15Å
854	L	86.8	Confident	90.1	Very high	54 Å²	54	42 Å²	42	28%	0.283	22%	0.22	S	C	.	.	H	α-helix	trans	-58.9	-38	-178.9	179.5	64.6	0	0	0	112.9	P734 L742 K852 Q858	P734-L854 HydrophobicContact CB-CD1 4.43Å; L742-L854 HydrophobicContact CD2-CD2 3.48Å; L742-L854 VanDerWaalsContact CD2-CD2 3.48Å; L742-L854 HydrophobicContact CG-CD2 3.9Å; K852-L854 VanDerWaalsContact C-N 3.27Å; K852-L854 PolarHBondContact O-N 3.42Å; K852-L854 VanDerWaalsContact O-N 3.09Å; L854-Q858 PolarHBondContact O-NE2 2.76Å
855	Y	90.4	Very high	90.3	Very high	2 Å²	2	44.9 Å²	44.9	1%	0.008	23%	0.233	C	C	.	.	H	α-helix	trans	-91.7	-34	-177.1	-54.5	-75.6	0	0	0	111.2	M730 L742 A745 V746 W849 K852 P853 V857 Q858 F859	M730-Y855 PolarHBondContact O-OH 3.17Å; L742-Y855 HydrophobicContact CD1-CE1 4.18Å; L742-Y855 HydrophobicContact CG-CE1 4.22Å; A745-Y855 HydrophobicContact CB-CE1 4.26Å; V746-Y855 HydrophobicContact CG2-CD1 4.12Å; W849-Y855 HydrophobicContact CB-CD1 4.41Å; W849-Y855 HydrophobicContact CB-CD2 3.93Å; W849-Y855 HydrophobicContact CB-CG 3.78Å; W849-Y855 AromaticContact CD1-CD1 3.73Å; W849-Y855 AromaticContact CD1-CD2 3.53Å; W849-Y855 AromaticContact CD1-CE1 3.62Å; W849-Y855 AromaticContact CD1-CE2 3.44Å; W849-Y855 VanDerWaalsContact CD1-CE2 3.44Å; W849-Y855 AromaticContact CD1-CG 3.68Å; W849-Y855 AromaticContact CD1-CZ 3.47Å; W849-Y855 VanDerWaalsContact CD1-CZ 3.47Å; W849-Y855 AromaticContact CD2-CD1 3.95Å; W849-Y855 HydrophobicContact CD2-CD1 3.95Å; W849-Y855 HydrophobicContact CD2-CE1 4.26Å; W849-Y855 HydrophobicContact CD2-CG 4.22Å; W849-Y855 AromaticContact CE2-CD1 3.98Å; W849-Y855 AromaticContact CE2-CE1 3.83Å; W849-Y855 AromaticContact CG-CD1 3.81Å; W849-Y855 HydrophobicContact CG-CD1 3.81Å; W849-Y855 AromaticContact CG-CD2 3.84Å; W849-Y855 HydrophobicContact CG-CD2 3.84Å; W849-Y855 HydrophobicContact CG-CE1 4.16Å; W849-Y855 HydrophobicContact CG-CE2 4.21Å; W849-Y855 AromaticContact CG-CG 3.63Å; W849-Y855 HydrophobicContact CG-CG 3.63Å; W849-Y855 HydrophobicContact CZ2-CE1 4.43Å; W849-Y855 AromaticContact NE1-CD1 3.85Å; W849-Y855 AromaticContact NE1-CE1 3.42Å; W849-Y855 AromaticContact NE1-CE2 3.96Å; W849-Y855 AromaticContact NE1-CZ 3.48Å; K852-Y855 HydrophobicContact CB-CD2 3.72Å; K852-Y855 HydrophobicContact CB-CE2 4.28Å; K852-Y855 HydrophobicContact CD-CD2 4.15Å; K852-Y855 HydrophobicContact CD-CE2 3.97Å; K852-Y855 PolarHBondContact O-N 2.86Å; P853-Y855 VanDerWaalsContact C-N 3.28Å; P853-Y855 PolarHBondContact O-N 2.8Å; Y855-V857 VanDerWaalsContact C-N 3.26Å; Y855-V857 PolarHBondContact O-N 2.96Å; Y855-Q858 WeakPolarHBondContact O-CA 3.32Å; Y855-Q858 WeakPolarHBondContact O-CB 3.28Å; Y855-Q858 PolarHBondContact O-N 2.99Å; Y855-F859 WeakPolarHBondContact O-CD2 3.47Å; Y855-F859 PolarHBondContact O-N 3.2Å; Y855-F859 VanDerWaalsContact O-N 3.11Å
856	D	89.7	Confident	90.2	Very high	28 Å²	28	44.9 Å²	44.9	15%	0.15	23%	0.233	C	C	.	.	H	α-helix	trans	-57.6	-39.4	174.8	-66.5	-13	0	0	0	111.7	K852 P853 Q858 F859 K860 L953	K852-D856 PolarHBondContact O-N 3.37Å; K852-D856 VanDerWaalsContact O-N 3.11Å; P853-D856 PolarHBondContact O-N 3.49Å; D856-Q858 VanDerWaalsContact C-N 3.31Å; D856-Q858 PolarHBondContact O-N 3.34Å; D856-F859 PolarHBondContact O-N 3.12Å; D856-K860 PolarHBondContact O-N 2.92Å; D856-K860 VanDerWaalsContact O-N 3.12Å; D856-L953 HydrophobicContact CB-CD2 3.98Å; D856-L953 VanDerWaalsContact OD1-CD1 3.32Å; D856-L953 WeakPolarHBondContact OD1-CD1 3.2Å
857	V	90.2	Very high	90.1	Very high	99 Å²	99	47 Å²	47	60%	0.6	24%	0.244	S	C	*	.	H	α-helix	trans	-63.1	-36.6	174.4	170.9	0	0	0	0	111.8	P853 Y855 K860 R861	P853-V857 WeakPolarHBondContact O-CG2 3.3Å; P853-V857 PolarHBondContact O-N 3.46Å; P853-V857 VanDerWaalsContact O-N 3.15Å; Y855-V857 VanDerWaalsContact C-N 3.26Å; Y855-V857 PolarHBondContact O-N 2.96Å; V857-K860 PolarHBondContact O-N 3.46Å; V857-R861 PolarHBondContact O-N 3.26Å
858	Q	92.8	Very high	90.1	Very high	6 Å²	6	49.2 Å²	49.2	3%	0.028	27%	0.268	C	S	.	.	H	α-helix	trans	-67.2	-41.6	178	-62.9	177.8	46.2	0	0	111.5	L742 S743 V746 L854 Y855 D856 R861 L862	L742-Q858 PolarHBondContact O-NE2 3.09Å; S743-Q858 VanDerWaalsContact C-CD 3.49Å; S743-Q858 WeakPolarHBondContact O-CG 3.36Å; S743-Q858 PolarHBondContact O-OE1 3.12Å; S743-Q858 VanDerWaalsContact O-OE1 3.1Å; V746-Q858 HydrophobicContact CB-CB 3.95Å; V746-Q858 HydrophobicContact CG2-CB 3.89Å; L854-Q858 PolarHBondContact O-NE2 2.76Å; Y855-Q858 WeakPolarHBondContact O-CA 3.32Å; Y855-Q858 WeakPolarHBondContact O-CB 3.28Å; Y855-Q858 PolarHBondContact O-N 2.99Å; D856-Q858 VanDerWaalsContact C-N 3.31Å; D856-Q858 PolarHBondContact O-N 3.34Å; Q858-R861 PolarHBondContact O-N 2.85Å; Q858-L862 WeakPolarHBondContact O-CG 3.49Å; Q858-L862 PolarHBondContact O-N 2.63Å
859	F	93	Very high	90.1	Very high	6 Å²	6	52.4 Å²	52.4	3%	0.026	28%	0.284	C	S	.	.	H	α-helix	trans	-59.5	-47.1	173.9	-80.3	-71.3	0	0	0	111.8	V746 L846 Y855 D856 R861 L862 E863 F878 V950 L953	V746-F859 HydrophobicContact CG1-CD1 3.92Å; V746-F859 HydrophobicContact CG1-CD2 4.21Å; V746-F859 HydrophobicContact CG1-CE1 3.56Å; V746-F859 HydrophobicContact CG1-CE2 3.87Å; V746-F859 HydrophobicContact CG1-CG 4.23Å; V746-F859 HydrophobicContact CG1-CZ 3.51Å; V746-F859 HydrophobicContact CG2-CD2 4.33Å; V746-F859 HydrophobicContact CG2-CE2 3.95Å; V746-F859 HydrophobicContact CG2-CZ 4.33Å; L846-F859 HydrophobicContact CD2-CE1 4.42Å; L846-F859 HydrophobicContact CD2-CZ 3.66Å; Y855-F859 WeakPolarHBondContact O-CD2 3.47Å; Y855-F859 PolarHBondContact O-N 3.2Å; Y855-F859 VanDerWaalsContact O-N 3.11Å; D856-F859 PolarHBondContact O-N 3.12Å; F859-R861 VanDerWaalsContact C-N 3.32Å; F859-R861 PolarHBondContact O-N 3.46Å; F859-L862 WeakPolarHBondContact O-CB 3.25Å; F859-L862 PolarHBondContact O-N 2.98Å; F859-L862 VanDerWaalsContact O-N 3.13Å; F859-E863 PolarHBondContact O-N 3.19Å; F859-F878 AromaticContact CD1-CE2 3.95Å; F859-F878 HydrophobicContact CD1-CE2 3.95Å; F859-F878 HydrophobicContact CD1-CZ 4.15Å; F859-F878 HydrophobicContact CE1-CE2 4.28Å; F859-V950 HydrophobicContact CE1-CG2 4.29Å; F859-L953 HydrophobicContact CD2-CD1 4.05Å; F859-L953 HydrophobicContact CG-CD1 4.45Å
860	K	91.5	Very high	89.8	Confident	112 Å²	112	52.9 Å²	52.9	49%	0.487	29%	0.286	S	S	.	.	H	α-helix	trans	-61.1	-38.9	176.9	-70.8	-178.6	178.5	-177.4	0	112.8	D856 V857 L862 E863 N864	D856-K860 PolarHBondContact O-N 2.92Å; D856-K860 VanDerWaalsContact O-N 3.12Å; V857-K860 PolarHBondContact O-N 3.46Å; K860-L862 VanDerWaalsContact C-N 3.34Å; K860-E863 PolarHBondContact O-N 3Å; K860-N864 VanDerWaalsContact O-CG 3.27Å; K860-N864 PolarHBondContact O-N 3.21Å; K860-N864 PolarHBondContact O-ND2 3.5Å
861	R	92.2	Very high	89.2	Confident	107 Å²	107	54.1 Å²	54.1	40%	0.404	30%	0.299	S	S	.	.	H	α-helix	trans	-61	-44.1	174.4	-174.9	178.6	66.3	-174.8	-2.6	111.2	S743 N744 V857 Q858 F859 N864 E865	S743-R861 PolarHBondContact O-NH2 3.47Å; N744-R861 PolarHBondContact OD1-NH2 3.35Å; V857-R861 PolarHBondContact O-N 3.26Å; Q858-R861 PolarHBondContact O-N 2.85Å; F859-R861 VanDerWaalsContact C-N 3.32Å; F859-R861 PolarHBondContact O-N 3.46Å; R861-N864 PolarHBondContact O-N 3.03Å; R861-E865 WeakPolarHBondContact O-CB 3.36Å; R861-E865 PolarHBondContact O-N 3.5Å
862	L	93.3	Very high	89	Confident	4 Å²	4	55.4 Å²	55.4	2%	0.021	29%	0.293	C	S	.	.	H	α-helix	trans	-68.1	-34.7	178.3	-71.3	169.3	0	0	0	112.7	V746 R747 L750 Q858 F859 K860 A866 F878	V746-L862 HydrophobicContact CG1-CD1 3.83Å; R747-L862 HydrophobicContact CB-CD2 4.37Å; R747-L862 HydrophobicContact CG-CD2 4.27Å; L750-L862 HydrophobicContact CD1-CD1 3.99Å; Q858-L862 WeakPolarHBondContact O-CG 3.49Å; Q858-L862 PolarHBondContact O-N 2.63Å; F859-L862 WeakPolarHBondContact O-CB 3.25Å; F859-L862 PolarHBondContact O-N 2.98Å; F859-L862 VanDerWaalsContact O-N 3.13Å; K860-L862 VanDerWaalsContact C-N 3.34Å; L862-A866 VanDerWaalsContact O-CB 3.3Å; L862-A866 WeakPolarHBondContact O-CB 3.3Å; L862-A866 PolarHBondContact O-N 3.42Å; L862-F878 HydrophobicContact CB-CB 4.13Å; L862-F878 HydrophobicContact CB-CD1 4.34Å; L862-F878 HydrophobicContact CB-CD2 4.46Å; L862-F878 HydrophobicContact CB-CG 4.08Å
863	E	93.5	Very high	88.3	Confident	10 Å²	10	57.2 Å²	57.2	5%	0.047	31%	0.308	C	S	.	.	H	α-helix	trans	-63.6	-49.1	172.7	-175.7	174.9	-142.4	0	0	111.5	F859 K860 E865 A866 L867 F878 C954 S955 Q956 L957	F859-E863 PolarHBondContact O-N 3.19Å; K860-E863 PolarHBondContact O-N 3Å; E863-E865 VanDerWaalsContact C-N 3.34Å; E863-E865 PolarHBondContact O-N 2.94Å; E863-A866 PolarHBondContact O-N 3.3Å; E863-L867 HydrophobicContact CG-CD1 4.11Å; E863-L867 WeakPolarHBondContact O-CG 3.36Å; E863-L867 PolarHBondContact O-N 2.85Å; E863-F878 HydrophobicContact CB-CD1 4.27Å; E863-F878 HydrophobicContact CB-CE1 3.99Å; E863-C954 HydrophobicContact CB-CB 4.22Å; E863-C954 VanDerWaalsContact CD-CA 3.46Å; E863-C954 VanDerWaalsContact CD-CB 3.44Å; E863-C954 HydrophobicContact CG-CB 4.19Å; E863-C954 WeakPolarHBondContact OE1-CA 3.19Å; E863-C954 WeakPolarHBondContact OE1-CB 3.21Å; E863-C954 VanDerWaalsContact OE2-CA 3.28Å; E863-C954 WeakPolarHBondContact OE2-CA 3.23Å; E863-C954 WeakPolarHBondContact OE2-CB 3.3Å; E863-C954 PolarHBondContact OE2-SG 3.4Å; E863-C954 VanDerWaalsContact OE2-SG 3.41Å; E863-S955 PolarHBondContact OE1-N 3.32Å; E863-Q956 WeakPolarHBondContact OE1-CA 3.31Å; E863-Q956 WeakPolarHBondContact OE1-CB 3.35Å; E863-Q956 PolarHBondContact OE1-N 3.46Å; E863-L957 HydrophobicContact CG-CB 4.05Å; E863-L957 PolarHBondContact OE1-N 2.98Å
864	N	92.3	Very high	87.8	Confident	98 Å²	98	58.4 Å²	58.4	52%	0.524	31%	0.309	S	S	.	.	H	α-helix	trans	-62.2	-41.7	177.9	-67.7	-23.8	0	0	0	111.9	K860 R861 L867 A868	K860-N864 VanDerWaalsContact O-CG 3.27Å; K860-N864 PolarHBondContact O-N 3.21Å; K860-N864 PolarHBondContact O-ND2 3.5Å; R861-N864 PolarHBondContact O-N 3.03Å; N864-L867 PolarHBondContact O-N 3.38Å; N864-A868 WeakPolarHBondContact O-CB 3.22Å; N864-A868 PolarHBondContact O-N 2.79Å
865	E	91.9	Very high	87.6	Confident	69 Å²	69	57.5 Å²	57.5	32%	0.322	31%	0.306	S	S	.	.	H	α-helix	trans	-60.2	-45	173.9	-175.8	-177.1	162.7	0	0	110.8	R747 R861 E863 A868 H869	R747-E865 IonicContact CZ-OE1 2.72Å; R747-E865 VanDerWaalsContact NH1-CD 3.3Å; R747-E865 IonicContact NH1-OE1 2.72Å; R747-E865 PolarHBondContact NH1-OE1 2.85Å; R747-E865 IonicContact NH1-OE2 3.22Å; R747-E865 PolarHBondContact NH1-OE2 2.68Å; R747-E865 IonicContact NH2-OE1 3.89Å; R861-E865 WeakPolarHBondContact O-CB 3.36Å; R861-E865 PolarHBondContact O-N 3.5Å; E863-E865 VanDerWaalsContact C-N 3.34Å; E863-E865 PolarHBondContact O-N 2.94Å; E865-A868 PolarHBondContact O-N 3.41Å; E865-H869 WeakPolarHBondContact O-CB 3.31Å; E865-H869 PolarHBondContact O-CD2 3.42Å; E865-H869 VanDerWaalsContact O-CD2 3.27Å; E865-H869 PolarHBondContact O-N 3.38Å; E865-H869 VanDerWaalsContact O-N 3.08Å
866	A	90.8	Very high	87.7	Confident	0 Å²	0	58.1 Å²	58.1	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-67.2	-37.7	-179.8	0	0	0	0	0	113.6	L862 E863 I870 P876 F878 L957	L862-A866 VanDerWaalsContact O-CB 3.3Å; L862-A866 WeakPolarHBondContact O-CB 3.3Å; L862-A866 PolarHBondContact O-N 3.42Å; E863-A866 PolarHBondContact O-N 3.3Å; A866-I870 WeakPolarHBondContact O-CA 3.46Å; A866-I870 WeakPolarHBondContact O-CB 3.46Å; A866-I870 PolarHBondContact O-N 2.61Å; A866-I870 VanDerWaalsContact O-N 3.17Å; A866-P876 HydrophobicContact CB-CB 3.76Å; A866-P876 HydrophobicContact CB-CG 4.3Å; A866-F878 HydrophobicContact CB-CB 4.15Å; A866-L957 HydrophobicContact CB-CD1 4.23Å; A866-L957 HydrophobicContact CB-CD2 3.72Å
867	L	88.6	Confident	87.8	Confident	53 Å²	53	58.1 Å²	58.1	28%	0.277	31%	0.31	S	S	.	.	H	α-helix	trans	-69.3	-36.4	175.9	-70.9	170.1	0	0	0	112	E863 N864 H869 Q956 L957	E863-L867 HydrophobicContact CG-CD1 4.11Å; E863-L867 WeakPolarHBondContact O-CG 3.36Å; E863-L867 PolarHBondContact O-N 2.85Å; N864-L867 PolarHBondContact O-N 3.38Å; L867-H869 VanDerWaalsContact C-N 3.35Å; L867-Q956 HydrophobicContact CD1-CB 3.95Å; L867-L957 HydrophobicContact CD2-CD1 3.95Å; L867-L957 HydrophobicContact CG-CD1 4.39Å
868	A	89.2	Confident	87.9	Confident	75 Å²	75	53.5 Å²	53.5	62%	0.62	28%	0.282	S	S	*	.	H	α-helix	trans	-70.4	-31.1	177.8	0	0	0	0	0	113.1	N864 E865	N864-A868 WeakPolarHBondContact O-CB 3.22Å; N864-A868 PolarHBondContact O-N 2.79Å; E865-A868 PolarHBondContact O-N 3.41Å
869	H	87.1	Confident	87.8	Confident	86 Å²	86	53.2 Å²	53.2	40%	0.398	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.4	23	-172.4	-68.4	-71.7	0	0	0	113.2	E865 L867 D871 D872 P876	E865-H869 WeakPolarHBondContact O-CB 3.31Å; E865-H869 PolarHBondContact O-CD2 3.42Å; E865-H869 VanDerWaalsContact O-CD2 3.27Å; E865-H869 PolarHBondContact O-N 3.38Å; E865-H869 VanDerWaalsContact O-N 3.08Å; L867-H869 VanDerWaalsContact C-N 3.35Å; H869-D871 VanDerWaalsContact C-N 3.27Å; H869-D871 PolarHBondContact O-N 3.3Å; H869-D872 HydrophobicContact CB-CB 4.48Å; H869-D872 WeakPolarHBondContact CB-OD2 3.18Å; H869-D872 IonicContact CE1-OD2 3.42Å; H869-D872 IonicContact CG-OD2 3.15Å; H869-D872 IonicContact ND1-OD1 3.43Å; H869-D872 IonicContact ND1-OD2 2.83Å; H869-D872 PolarHBondContact ND1-OD2 2.93Å; H869-D872 WeakPolarHBondContact O-CB 3.19Å; H869-D872 PolarHBondContact O-N 3.41Å; H869-P876 HydrophobicContact CB-CG 4.03Å; H869-P876 WeakPolarHBondContact O-CD 3.34Å; H869-P876 WeakPolarHBondContact O-CG 3.46Å
870	I	83.2	Confident	87.7	Confident	12 Å²	12	55 Å²	55	6%	0.062	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-31.6	-172.7	-152.5	152.2	0	0	0	112.7	A866 L879 L957 H960 I962 Y1133	A866-I870 WeakPolarHBondContact O-CA 3.46Å; A866-I870 WeakPolarHBondContact O-CB 3.46Å; A866-I870 PolarHBondContact O-N 2.61Å; A866-I870 VanDerWaalsContact O-N 3.17Å; I870-L879 HydrophobicContact CG1-CD2 4.08Å; I870-L957 HydrophobicContact CD1-CD1 4.09Å; I870-H960 VanDerWaalsContact CD1-CE1 3.48Å; I870-H960 WeakPolarHBondContact CD1-CE1 3.42Å; I870-I962 HydrophobicContact CD1-CD1 3.93Å; I870-I962 HydrophobicContact CG1-CD1 3.82Å; I870-Y1133 WeakPolarHBondContact O-CE2 3.34Å; I870-Y1133 VanDerWaalsContact O-CZ 3.26Å; I870-Y1133 PolarHBondContact O-OH 3.35Å
871	D	76.5	Confident	87.8	Confident	111 Å²	111	49.7 Å²	49.7	59%	0.594	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.2	6	-179.6	-66.1	-48	0	0	0	113.5	H869	H869-D871 VanDerWaalsContact C-N 3.27Å; H869-D871 PolarHBondContact O-N 3.3Å
872	D	80.4	Confident	87.8	Confident	80 Å²	80	44.6 Å²	44.6	43%	0.428	25%	0.247	S	C	.	.	S	Bend	trans	-65.5	154.9	178.4	-78.5	-1.1	0	0	0	111.6	H869 N874	H869-D872 HydrophobicContact CB-CB 4.48Å; H869-D872 WeakPolarHBondContact CB-OD2 3.18Å; H869-D872 IonicContact CE1-OD2 3.42Å; H869-D872 IonicContact CG-OD2 3.15Å; H869-D872 IonicContact ND1-OD1 3.43Å; H869-D872 IonicContact ND1-OD2 2.83Å; H869-D872 PolarHBondContact ND1-OD2 2.93Å; H869-D872 WeakPolarHBondContact O-CB 3.19Å; H869-D872 PolarHBondContact O-N 3.41Å; D872-N874 PolarHBondContact O-N 3.32Å
873	V	73.8	Confident	87.6	Confident	87 Å²	87	44.4 Å²	44.4	53%	0.527	25%	0.246	S	C	.	.	S	Bend	trans	-55.5	-38.3	-178.3	-176.8	0	0	0	0	111.9
874	N	77.2	Confident	87.4	Confident	128 Å²	128	44.9 Å²	44.9	68%	0.684	25%	0.249	S	C	*	.	S	Bend	trans	-105.5	125.8	174.9	-64.4	-45.4	0	0	0	108.3	D872	D872-N874 PolarHBondContact O-N 3.32Å
875	P	82.8	Confident	87.4	Confident	35 Å²	35	40.2 Å²	40.2	23%	0.227	22%	0.224	C	C	.	.			trans	-59.9	142.2	-178.7	21.1	-30.1	0	0	0	110.7	L879 Q880 L1137	P875-L879 HydrophobicContact CB-CD2 4.49Å; P875-Q880 HydrophobicContact CB-CG 3.87Å; P875-Q880 HydrophobicContact CG-CG 3.7Å; P875-Q880 PolarHBondContact O-NE2 3.41Å; P875-L1137 HydrophobicContact CB-CD2 3.61Å; P875-L1137 HydrophobicContact CG-CD2 4.02Å
876	P	91.1	Very high	87.3	Confident	15 Å²	15	37 Å²	37	10%	0.097	21%	0.209	C	C	.	.			trans	-57.9	145.9	178	-26.7	34.3	0	0	0	112.5	A866 H869 F878 L879 Q880	A866-P876 HydrophobicContact CB-CB 3.76Å; A866-P876 HydrophobicContact CB-CG 4.3Å; H869-P876 HydrophobicContact CB-CG 4.03Å; H869-P876 WeakPolarHBondContact O-CD 3.34Å; H869-P876 WeakPolarHBondContact O-CG 3.46Å; P876-F878 VanDerWaalsContact C-N 3.25Å; P876-F878 PolarHBondContact O-N 2.81Å; P876-L879 HydrophobicContact CB-CB 4.35Å; P876-L879 WeakPolarHBondContact O-CB 3.44Å; P876-L879 PolarHBondContact O-N 2.79Å; P876-L879 VanDerWaalsContact O-N 3.07Å; P876-Q880 PolarHBondContact O-N 3.21Å
877	L	91.5	Very high	87.2	Confident	27 Å²	27	38.4 Å²	38.4	14%	0.141	22%	0.216	C	C	.	.	H	α-helix	trans	-51	-45.7	-177.9	174.1	66.5	0	0	0	112.5	R747 L750 T751 V754 Q880 F881	R747-L877 HydrophobicContact CG-CD2 3.88Å; L750-L877 HydrophobicContact CB-CD2 4.19Å; L750-L877 HydrophobicContact CB-CG 4.34Å; T751-L877 WeakPolarHBondContact OG1-CD2 3.44Å; V754-L877 HydrophobicContact CB-CD1 4.15Å; V754-L877 HydrophobicContact CG2-CD1 3.87Å; L877-Q880 PolarHBondContact O-N 3.03Å; L877-F881 WeakPolarHBondContact O-CB 3.38Å; L877-F881 PolarHBondContact O-N 2.75Å
878	F	93.3	Very high	87.2	Confident	3 Å²	3	36 Å²	36	1%	0.013	20%	0.204	C	C	.	.	H	α-helix	trans	-70.3	-34.3	-175.9	-167	-133.3	0	0	0	112.4	L750 F859 L862 E863 A866 P876 F881 L882 V950 C954 L957	L750-F878 HydrophobicContact CD1-CD2 3.63Å; L750-F878 HydrophobicContact CD1-CE2 4.08Å; F859-F878 AromaticContact CD1-CE2 3.95Å; F859-F878 HydrophobicContact CD1-CE2 3.95Å; F859-F878 HydrophobicContact CD1-CZ 4.15Å; F859-F878 HydrophobicContact CE1-CE2 4.28Å; L862-F878 HydrophobicContact CB-CB 4.13Å; L862-F878 HydrophobicContact CB-CD1 4.34Å; L862-F878 HydrophobicContact CB-CD2 4.46Å; L862-F878 HydrophobicContact CB-CG 4.08Å; E863-F878 HydrophobicContact CB-CD1 4.27Å; E863-F878 HydrophobicContact CB-CE1 3.99Å; A866-F878 HydrophobicContact CB-CB 4.15Å; P876-F878 VanDerWaalsContact C-N 3.25Å; P876-F878 PolarHBondContact O-N 2.81Å; F878-F881 AromaticContact CD2-CD1 3.96Å; F878-F881 HydrophobicContact CD2-CD1 3.96Å; F878-F881 AromaticContact CE2-CD1 3.94Å; F878-F881 HydrophobicContact CE2-CD1 3.94Å; F878-F881 HydrophobicContact CE2-CE1 4.3Å; F878-F881 PolarHBondContact O-N 2.63Å; F878-L882 HydrophobicContact CD1-CD1 4.45Å; F878-L882 HydrophobicContact CE1-CD1 4.17Å; F878-L882 HydrophobicContact CE2-CG 4.44Å; F878-L882 HydrophobicContact CZ-CD1 4.29Å; F878-L882 HydrophobicContact CZ-CG 4.5Å; F878-L882 WeakPolarHBondContact O-CG 3.48Å; F878-L882 PolarHBondContact O-N 3Å; F878-V950 HydrophobicContact CE2-CG1 4.04Å; F878-V950 HydrophobicContact CZ-CG1 3.69Å; F878-C954 HydrophobicContact CE1-CB 3.89Å; F878-C954 HydrophobicContact CZ-CB 3.99Å; F878-L957 HydrophobicContact CB-CD2 4.46Å; F878-L957 HydrophobicContact CD1-CD2 3.38Å; F878-L957 HydrophobicContact CE1-CD2 3.91Å; F878-L957 HydrophobicContact CG-CD2 4.18Å
879	L	91	Very high	87.3	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-64.9	-44.8	172.6	178.6	60.7	0	0	0	111.2	I870 P875 P876 L882 S883 L957 I962 L963 Y1133 L1137	I870-L879 HydrophobicContact CG1-CD2 4.08Å; P875-L879 HydrophobicContact CB-CD2 4.49Å; P876-L879 HydrophobicContact CB-CB 4.35Å; P876-L879 WeakPolarHBondContact O-CB 3.44Å; P876-L879 PolarHBondContact O-N 2.79Å; P876-L879 VanDerWaalsContact O-N 3.07Å; L879-L882 PolarHBondContact O-N 2.84Å; L879-S883 WeakPolarHBondContact O-CB 3.31Å; L879-S883 PolarHBondContact O-N 3.06Å; L879-L957 HydrophobicContact CD1-CD1 4.42Å; L879-I962 HydrophobicContact CD1-CG2 4.47Å; L879-L963 HydrophobicContact CD1-CD1 3.72Å; L879-L963 HydrophobicContact CD1-CD2 4.1Å; L879-L963 HydrophobicContact CD1-CG 3.83Å; L879-Y1133 HydrophobicContact CD2-CE1 3.87Å; L879-L1137 HydrophobicContact CD1-CD1 4.47Å; L879-L1137 HydrophobicContact CD2-CD1 4.44Å; L879-L1137 HydrophobicContact CD2-CD2 4.15Å; L879-L1137 HydrophobicContact CG-CD1 4.37Å; L879-L1137 HydrophobicContact CG-CD2 4.17Å
880	Q	90.4	Very high	87.5	Confident	43 Å²	43	30.1 Å²	30.1	20%	0.201	17%	0.165	C	C	.	.	H	α-helix	trans	-59.8	-46.7	175	-67	-176.5	55.6	0	0	111.3	V754 P875 P876 L877 L882 S883 L884	V754-Q880 HydrophobicContact CG1-CB 3.99Å; V754-Q880 HydrophobicContact CG2-CB 4.07Å; P875-Q880 HydrophobicContact CB-CG 3.87Å; P875-Q880 HydrophobicContact CG-CG 3.7Å; P875-Q880 PolarHBondContact O-NE2 3.41Å; P876-Q880 PolarHBondContact O-N 3.21Å; L877-Q880 PolarHBondContact O-N 3.03Å; Q880-L882 PolarHBondContact O-N 2.9Å; Q880-S883 PolarHBondContact O-N 3.24Å; Q880-L884 WeakPolarHBondContact O-CG 3.44Å; Q880-L884 PolarHBondContact O-N 2.89Å
881	F	93.2	Very high	87.8	Confident	0 Å²	0	31.9 Å²	31.9	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-56.7	-50.3	177	165.8	-107.5	0	0	0	112.1	L750 F753 V754 L846 L877 F878 S883 L884 L885 V950	L750-F881 HydrophobicContact CD1-CB 4.43Å; L750-F881 HydrophobicContact CD1-CD1 4.01Å; L750-F881 HydrophobicContact CD1-CG 4.15Å; L750-F881 HydrophobicContact CD2-CD1 3.94Å; L750-F881 HydrophobicContact CD2-CD2 3.64Å; L750-F881 HydrophobicContact CD2-CE1 3.91Å; L750-F881 HydrophobicContact CD2-CE2 3.62Å; L750-F881 HydrophobicContact CD2-CG 3.78Å; L750-F881 HydrophobicContact CD2-CZ 3.75Å; L750-F881 HydrophobicContact CG-CG 4.39Å; F753-F881 HydrophobicContact CB-CD2 4.38Å; F753-F881 AromaticContact CD1-CD2 3.63Å; F753-F881 HydrophobicContact CD1-CD2 3.63Å; F753-F881 HydrophobicContact CD1-CE2 4.04Å; F753-F881 HydrophobicContact CD2-CD2 4.42Å; F753-F881 HydrophobicContact CD2-CE2 4.07Å; F753-F881 AromaticContact CE1-CD2 3.95Å; F753-F881 HydrophobicContact CE1-CD2 3.95Å; F753-F881 HydrophobicContact CE1-CE2 4.11Å; F753-F881 HydrophobicContact CE2-CE2 4.16Å; F753-F881 AromaticContact CG-CD2 3.9Å; F753-F881 HydrophobicContact CG-CD2 3.9Å; F753-F881 HydrophobicContact CG-CE2 4.02Å; F753-F881 HydrophobicContact CZ-CD2 4.48Å; F753-F881 HydrophobicContact CZ-CE2 4.18Å; V754-F881 HydrophobicContact CG2-CB 4.01Å; L846-F881 HydrophobicContact CD1-CZ 4.27Å; L877-F881 WeakPolarHBondContact O-CB 3.38Å; L877-F881 PolarHBondContact O-N 2.75Å; F878-F881 AromaticContact CD2-CD1 3.96Å; F878-F881 HydrophobicContact CD2-CD1 3.96Å; F878-F881 AromaticContact CE2-CD1 3.94Å; F878-F881 HydrophobicContact CE2-CD1 3.94Å; F878-F881 HydrophobicContact CE2-CE1 4.3Å; F878-F881 PolarHBondContact O-N 2.63Å; F881-S883 VanDerWaalsContact C-N 3.35Å; F881-S883 PolarHBondContact O-N 3.44Å; F881-L884 PolarHBondContact O-N 2.96Å; F881-L885 HydrophobicContact CE1-CD2 4.18Å; F881-L885 HydrophobicContact CE2-CD1 4.46Å; F881-L885 HydrophobicContact CZ-CD1 4.39Å; F881-L885 HydrophobicContact CZ-CD2 3.91Å; F881-L885 WeakPolarHBondContact O-CB 3.02Å; F881-L885 PolarHBondContact O-N 3.12Å; F881-V950 HydrophobicContact CE1-CG2 4.32Å
882	L	92.2	Very high	88.4	Confident	0 Å²	0	26.6 Å²	26.6	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-63.7	-40.5	179.6	-71.8	177.9	0	0	0	112.2	F878 L879 Q880 L884 L885 V886 V950 L957 I958 L963	F878-L882 HydrophobicContact CD1-CD1 4.45Å; F878-L882 HydrophobicContact CE1-CD1 4.17Å; F878-L882 HydrophobicContact CE2-CG 4.44Å; F878-L882 HydrophobicContact CZ-CD1 4.29Å; F878-L882 HydrophobicContact CZ-CG 4.5Å; F878-L882 WeakPolarHBondContact O-CG 3.48Å; F878-L882 PolarHBondContact O-N 3Å; L879-L882 PolarHBondContact O-N 2.84Å; Q880-L882 PolarHBondContact O-N 2.9Å; L882-L884 VanDerWaalsContact C-N 3.35Å; L882-L884 PolarHBondContact O-N 3.3Å; L882-L885 PolarHBondContact O-N 3.34Å; L882-V886 VanDerWaalsContact O-CG2 3.31Å; L882-V886 WeakPolarHBondContact O-CG2 3.47Å; L882-V886 PolarHBondContact O-N 3.34Å; L882-V950 HydrophobicContact CD2-CG1 3.81Å; L882-L957 HydrophobicContact CD1-CB 4.45Å; L882-L957 HydrophobicContact CD1-CD2 3.65Å; L882-L957 HydrophobicContact CD1-CG 4.03Å; L882-I958 HydrophobicContact CD1-CD1 3.81Å; L882-I958 HydrophobicContact CD1-CG1 4.12Å; L882-I958 HydrophobicContact CD2-CD1 4.03Å; L882-I958 HydrophobicContact CG-CD1 4.37Å; L882-L963 HydrophobicContact CB-CD1 3.94Å; L882-L963 HydrophobicContact CD1-CD1 4.02Å
883	S	89.9	Confident	88.7	Confident	1 Å²	1	23 Å²	23	1%	0.007	12%	0.124	C	C	.	.	H	α-helix	trans	-58.6	-46.9	175.1	-174.6	0	0	0	0	111.4	L879 Q880 F881 V886 N887 R966 N1138	L879-S883 WeakPolarHBondContact O-CB 3.31Å; L879-S883 PolarHBondContact O-N 3.06Å; Q880-S883 PolarHBondContact O-N 3.24Å; F881-S883 VanDerWaalsContact C-N 3.35Å; F881-S883 PolarHBondContact O-N 3.44Å; S883-V886 PolarHBondContact O-N 3.4Å; S883-N887 VanDerWaalsContact O-CG 3.28Å; S883-N887 PolarHBondContact O-N 3.38Å; S883-N887 PolarHBondContact O-ND2 2.85Å; S883-R966 PolarHBondContact OG-NH1 2.93Å; S883-N1138 PolarHBondContact OG-OD1 3.45Å
884	L	89.6	Confident	89.5	Confident	19 Å²	19	20.6 Å²	20.6	10%	0.099	11%	0.109	C	C	.	.	H	α-helix	trans	-66.6	-40.2	177.5	-68.3	176.3	0	0	0	112.4	F753 V754 E757 Q880 F881 L882 V886 N887 D888	F753-L884 HydrophobicContact CE1-CB 3.95Å; V754-L884 HydrophobicContact CB-CD1 4.32Å; V754-L884 HydrophobicContact CG1-CD1 4.34Å; V754-L884 HydrophobicContact CG2-CD1 4.15Å; E757-L884 HydrophobicContact CB-CD1 4.09Å; E757-L884 HydrophobicContact CB-CD2 4.18Å; E757-L884 HydrophobicContact CG-CD2 3.73Å; Q880-L884 WeakPolarHBondContact O-CG 3.44Å; Q880-L884 PolarHBondContact O-N 2.89Å; F881-L884 PolarHBondContact O-N 2.96Å; L882-L884 VanDerWaalsContact C-N 3.35Å; L882-L884 PolarHBondContact O-N 3.3Å; L884-V886 VanDerWaalsContact C-N 3.31Å; L884-V886 PolarHBondContact O-N 2.73Å; L884-N887 WeakPolarHBondContact O-CB 3.29Å; L884-N887 PolarHBondContact O-N 3.12Å; L884-D888 WeakPolarHBondContact O-CB 3.11Å; L884-D888 VanDerWaalsContact O-CG 3.28Å; L884-D888 PolarHBondContact O-N 3.13Å
885	L	91.2	Very high	90.1	Very high	0 Å²	0	17.6 Å²	17.6	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-63.2	-38.8	178.4	-169.7	70.9	0	0	0	111.7	F753 Y843 F881 L882 D888 A889 T943 T946 L947	F753-L885 HydrophobicContact CZ-CD1 4.27Å; Y843-L885 HydrophobicContact CE1-CD1 3.79Å; F881-L885 HydrophobicContact CE1-CD2 4.18Å; F881-L885 HydrophobicContact CE2-CD1 4.46Å; F881-L885 HydrophobicContact CZ-CD1 4.39Å; F881-L885 HydrophobicContact CZ-CD2 3.91Å; F881-L885 WeakPolarHBondContact O-CB 3.02Å; F881-L885 PolarHBondContact O-N 3.12Å; L882-L885 PolarHBondContact O-N 3.34Å; L885-D888 PolarHBondContact O-N 3.23Å; L885-A889 WeakPolarHBondContact O-CB 3.09Å; L885-A889 PolarHBondContact O-N 3.45Å; L885-T943 HydrophobicContact CD1-CG2 3.69Å; L885-T943 HydrophobicContact CG-CG2 4.17Å; L885-T946 HydrophobicContact CD1-CG2 4.47Å; L885-T946 HydrophobicContact CD2-CG2 4.32Å; L885-L947 HydrophobicContact CD2-CB 4.06Å; L885-L947 HydrophobicContact CD2-CD1 3.92Å
886	V	90.7	Very high	90.3	Very high	1 Å²	1	16 Å²	16	1%	0.006	8%	0.08	C	C	.	.	H	α-helix	trans	-67.2	-42.8	173.8	172.2	0	0	0	0	110.9	L882 S883 L884 D888 A889 I890 L947 R966 V967 M970	L882-V886 VanDerWaalsContact O-CG2 3.31Å; L882-V886 WeakPolarHBondContact O-CG2 3.47Å; L882-V886 PolarHBondContact O-N 3.34Å; S883-V886 PolarHBondContact O-N 3.4Å; L884-V886 VanDerWaalsContact C-N 3.31Å; L884-V886 PolarHBondContact O-N 2.73Å; V886-D888 VanDerWaalsContact C-N 3.31Å; V886-D888 PolarHBondContact O-N 2.83Å; V886-A889 PolarHBondContact O-N 3.42Å; V886-I890 HydrophobicContact CG1-CD1 3.93Å; V886-I890 VanDerWaalsContact O-CG1 3.27Å; V886-I890 WeakPolarHBondContact O-CG1 3.4Å; V886-I890 PolarHBondContact O-N 2.84Å; V886-L947 HydrophobicContact CG2-CD1 4.49Å; V886-R966 HydrophobicContact CG1-CB 4.49Å; V886-V967 HydrophobicContact CG2-CG2 3.89Å; V886-M970 HydrophobicContact CG1-SD 4.1Å
887	N	88.3	Confident	90.1	Very high	30 Å²	30	15.4 Å²	15.4	16%	0.16	8%	0.076	C	C	.	.	H	α-helix	trans	-58.2	-44.8	174.7	-72.1	-21.2	0	0	0	111.9	S883 L884 I890 F891 R966 N1138	S883-N887 VanDerWaalsContact O-CG 3.28Å; S883-N887 PolarHBondContact O-N 3.38Å; S883-N887 PolarHBondContact O-ND2 2.85Å; L884-N887 WeakPolarHBondContact O-CB 3.29Å; L884-N887 PolarHBondContact O-N 3.12Å; N887-I890 PolarHBondContact O-N 2.62Å; N887-F891 PolarHBondContact O-N 3.25Å; N887-R966 PolarHBondContact OD1-NH2 2.77Å; N887-N1138 PolarHBondContact ND2-OD1 3.22Å
888	D	89.3	Confident	90	Very high	3 Å²	3	16.9 Å²	16.9	2%	0.016	9%	0.089	C	C	.	.	H	α-helix	trans	-63.4	-44.7	178.4	-75.4	-0.3	0	0	0	111.8	F836 R839 L884 L885 V886 I890 F891 L892 T943	F836-D888 HydrophobicContact CE1-CB 4.12Å; R839-D888 VanDerWaalsContact CD-OD2 3.29Å; R839-D888 WeakPolarHBondContact CD-OD2 3.07Å; R839-D888 IonicContact CZ-OD1 3.93Å; R839-D888 IonicContact CZ-OD2 2.86Å; R839-D888 IonicContact NE-OD2 3Å; R839-D888 PolarHBondContact NE-OD2 3.38Å; R839-D888 IonicContact NH1-OD1 2.62Å; R839-D888 PolarHBondContact NH1-OD1 2.85Å; R839-D888 IonicContact NH1-OD2 2.79Å; R839-D888 PolarHBondContact NH1-OD2 3.45Å; L884-D888 WeakPolarHBondContact O-CB 3.11Å; L884-D888 VanDerWaalsContact O-CG 3.28Å; L884-D888 PolarHBondContact O-N 3.13Å; L885-D888 PolarHBondContact O-N 3.23Å; V886-D888 VanDerWaalsContact C-N 3.31Å; V886-D888 PolarHBondContact O-N 2.83Å; D888-I890 VanDerWaalsContact C-N 3.31Å; D888-I890 PolarHBondContact O-N 2.97Å; D888-F891 PolarHBondContact O-N 3.46Å; D888-L892 HydrophobicContact CB-CD1 4.4Å; D888-L892 VanDerWaalsContact O-CB 3.25Å; D888-L892 WeakPolarHBondContact O-CB 3.06Å; D888-L892 VanDerWaalsContact O-CG 3.27Å; D888-L892 WeakPolarHBondContact O-CG 3.5Å; D888-L892 PolarHBondContact O-N 3.5Å; D888-T943 HydrophobicContact CB-CG2 4.14Å
889	A	90.7	Very high	89.9	Confident	0 Å²	0	17.2 Å²	17.2	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-60.8	-43.1	177.4	0	0	0	0	0	111.1	L885 V886 L893 T943 I944 M970	L885-A889 WeakPolarHBondContact O-CB 3.09Å; L885-A889 PolarHBondContact O-N 3.45Å; V886-A889 PolarHBondContact O-N 3.42Å; A889-L893 VanDerWaalsContact O-CB 3.29Å; A889-L893 WeakPolarHBondContact O-CB 3.28Å; A889-L893 WeakPolarHBondContact O-CG 3.39Å; A889-L893 PolarHBondContact O-N 3.2Å; A889-T943 HydrophobicContact CB-CG2 3.85Å; A889-I944 HydrophobicContact CB-CD1 3.95Å; A889-M970 HydrophobicContact CB-SD 3.71Å
890	I	90.3	Very high	89.8	Confident	38 Å²	38	17.2 Å²	17.2	20%	0.195	9%	0.091	C	C	.	.	H	α-helix	trans	-59.4	-54.3	175.6	-67.3	164.8	0	0	0	110	V886 N887 D888 D894 M970	V886-I890 HydrophobicContact CG1-CD1 3.93Å; V886-I890 VanDerWaalsContact O-CG1 3.27Å; V886-I890 WeakPolarHBondContact O-CG1 3.4Å; V886-I890 PolarHBondContact O-N 2.84Å; N887-I890 PolarHBondContact O-N 2.62Å; D888-I890 VanDerWaalsContact C-N 3.31Å; D888-I890 PolarHBondContact O-N 2.97Å; I890-D894 WeakPolarHBondContact O-CB 3.15Å; I890-D894 PolarHBondContact O-N 2.97Å; I890-M970 HydrophobicContact CD1-CB 4.35Å; I890-M970 HydrophobicContact CD1-CG 4.41Å; I890-M970 HydrophobicContact CG1-CB 4.08Å; I890-M970 HydrophobicContact CG1-CG 3.65Å; I890-M970 HydrophobicContact CG1-SD 4.27Å
891	F	90.2	Very high	89.6	Confident	49 Å²	49	17.1 Å²	17.1	22%	0.215	10%	0.097	C	C	.	.	H	α-helix	trans	-63.6	-55.6	-176.4	175.1	-93.8	0	0	0	112.5	F832 F836 N887 D888 L893 D894 E895	F832-F891 HydrophobicContact CD1-CE1 4.23Å; F832-F891 HydrophobicContact CD1-CE2 4.27Å; F832-F891 AromaticContact CD1-CZ 3.97Å; F832-F891 HydrophobicContact CD1-CZ 3.97Å; F832-F891 AromaticContact CE1-CD1 3.75Å; F832-F891 HydrophobicContact CE1-CD1 3.75Å; F832-F891 AromaticContact CE1-CD2 3.77Å; F832-F891 HydrophobicContact CE1-CD2 3.77Å; F832-F891 AromaticContact CE1-CE1 3.6Å; F832-F891 HydrophobicContact CE1-CE1 3.6Å; F832-F891 AromaticContact CE1-CE2 3.61Å; F832-F891 HydrophobicContact CE1-CE2 3.61Å; F832-F891 AromaticContact CE1-CG 3.84Å; F832-F891 HydrophobicContact CE1-CG 3.84Å; F832-F891 AromaticContact CE1-CZ 3.53Å; F832-F891 HydrophobicContact CE1-CZ 3.53Å; F832-F891 HydrophobicContact CZ-CD1 4.44Å; F832-F891 HydrophobicContact CZ-CD2 4.21Å; F832-F891 HydrophobicContact CZ-CE2 4.43Å; F832-F891 HydrophobicContact CZ-CG 4.22Å; F836-F891 AromaticContact CE2-CD1 3.74Å; F836-F891 HydrophobicContact CE2-CD1 3.74Å; F836-F891 AromaticContact CE2-CE1 3.66Å; F836-F891 HydrophobicContact CE2-CE1 3.66Å; F836-F891 AromaticContact CZ-CD1 3.58Å; F836-F891 HydrophobicContact CZ-CD1 3.58Å; F836-F891 HydrophobicContact CZ-CE1 4.02Å; N887-F891 PolarHBondContact O-N 3.25Å; D888-F891 PolarHBondContact O-N 3.46Å; F891-L893 VanDerWaalsContact C-N 3.3Å; F891-L893 PolarHBondContact O-N 3.12Å; F891-D894 PolarHBondContact O-N 3.44Å; F891-E895 HydrophobicContact CZ-CB 4.43Å; F891-E895 HydrophobicContact CZ-CG 4.35Å; F891-E895 VanDerWaalsContact O-CB 3.3Å; F891-E895 WeakPolarHBondContact O-CB 3.5Å; F891-E895 PolarHBondContact O-N 3.28Å
892	L	88.9	Confident	89.4	Confident	0 Å²	0	22.2 Å²	22.2	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-60.4	-41.8	-171.9	-73	170	0	0	0	111.7	F836 D888 A896 H936 L939 T943	F836-L892 HydrophobicContact CD1-CD1 3.88Å; F836-L892 HydrophobicContact CD1-CD2 3.86Å; F836-L892 HydrophobicContact CD1-CG 4.13Å; F836-L892 HydrophobicContact CD2-CD2 3.97Å; F836-L892 HydrophobicContact CE1-CD1 3.73Å; F836-L892 HydrophobicContact CE1-CD2 3.76Å; F836-L892 HydrophobicContact CE1-CG 3.7Å; F836-L892 HydrophobicContact CE2-CD2 3.89Å; F836-L892 HydrophobicContact CG-CD2 3.98Å; F836-L892 HydrophobicContact CZ-CD1 4.46Å; F836-L892 HydrophobicContact CZ-CD2 3.79Å; F836-L892 HydrophobicContact CZ-CG 3.93Å; D888-L892 HydrophobicContact CB-CD1 4.4Å; D888-L892 VanDerWaalsContact O-CB 3.25Å; D888-L892 WeakPolarHBondContact O-CB 3.06Å; D888-L892 VanDerWaalsContact O-CG 3.27Å; D888-L892 WeakPolarHBondContact O-CG 3.5Å; D888-L892 PolarHBondContact O-N 3.5Å; L892-A896 WeakPolarHBondContact O-CB 3.23Å; L892-A896 PolarHBondContact O-N 3.32Å; L892-H936 WeakPolarHBondContact CD2-ND1 3.27Å; L892-L939 HydrophobicContact CD1-CB 3.9Å; L892-L939 HydrophobicContact CD2-CB 4.2Å; L892-L939 HydrophobicContact CD2-CD1 4.3Å; L892-T943 WeakPolarHBondContact CD1-OG1 3.11Å
893	L	87.2	Confident	89.2	Confident	3 Å²	3	22.2 Å²	22.2	2%	0.016	12%	0.121	C	C	.	.	H	α-helix	trans	-78.4	-37	-178.8	-66.9	174.4	0	0	0	112.2	A889 F891 A896 L897 I944 F974 M1001	A889-L893 VanDerWaalsContact O-CB 3.29Å; A889-L893 WeakPolarHBondContact O-CB 3.28Å; A889-L893 WeakPolarHBondContact O-CG 3.39Å; A889-L893 PolarHBondContact O-N 3.2Å; F891-L893 VanDerWaalsContact C-N 3.3Å; F891-L893 PolarHBondContact O-N 3.12Å; L893-A896 PolarHBondContact O-N 3.02Å; L893-L897 WeakPolarHBondContact O-CB 3.34Å; L893-L897 WeakPolarHBondContact O-CG 3.37Å; L893-L897 PolarHBondContact O-N 3.47Å; L893-I944 HydrophobicContact CD1-CD1 3.93Å; L893-I944 HydrophobicContact CD1-CG1 3.52Å; L893-F974 HydrophobicContact CB-CD1 3.98Å; L893-F974 HydrophobicContact CB-CE1 3.32Å; L893-F974 HydrophobicContact CB-CE2 4.07Å; L893-F974 HydrophobicContact CB-CZ 3.39Å; L893-F974 HydrophobicContact CD1-CD1 4.36Å; L893-F974 HydrophobicContact CD1-CD2 3.94Å; L893-F974 HydrophobicContact CD1-CE1 4.27Å; L893-F974 HydrophobicContact CD1-CE2 3.81Å; L893-F974 HydrophobicContact CD1-CG 4.23Å; L893-F974 HydrophobicContact CD1-CZ 4.01Å; L893-F974 HydrophobicContact CG-CE1 4.46Å; L893-F974 HydrophobicContact CG-CZ 4.33Å; L893-M1001 HydrophobicContact CB-CE 4.23Å; L893-M1001 HydrophobicContact CD1-CE 3.36Å; L893-M1001 HydrophobicContact CD2-CE 3.23Å; L893-M1001 HydrophobicContact CD2-SD 4.08Å; L893-M1001 HydrophobicContact CG-CE 3.76Å
894	D	90.2	Very high	89.2	Confident	38 Å²	38	23.3 Å²	23.3	20%	0.203	13%	0.126	C	C	.	.	H	α-helix	trans	-64.3	-45	176.7	-164.2	30.5	0	0	0	111.1	I890 F891 L897 S898 Y973 R977	I890-D894 WeakPolarHBondContact O-CB 3.15Å; I890-D894 PolarHBondContact O-N 2.97Å; F891-D894 PolarHBondContact O-N 3.44Å; D894-L897 PolarHBondContact O-N 2.95Å; D894-S898 WeakPolarHBondContact O-CB 3.45Å; D894-S898 PolarHBondContact O-N 3.04Å; D894-Y973 PolarHBondContact OD1-OH 2.92Å; D894-Y973 PolarHBondContact OD2-OH 3.32Å; D894-R977 PolarHBondContact O-NH2 3.07Å; D894-R977 IonicContact OD1-CZ 3.02Å; D894-R977 IonicContact OD1-NH1 2.61Å; D894-R977 PolarHBondContact OD1-NH1 2.96Å; D894-R977 IonicContact OD1-NH2 3.42Å; D894-R977 PolarHBondContact OD1-NH2 2.99Å
895	E	89.9	Confident	89	Confident	64 Å²	64	26.5 Å²	26.5	30%	0.299	14%	0.14	S	C	.	.	H	α-helix	trans	-63.2	-46.7	176.6	-162.3	59.3	-147.7	0	0	111	F891 L897 S898 L899	F891-E895 HydrophobicContact CZ-CB 4.43Å; F891-E895 HydrophobicContact CZ-CG 4.35Å; F891-E895 VanDerWaalsContact O-CB 3.3Å; F891-E895 WeakPolarHBondContact O-CB 3.5Å; F891-E895 PolarHBondContact O-N 3.28Å; E895-L897 VanDerWaalsContact C-N 3.33Å; E895-L897 PolarHBondContact O-N 3.25Å; E895-S898 WeakPolarHBondContact O-CB 3.42Å; E895-S898 PolarHBondContact O-N 2.94Å; E895-L899 HydrophobicContact CG-CD1 4.15Å; E895-L899 WeakPolarHBondContact O-CB 3.1Å; E895-L899 VanDerWaalsContact O-CG 3.25Å; E895-L899 WeakPolarHBondContact O-CG 3.45Å; E895-L899 PolarHBondContact O-N 2.98Å
896	A	88	Confident	88.8	Confident	2 Å²	2	28.1 Å²	28.1	2%	0.017	15%	0.15	C	C	.	.	H	α-helix	trans	-54.4	-46.8	174.2	0	0	0	0	0	112.8	L892 L893 L899 L900 H936 I937	L892-A896 WeakPolarHBondContact O-CB 3.23Å; L892-A896 PolarHBondContact O-N 3.32Å; L893-A896 PolarHBondContact O-N 3.02Å; A896-L899 PolarHBondContact O-N 2.97Å; A896-L900 WeakPolarHBondContact O-CG 3.38Å; A896-L900 PolarHBondContact O-N 3.3Å; A896-H936 HydrophobicContact CB-CB 3.9Å; A896-I937 HydrophobicContact CB-CG1 3.63Å
897	L	86.5	Confident	88.6	Confident	2 Å²	2	29.5 Å²	29.5	1%	0.01	16%	0.157	C	C	.	.	H	α-helix	trans	-70.3	-34.7	-179.1	-67.4	174.9	0	0	0	111.7	L893 D894 E895 A901 F974 R977 L986 F996	L893-L897 WeakPolarHBondContact O-CB 3.34Å; L893-L897 WeakPolarHBondContact O-CG 3.37Å; L893-L897 PolarHBondContact O-N 3.47Å; D894-L897 PolarHBondContact O-N 2.95Å; E895-L897 VanDerWaalsContact C-N 3.33Å; E895-L897 PolarHBondContact O-N 3.25Å; L897-A901 PolarHBondContact O-N 2.87Å; L897-A901 VanDerWaalsContact O-N 3.13Å; L897-F974 HydrophobicContact CD1-CD1 4.02Å; L897-F974 HydrophobicContact CD1-CE1 4.24Å; L897-R977 VanDerWaalsContact CB-NH2 3.26Å; L897-R977 HydrophobicContact CD1-CB 4.43Å; L897-R977 HydrophobicContact CD1-CG 4.07Å; L897-L986 HydrophobicContact CB-CD2 3.98Å; L897-L986 HydrophobicContact CD2-CD1 3.58Å; L897-L986 HydrophobicContact CD2-CD2 3.56Å; L897-L986 HydrophobicContact CD2-CG 4.14Å; L897-L986 HydrophobicContact CG-CD2 4.33Å; L897-F996 HydrophobicContact CD2-CE2 4.18Å; L897-F996 HydrophobicContact CD2-CZ 4.16Å
898	S	89	Confident	88.5	Confident	59 Å²	59	34 Å²	34	41%	0.413	17%	0.172	S	C	.	.	H	α-helix	trans	-63.8	-49	173.2	-175.4	0	0	0	0	111.3	D894 E895 L900 A901 Q902	D894-S898 WeakPolarHBondContact O-CB 3.45Å; D894-S898 PolarHBondContact O-N 3.04Å; E895-S898 WeakPolarHBondContact O-CB 3.42Å; E895-S898 PolarHBondContact O-N 2.94Å; S898-L900 VanDerWaalsContact C-N 3.33Å; S898-L900 PolarHBondContact O-N 3.25Å; S898-A901 WeakPolarHBondContact O-CB 3.28Å; S898-A901 PolarHBondContact O-N 3.17Å; S898-A901 VanDerWaalsContact O-N 3.12Å; S898-Q902 PolarHBondContact O-N 3.42Å
899	L	90.3	Very high	88.3	Confident	9 Å²	9	37.8 Å²	37.8	5%	0.047	19%	0.189	C	C	.	.	H	α-helix	trans	-61.4	-39	177.3	-68	168.1	0	0	0	111.8	E895 A896 Q902 L903 T929 L932 A933	E895-L899 HydrophobicContact CG-CD1 4.15Å; E895-L899 WeakPolarHBondContact O-CB 3.1Å; E895-L899 VanDerWaalsContact O-CG 3.25Å; E895-L899 WeakPolarHBondContact O-CG 3.45Å; E895-L899 PolarHBondContact O-N 2.98Å; A896-L899 PolarHBondContact O-N 2.97Å; L899-Q902 PolarHBondContact O-N 3.29Å; L899-L903 WeakPolarHBondContact O-CB 3.47Å; L899-L903 VanDerWaalsContact O-CG 3.28Å; L899-L903 WeakPolarHBondContact O-CG 2.79Å; L899-L903 PolarHBondContact O-N 2.99Å; L899-T929 HydrophobicContact CD2-CG2 3.86Å; L899-L932 HydrophobicContact CD1-CB 4.44Å; L899-L932 HydrophobicContact CD1-CD2 4.07Å; L899-L932 HydrophobicContact CD1-CG 3.95Å; L899-L932 HydrophobicContact CD2-CD2 4.28Å; L899-A933 HydrophobicContact CB-CB 3.87Å; L899-A933 HydrophobicContact CD1-CB 4.38Å
900	L	88.8	Confident	88.1	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-63.3	-40.8	173.9	-79	171.9	0	0	0	112.7	A896 S898 Q902 L903 K904 I937 V988 Y994 F996	A896-L900 WeakPolarHBondContact O-CG 3.38Å; A896-L900 PolarHBondContact O-N 3.3Å; S898-L900 VanDerWaalsContact C-N 3.33Å; S898-L900 PolarHBondContact O-N 3.25Å; L900-Q902 VanDerWaalsContact C-N 3.34Å; L900-L903 PolarHBondContact O-N 3.48Å; L900-K904 WeakPolarHBondContact O-CB 3.16Å; L900-K904 PolarHBondContact O-N 3.28Å; L900-I937 HydrophobicContact CD1-CD1 3.8Å; L900-I937 HydrophobicContact CD1-CG1 4.42Å; L900-I937 HydrophobicContact CD2-CD1 4.04Å; L900-I937 HydrophobicContact CG-CD1 3.95Å; L900-V988 HydrophobicContact CD2-CG1 4.11Å; L900-V988 HydrophobicContact CD2-CG2 4Å; L900-Y994 HydrophobicContact CD2-CD2 4.32Å; L900-Y994 HydrophobicContact CD2-CG 4.44Å; L900-F996 HydrophobicContact CD1-CB 4.4Å; L900-F996 HydrophobicContact CD1-CD1 3.92Å; L900-F996 HydrophobicContact CD1-CD2 3.76Å; L900-F996 HydrophobicContact CD1-CE1 4.09Å; L900-F996 HydrophobicContact CD1-CE2 3.95Å; L900-F996 HydrophobicContact CD1-CG 3.76Å; L900-F996 HydrophobicContact CD1-CZ 4.11Å
901	A	87.6	Confident	87.8	Confident	41 Å²	41	43.3 Å²	43.3	34%	0.339	21%	0.214	S	C	.	.	H	α-helix	trans	-65.4	-40.6	176.4	0	0	0	0	0	111.2	L897 S898 Q905	L897-A901 PolarHBondContact O-N 2.87Å; L897-A901 VanDerWaalsContact O-N 3.13Å; S898-A901 WeakPolarHBondContact O-CB 3.28Å; S898-A901 PolarHBondContact O-N 3.17Å; S898-A901 VanDerWaalsContact O-N 3.12Å; A901-Q905 PolarHBondContact O-N 3.43Å
902	Q	88.7	Confident	87.5	Confident	107 Å²	107	49 Å²	49	50%	0.5	24%	0.238	S	C	.	.	H	α-helix	trans	-63.2	-49.1	174	-167.8	-179.4	30.9	0	0	111.2	S898 L899 L900 K904 Q905 T906	S898-Q902 PolarHBondContact O-N 3.42Å; L899-Q902 PolarHBondContact O-N 3.29Å; L900-Q902 VanDerWaalsContact C-N 3.34Å; Q902-K904 VanDerWaalsContact C-N 3.29Å; Q902-K904 PolarHBondContact O-N 3.35Å; Q902-Q905 WeakPolarHBondContact O-CA 3.45Å; Q902-Q905 WeakPolarHBondContact O-CB 3.28Å; Q902-Q905 PolarHBondContact O-N 3.01Å; Q902-T906 PolarHBondContact O-N 2.93Å; Q902-T906 PolarHBondContact O-OG1 3.41Å
903	L	88.8	Confident	87.2	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-55	-44.8	178	-80.3	167.7	0	0	0	111.7	L899 L900 Q905 T906 E907 F926 T929 A933 Y994	L899-L903 WeakPolarHBondContact O-CB 3.47Å; L899-L903 VanDerWaalsContact O-CG 3.28Å; L899-L903 WeakPolarHBondContact O-CG 2.79Å; L899-L903 PolarHBondContact O-N 2.99Å; L900-L903 PolarHBondContact O-N 3.48Å; L903-Q905 VanDerWaalsContact C-N 3.3Å; L903-Q905 PolarHBondContact O-N 2.83Å; L903-T906 VanDerWaalsContact CA-OG1 3.3Å; L903-T906 WeakPolarHBondContact CA-OG1 3.47Å; L903-T906 PolarHBondContact O-N 3.17Å; L903-T906 PolarHBondContact O-OG1 3.17Å; L903-E907 WeakPolarHBondContact O-CB 3.45Å; L903-E907 PolarHBondContact O-N 3.3Å; L903-F926 HydrophobicContact CD2-CD2 3.75Å; L903-F926 HydrophobicContact CD2-CE2 3.53Å; L903-F926 HydrophobicContact CD2-CZ 4.23Å; L903-T929 HydrophobicContact CD1-CG2 4.48Å; L903-T929 HydrophobicContact CD2-CG2 3.92Å; L903-T929 HydrophobicContact CG-CG2 3.9Å; L903-A933 HydrophobicContact CD1-CB 3.62Å; L903-Y994 HydrophobicContact CD1-CD1 4.12Å; L903-Y994 HydrophobicContact CD1-CE1 3.9Å
904	K	87.9	Confident	86.7	Confident	24 Å²	24	56 Å²	56	10%	0.104	30%	0.299	C	S	.	.	H	α-helix	trans	-60.8	-38.4	176.2	-175.6	-176.1	175.7	-163.4	0	112.6	L900 Q902 R908 R984 D985 V988	L900-K904 WeakPolarHBondContact O-CB 3.16Å; L900-K904 PolarHBondContact O-N 3.28Å; Q902-K904 VanDerWaalsContact C-N 3.29Å; Q902-K904 PolarHBondContact O-N 3.35Å; K904-R908 WeakPolarHBondContact O-CG 3.42Å; K904-R908 PolarHBondContact O-N 2.86Å; K904-R984 PolarHBondContact NZ-O 3.06Å; K904-D985 WeakPolarHBondContact CD-O 3.38Å; K904-V988 HydrophobicContact CB-CG1 4.02Å
905	Q	87.5	Confident	86	Confident	86 Å²	86	55.5 Å²	55.5	40%	0.402	30%	0.302	S	S	.	.	H	α-helix	trans	-68.4	-46.9	177.2	-179	59.1	23.5	0	0	110.9	A901 Q902 L903 E907 R908 E909	A901-Q905 PolarHBondContact O-N 3.43Å; Q902-Q905 WeakPolarHBondContact O-CA 3.45Å; Q902-Q905 WeakPolarHBondContact O-CB 3.28Å; Q902-Q905 PolarHBondContact O-N 3.01Å; L903-Q905 VanDerWaalsContact C-N 3.3Å; L903-Q905 PolarHBondContact O-N 2.83Å; Q905-E907 PolarHBondContact O-N 3.03Å; Q905-R908 WeakPolarHBondContact O-CB 3.09Å; Q905-R908 PolarHBondContact O-N 3.48Å; Q905-E909 PolarHBondContact NE2-OE1 3.15Å; Q905-E909 PolarHBondContact O-N 3.19Å
906	T	86.3	Confident	85.3	Confident	35 Å²	35	59.5 Å²	59.5	22%	0.215	31%	0.314	C	S	.	.	H	α-helix	trans	-64.5	-35	174.3	31.9	0	0	0	0	113.2	Q902 L903 R908 E909 R910	Q902-T906 PolarHBondContact O-N 2.93Å; Q902-T906 PolarHBondContact O-OG1 3.41Å; L903-T906 VanDerWaalsContact CA-OG1 3.3Å; L903-T906 WeakPolarHBondContact CA-OG1 3.47Å; L903-T906 PolarHBondContact O-N 3.17Å; L903-T906 PolarHBondContact O-OG1 3.17Å; T906-R908 VanDerWaalsContact C-N 3.33Å; T906-R908 PolarHBondContact O-N 3.07Å; T906-E909 PolarHBondContact O-N 3.31Å; T906-R910 WeakPolarHBondContact O-CB 3.48Å; T906-R910 PolarHBondContact O-N 3.1Å
907	E	85.5	Confident	84.9	Confident	30 Å²	30	60.6 Å²	60.6	14%	0.14	32%	0.32	C	S	.	.	H	α-helix	trans	-60.3	-43.3	173.4	-95.4	-173.7	170	0	0	110.9	L903 Q905 E909 R910 D911 F926 R989 Y994	L903-E907 WeakPolarHBondContact O-CB 3.45Å; L903-E907 PolarHBondContact O-N 3.3Å; Q905-E907 PolarHBondContact O-N 3.03Å; E907-E909 VanDerWaalsContact C-N 3.29Å; E907-E909 PolarHBondContact O-N 3.32Å; E907-R910 WeakPolarHBondContact O-CB 3.33Å; E907-R910 PolarHBondContact O-N 3.3Å; E907-D911 WeakPolarHBondContact O-CB 3.4Å; E907-D911 PolarHBondContact O-N 3.11Å; E907-F926 HydrophobicContact CG-CE2 3.91Å; E907-F926 HydrophobicContact CG-CZ 3.7Å; E907-R989 PolarHBondContact OE2-N 2.56Å; E907-Y994 PolarHBondContact OE1-OH 3.49Å
908	R	86	Confident	84.2	Confident	125 Å²	125	65.8 Å²	65.8	47%	0.472	36%	0.356	S	S	.	.	H	α-helix	trans	-63.7	-36.3	176.6	-73.6	169.6	172.8	173.4	-5	112.3	K904 Q905 T906 K912	K904-R908 WeakPolarHBondContact O-CG 3.42Å; K904-R908 PolarHBondContact O-N 2.86Å; Q905-R908 WeakPolarHBondContact O-CB 3.09Å; Q905-R908 PolarHBondContact O-N 3.48Å; T906-R908 VanDerWaalsContact C-N 3.33Å; T906-R908 PolarHBondContact O-N 3.07Å; R908-K912 VanDerWaalsContact O-CG 3.27Å; R908-K912 WeakPolarHBondContact O-CG 3.29Å; R908-K912 PolarHBondContact O-N 3.14Å; R908-K912 VanDerWaalsContact O-N 3.09Å
909	E	86.1	Confident	83.8	Confident	81 Å²	81	65 Å²	65	38%	0.379	35%	0.351	S	S	.	.	H	α-helix	trans	-69.8	-42.7	176.1	-71.7	168.8	-165.5	0	0	111	Q905 T906 E907 D911 K912 C913 L917	Q905-E909 PolarHBondContact NE2-OE1 3.15Å; Q905-E909 PolarHBondContact O-N 3.19Å; T906-E909 PolarHBondContact O-N 3.31Å; E907-E909 VanDerWaalsContact C-N 3.29Å; E907-E909 PolarHBondContact O-N 3.32Å; E909-D911 VanDerWaalsContact C-N 3.33Å; E909-D911 PolarHBondContact O-N 3.37Å; E909-K912 WeakPolarHBondContact O-CB 3.49Å; E909-K912 PolarHBondContact O-N 3.13Å; E909-C913 PolarHBondContact O-N 3.41Å; E909-C913 PolarHBondContact O-SG 2.87Å; E909-L917 HydrophobicContact CB-CD2 4.33Å
910	R	85.5	Confident	82.9	Confident	70 Å²	70	69.8 Å²	69.8	26%	0.264	39%	0.385	S	S	.	.	H	α-helix	trans	-58.5	-43.2	173.2	-171.7	175.1	-175.6	-96.1	3.9	112.1	T906 E907 C913 G914 G915 L917 E923	T906-R910 WeakPolarHBondContact O-CB 3.48Å; T906-R910 PolarHBondContact O-N 3.1Å; E907-R910 WeakPolarHBondContact O-CB 3.33Å; E907-R910 PolarHBondContact O-N 3.3Å; R910-C913 CarbonylContact O-C 3.54Å; R910-C913 PolarHBondContact O-N 2.89Å; R910-G914 PolarHBondContact O-N 3.42Å; R910-G915 PolarHBondContact NE-O 2.94Å; R910-G915 PolarHBondContact NH1-O 2.95Å; R910-G915 PolarHBondContact NH2-O 3.48Å; R910-G915 WeakPolarHBondContact O-CA 3.47Å; R910-G915 PolarHBondContact O-N 2.69Å; R910-L917 HydrophobicContact CB-CD2 4.08Å; R910-L917 HydrophobicContact CB-CG 4.08Å; R910-L917 HydrophobicContact CG-CG 4.25Å; R910-E923 IonicContact CZ-OE1 3.5Å; R910-E923 VanDerWaalsContact CZ-OE1 3.29Å; R910-E923 IonicContact NE-OE1 3.3Å; R910-E923 PolarHBondContact NE-OE1 3.37Å; R910-E923 IonicContact NE-OE2 3.24Å; R910-E923 PolarHBondContact NE-OE2 3.46Å; R910-E923 IonicContact NH2-OE1 3.1Å; R910-E923 PolarHBondContact NH2-OE1 3.08Å
911	D	84.1	Confident	82.2	Confident	85 Å²	85	73.8 Å²	73.8	46%	0.455	41%	0.413	S	S	.	.	H	α-helix	trans	-65.5	-40.3	176.3	-76.1	-17.7	0	0	0	111.8	E907 E909 C913 G914	E907-D911 WeakPolarHBondContact O-CB 3.4Å; E907-D911 PolarHBondContact O-N 3.11Å; E909-D911 VanDerWaalsContact C-N 3.33Å; E909-D911 PolarHBondContact O-N 3.37Å; D911-C913 PolarHBondContact O-N 2.64Å; D911-G914 PolarHBondContact O-N 3.24Å; D911-G914 VanDerWaalsContact O-N 3.09Å
912	K	85.7	Confident	81.8	Confident	169 Å²	169	75.2 Å²	75.2	74%	0.735	42%	0.415	S	S	*	.	H	α-helix	trans	-61.5	-32.4	173.9	-74.1	170.1	-174.2	175.5	0	112.3	R908 E909 G914	R908-K912 VanDerWaalsContact O-CG 3.27Å; R908-K912 WeakPolarHBondContact O-CG 3.29Å; R908-K912 PolarHBondContact O-N 3.14Å; R908-K912 VanDerWaalsContact O-N 3.09Å; E909-K912 WeakPolarHBondContact O-CB 3.49Å; E909-K912 PolarHBondContact O-N 3.13Å; K912-G914 VanDerWaalsContact C-N 3.26Å; K912-G914 PolarHBondContact O-N 3.14Å
913	C	80.7	Confident	81.4	Confident	75 Å²	75	72.1 Å²	72.1	51%	0.507	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.5	12.6	177	-67.8	0	0	0	0	113.8	E909 R910 D911 R916	E909-C913 PolarHBondContact O-N 3.41Å; E909-C913 PolarHBondContact O-SG 2.87Å; R910-C913 CarbonylContact O-C 3.54Å; R910-C913 PolarHBondContact O-N 2.89Å; D911-C913 PolarHBondContact O-N 2.64Å; C913-R916 WeakPolarHBondContact CB-O 3.43Å
914	G	77.9	Confident	80.6	Confident	75 Å²	75	75 Å²	75	77%	0.773	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.2	22.2	176.8	0	0	0	0	0	114.2	R910 D911 K912	R910-G914 PolarHBondContact O-N 3.42Å; D911-G914 PolarHBondContact O-N 3.24Å; D911-G914 VanDerWaalsContact O-N 3.09Å; K912-G914 VanDerWaalsContact C-N 3.26Å; K912-G914 PolarHBondContact O-N 3.14Å
915	G	76.1	Confident	80.3	Confident	26 Å²	26	78.7 Å²	78.7	27%	0.268	44%	0.444	S	S	.	.	S	Bend	trans	98.1	5.5	173.6	0	0	0	0	0	115.1	R910	R910-G915 PolarHBondContact NE-O 2.94Å; R910-G915 PolarHBondContact NH1-O 2.95Å; R910-G915 PolarHBondContact NH2-O 3.48Å; R910-G915 WeakPolarHBondContact O-CA 3.47Å; R910-G915 PolarHBondContact O-N 2.69Å
916	R	73.8	Confident	80.2	Confident	148 Å²	148	75.8 Å²	75.8	56%	0.558	43%	0.431	S	S	*	.	S	Bend	trans	-142.3	144.8	170.4	-98	-177.2	165.2	-178.4	-3.1	109.8	C913	C913-R916 WeakPolarHBondContact CB-O 3.43Å
917	L	79.2	Confident	79.8	Confident	25 Å²	25	76.1 Å²	76.1	13%	0.131	44%	0.437	C	S	.	.			trans	-69.9	154	172.8	-68.5	163.9	0	0	0	110.5	E909 R910 S919 D922 E923 F926	E909-L917 HydrophobicContact CB-CD2 4.33Å; R910-L917 HydrophobicContact CB-CD2 4.08Å; R910-L917 HydrophobicContact CB-CG 4.08Å; R910-L917 HydrophobicContact CG-CG 4.25Å; L917-S919 VanDerWaalsContact C-N 3.29Å; L917-S919 PolarHBondContact O-N 2.94Å; L917-D922 HydrophobicContact CB-CB 4.12Å; L917-D922 HydrophobicContact CD1-CB 4.03Å; L917-E923 WeakPolarHBondContact CB-OE2 3.36Å; L917-E923 PolarHBondContact N-OE2 3.41Å; L917-F926 HydrophobicContact CD1-CB 3.98Å
918	S	73.5	Confident	79.4	Confident	111 Å²	111	79.4 Å²	79.4	78%	0.776	45%	0.452	S	S	*	.	S	Bend	trans	-68.6	-27.1	-174.9	47.8	0	0	0	0	113.5
919	S	79.4	Confident	79.4	Confident	43 Å²	43	74.2 Å²	74.2	30%	0.301	43%	0.434	S	S	.	.	S	Bend	trans	-111	134.5	179.7	168.3	0	0	0	0	110.7	L917 S921 D922 E923	L917-S919 VanDerWaalsContact C-N 3.29Å; L917-S919 PolarHBondContact O-N 2.94Å; S919-S921 PolarHBondContact O-N 2.98Å; S919-S921 WeakPolarHBondContact OG-CB 3.5Å; S919-S921 PolarHBondContact OG-N 3.42Å; S919-D922 WeakPolarHBondContact CB-OD2 3.46Å; S919-D922 PolarHBondContact O-N 3Å; S919-D922 VanDerWaalsContact O-N 3.1Å; S919-E923 PolarHBondContact O-N 2.86Å; S919-E923 VanDerWaalsContact O-N 3.16Å
920	S	72.3	Confident	79.3	Confident	110 Å²	110	70.9 Å²	70.9	77%	0.769	42%	0.421	S	S	*	.	H	α-helix	trans	-61.8	-28	173.1	-175.1	0	0	0	0	112.5	A924	S920-A924 PolarHBondContact O-N 2.94Å
921	S	74.3	Confident	79	Confident	84 Å²	84	74.1 Å²	74.1	59%	0.587	43%	0.433	S	S	*	.	H	α-helix	trans	-68.8	-38.7	175	-172.1	0	0	0	0	111.1	S919 A924 L925	S919-S921 PolarHBondContact O-N 2.98Å; S919-S921 WeakPolarHBondContact OG-CB 3.5Å; S919-S921 PolarHBondContact OG-N 3.42Å; S921-A924 PolarHBondContact O-N 2.67Å; S921-L925 WeakPolarHBondContact O-CB 3.29Å; S921-L925 PolarHBondContact O-N 3.23Å
922	D	79.2	Confident	78.9	Confident	70 Å²	70	72 Å²	72	37%	0.374	42%	0.422	S	S	.	.	H	α-helix	trans	-72.4	-36.6	-177.3	-60.1	-5.8	0	0	0	110.7	L917 S919 L925 F926	L917-D922 HydrophobicContact CB-CB 4.12Å; L917-D922 HydrophobicContact CD1-CB 4.03Å; S919-D922 WeakPolarHBondContact CB-OD2 3.46Å; S919-D922 PolarHBondContact O-N 3Å; S919-D922 VanDerWaalsContact O-N 3.1Å; D922-L925 PolarHBondContact O-N 3.27Å; D922-F926 WeakPolarHBondContact O-CB 3.5Å; D922-F926 PolarHBondContact O-N 2.97Å
923	E	79.3	Confident	79	Confident	42 Å²	42	64 Å²	64	20%	0.196	39%	0.387	C	S	.	.	H	α-helix	trans	-65.7	-39.3	173.2	-164.4	77.1	-169	0	0	111.6	R910 L917 S919 F926 A927	R910-E923 IonicContact CZ-OE1 3.5Å; R910-E923 VanDerWaalsContact CZ-OE1 3.29Å; R910-E923 IonicContact NE-OE1 3.3Å; R910-E923 PolarHBondContact NE-OE1 3.37Å; R910-E923 IonicContact NE-OE2 3.24Å; R910-E923 PolarHBondContact NE-OE2 3.46Å; R910-E923 IonicContact NH2-OE1 3.1Å; R910-E923 PolarHBondContact NH2-OE1 3.08Å; L917-E923 WeakPolarHBondContact CB-OE2 3.36Å; L917-E923 PolarHBondContact N-OE2 3.41Å; S919-E923 PolarHBondContact O-N 2.86Å; S919-E923 VanDerWaalsContact O-N 3.16Å; E923-F926 PolarHBondContact O-N 3.39Å; E923-A927 PolarHBondContact O-N 3.29Å
924	A	72	Confident	79.2	Confident	60 Å²	60	63 Å²	63	50%	0.496	37%	0.373	S	S	.	.	H	α-helix	trans	-65.5	-40	174.9	0	0	0	0	0	112	S920 S921 A927 H928	S920-A924 PolarHBondContact O-N 2.94Å; S921-A924 PolarHBondContact O-N 2.67Å; A924-A927 PolarHBondContact O-N 3.34Å; A924-H928 WeakPolarHBondContact O-CB 3.42Å; A924-H928 PolarHBondContact O-N 2.68Å
925	L	81.5	Confident	79.4	Confident	102 Å²	102	62.1 Å²	62.1	53%	0.534	35%	0.349	S	S	.	.	H	α-helix	trans	-63.2	-46.7	174.1	-176.3	63.4	0	0	0	110.9	S921 D922 A927 H928 T929	S921-L925 WeakPolarHBondContact O-CB 3.29Å; S921-L925 PolarHBondContact O-N 3.23Å; D922-L925 PolarHBondContact O-N 3.27Å; L925-A927 VanDerWaalsContact C-N 3.34Å; L925-A927 PolarHBondContact O-N 3.05Å; L925-H928 WeakPolarHBondContact O-CB 3.5Å; L925-H928 PolarHBondContact O-N 3.49Å; L925-H928 VanDerWaalsContact O-N 3.08Å; L925-T929 PolarHBondContact O-N 2.9Å; L925-T929 PolarHBondContact O-OG1 2.68Å
926	F	85.2	Confident	79.9	Confident	26 Å²	26	61 Å²	61	11%	0.114	34%	0.336	C	S	.	.	H	α-helix	trans	-55.7	-46.8	176	175.4	-102	0	0	0	112.2	L903 E907 L917 D922 E923 H928 T929 G930	L903-F926 HydrophobicContact CD2-CD2 3.75Å; L903-F926 HydrophobicContact CD2-CE2 3.53Å; L903-F926 HydrophobicContact CD2-CZ 4.23Å; E907-F926 HydrophobicContact CG-CE2 3.91Å; E907-F926 HydrophobicContact CG-CZ 3.7Å; L917-F926 HydrophobicContact CD1-CB 3.98Å; D922-F926 WeakPolarHBondContact O-CB 3.5Å; D922-F926 PolarHBondContact O-N 2.97Å; E923-F926 PolarHBondContact O-N 3.39Å; F926-H928 VanDerWaalsContact C-N 3.34Å; F926-H928 PolarHBondContact O-N 3.32Å; F926-T929 PolarHBondContact O-N 3.44Å; F926-G930 PolarHBondContact O-N 3.13Å
927	A	79.1	Confident	80.5	Confident	42 Å²	42	54.3 Å²	54.3	35%	0.347	31%	0.311	S	S	.	.	H	α-helix	trans	-64.4	-37.3	176.3	0	0	0	0	0	112.6	E923 A924 L925 G930 R931	E923-A927 PolarHBondContact O-N 3.29Å; A924-A927 PolarHBondContact O-N 3.34Å; L925-A927 VanDerWaalsContact C-N 3.34Å; L925-A927 PolarHBondContact O-N 3.05Å; A927-G930 PolarHBondContact O-N 3.36Å; A927-R931 PolarHBondContact O-N 3.11Å; A927-R931 VanDerWaalsContact O-N 3.15Å
928	H	77.8	Confident	80.7	Confident	99 Å²	99	55.4 Å²	55.4	46%	0.458	32%	0.317	S	S	.	.	H	α-helix	trans	-65.5	-48.7	175.1	176.8	66.1	0	0	0	112	A924 L925 F926 G930 R931 L932	A924-H928 WeakPolarHBondContact O-CB 3.42Å; A924-H928 PolarHBondContact O-N 2.68Å; L925-H928 WeakPolarHBondContact O-CB 3.5Å; L925-H928 PolarHBondContact O-N 3.49Å; L925-H928 VanDerWaalsContact O-N 3.08Å; F926-H928 VanDerWaalsContact C-N 3.34Å; F926-H928 PolarHBondContact O-N 3.32Å; H928-G930 PolarHBondContact O-N 3.14Å; H928-R931 PolarHBondContact O-N 3.43Å; H928-R931 VanDerWaalsContact O-N 3.13Å; H928-L932 PolarHBondContact O-N 3Å
929	T	84.9	Confident	81.2	Confident	16 Å²	16	50.4 Å²	50.4	10%	0.098	28%	0.281	C	S	.	.	H	α-helix	trans	-56.9	-39.9	174	-54.5	0	0	0	0	111.2	L899 L903 L925 F926 R931 L932 A933	L899-T929 HydrophobicContact CD2-CG2 3.86Å; L903-T929 HydrophobicContact CD1-CG2 4.48Å; L903-T929 HydrophobicContact CD2-CG2 3.92Å; L903-T929 HydrophobicContact CG-CG2 3.9Å; L925-T929 PolarHBondContact O-N 2.9Å; L925-T929 PolarHBondContact O-OG1 2.68Å; F926-T929 PolarHBondContact O-N 3.44Å; T929-R931 PolarHBondContact O-N 3.44Å; T929-L932 PolarHBondContact O-N 3.33Å; T929-A933 WeakPolarHBondContact O-CB 3.33Å; T929-A933 PolarHBondContact O-N 3.39Å
930	G	84.9	Confident	81.6	Confident	10 Å²	10	48.3 Å²	48.3	10%	0.103	27%	0.267	C	S	.	.	H	α-helix	trans	-59.4	-44.9	175.3	0	0	0	0	0	113.4	F926 A927 H928 R934	F926-G930 PolarHBondContact O-N 3.13Å; A927-G930 PolarHBondContact O-N 3.36Å; H928-G930 PolarHBondContact O-N 3.14Å; G930-R934 PolarHBondContact O-N 3.41Å; G930-R934 VanDerWaalsContact O-N 3.1Å
931	R	79	Confident	82.3	Confident	138 Å²	138	43.4 Å²	43.4	52%	0.521	23%	0.232	S	C	.	.	H	α-helix	trans	-66.6	-42.4	176.2	-71.6	-173.2	-66	-93.6	-2.3	112.1	A927 H928 T929 R934 H935	A927-R931 PolarHBondContact O-N 3.11Å; A927-R931 VanDerWaalsContact O-N 3.15Å; H928-R931 PolarHBondContact O-N 3.43Å; H928-R931 VanDerWaalsContact O-N 3.13Å; T929-R931 PolarHBondContact O-N 3.44Å; R931-R934 PolarHBondContact O-N 2.85Å; R931-H935 PolarHBondContact O-N 3.09Å
932	L	82.2	Confident	82.8	Confident	41 Å²	41	40 Å²	40	22%	0.215	21%	0.207	C	C	.	.	H	α-helix	trans	-62.8	-46.3	178.1	-171.6	64.8	0	0	0	110.9	L899 H928 T929 R934 H935 H936	L899-L932 HydrophobicContact CD1-CB 4.44Å; L899-L932 HydrophobicContact CD1-CD2 4.07Å; L899-L932 HydrophobicContact CD1-CG 3.95Å; L899-L932 HydrophobicContact CD2-CD2 4.28Å; H928-L932 PolarHBondContact O-N 3Å; T929-L932 PolarHBondContact O-N 3.33Å; L932-R934 VanDerWaalsContact C-N 3.34Å; L932-R934 PolarHBondContact O-N 2.94Å; L932-H935 WeakPolarHBondContact O-CB 3.46Å; L932-H935 PolarHBondContact O-N 3.32Å; L932-H935 VanDerWaalsContact O-N 3.11Å; L932-H936 WeakPolarHBondContact CD1-NE2 3.35Å; L932-H936 PolarHBondContact O-CD2 3.02Å; L932-H936 PolarHBondContact O-N 3.07Å
933	A	86.6	Confident	83.4	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-56.2	-48.1	175.2	0	0	0	0	0	111.2	L899 L903 T929 H935 H936 I937	L899-A933 HydrophobicContact CB-CB 3.87Å; L899-A933 HydrophobicContact CD1-CB 4.38Å; L903-A933 HydrophobicContact CD1-CB 3.62Å; T929-A933 WeakPolarHBondContact O-CB 3.33Å; T929-A933 PolarHBondContact O-N 3.39Å; A933-H935 VanDerWaalsContact C-N 3.3Å; A933-H935 PolarHBondContact O-N 3.4Å; A933-H936 PolarHBondContact O-N 3.27Å; A933-I937 HydrophobicContact CB-CD1 4.44Å; A933-I937 WeakPolarHBondContact O-CB 3.33Å; A933-I937 VanDerWaalsContact O-CD1 3.28Å; A933-I937 WeakPolarHBondContact O-CD1 3.38Å; A933-I937 WeakPolarHBondContact O-CG1 3.46Å; A933-I937 PolarHBondContact O-N 3.4Å
934	R	84.6	Confident	84	Confident	55 Å²	55	34.7 Å²	34.7	21%	0.208	18%	0.18	C	C	.	.	H	α-helix	trans	-56.9	-44	176.6	-177.4	176.3	-179.4	123.5	-2.8	112	N707 G930 R931 L932 I937 M938 A993 Y994	N707-R934 PolarHBondContact OD1-NH2 3.15Å; G930-R934 PolarHBondContact O-N 3.41Å; G930-R934 VanDerWaalsContact O-N 3.1Å; R931-R934 PolarHBondContact O-N 2.85Å; L932-R934 VanDerWaalsContact C-N 3.34Å; L932-R934 PolarHBondContact O-N 2.94Å; R934-I937 PolarHBondContact O-N 3.02Å; R934-M938 HydrophobicContact CG-CG 4.49Å; R934-M938 HydrophobicContact CG-SD 4.16Å; R934-M938 WeakPolarHBondContact O-CB 3.38Å; R934-M938 VanDerWaalsContact O-CG 3.32Å; R934-M938 WeakPolarHBondContact O-CG 3.49Å; R934-M938 PolarHBondContact O-N 3.39Å; R934-A993 PolarHBondContact NH1-O 3.2Å; R934-Y994 WeakPolarHBondContact CA-O 3.3Å
935	H	81.9	Confident	84.8	Confident	57 Å²	57	32 Å²	32	26%	0.264	16%	0.157	S	C	.	.	H	α-helix	trans	-60.4	-51.8	179.2	-176.1	64.9	0	0	0	112	H837 R931 L932 A933 I937 M938 L939	H837-H935 AromaticContact CE1-CE1 3.62Å; H837-H935 AromaticContact CE1-NE2 3.63Å; H837-H935 AromaticContact ND1-CE1 3.87Å; R931-H935 PolarHBondContact O-N 3.09Å; L932-H935 WeakPolarHBondContact O-CB 3.46Å; L932-H935 PolarHBondContact O-N 3.32Å; L932-H935 VanDerWaalsContact O-N 3.11Å; A933-H935 VanDerWaalsContact C-N 3.3Å; A933-H935 PolarHBondContact O-N 3.4Å; H935-I937 PolarHBondContact O-N 3.4Å; H935-M938 PolarHBondContact O-N 3.19Å; H935-L939 VanDerWaalsContact CE1-CD1 3.42Å; H935-L939 WeakPolarHBondContact CE1-CD1 3.5Å; H935-L939 WeakPolarHBondContact NE2-CD1 3.39Å; H935-L939 PolarHBondContact O-N 2.98Å
936	H	86.7	Confident	85.2	Confident	1 Å²	1	27.2 Å²	27.2	1%	0.005	13%	0.132	C	C	.	.	H	α-helix	trans	-65.2	-38.3	179.3	-70.1	-67.5	0	0	0	113	L892 A896 L932 A933 G940	L892-H936 WeakPolarHBondContact CD2-ND1 3.27Å; A896-H936 HydrophobicContact CB-CB 3.9Å; L932-H936 WeakPolarHBondContact CD1-NE2 3.35Å; L932-H936 PolarHBondContact O-CD2 3.02Å; L932-H936 PolarHBondContact O-N 3.07Å; A933-H936 PolarHBondContact O-N 3.27Å; H936-G940 WeakPolarHBondContact O-CA 3.3Å; H936-G940 PolarHBondContact O-N 3.42Å
937	I	87.6	Confident	85.6	Confident	8 Å²	8	26 Å²	26	4%	0.041	13%	0.127	C	C	.	.	H	α-helix	trans	-61.1	-47.9	176.4	-70.4	162.2	0	0	0	110.5	A896 L900 A933 R934 H935 G940 L941 G995 F996	A896-I937 HydrophobicContact CB-CG1 3.63Å; L900-I937 HydrophobicContact CD1-CD1 3.8Å; L900-I937 HydrophobicContact CD1-CG1 4.42Å; L900-I937 HydrophobicContact CD2-CD1 4.04Å; L900-I937 HydrophobicContact CG-CD1 3.95Å; A933-I937 HydrophobicContact CB-CD1 4.44Å; A933-I937 WeakPolarHBondContact O-CB 3.33Å; A933-I937 VanDerWaalsContact O-CD1 3.28Å; A933-I937 WeakPolarHBondContact O-CD1 3.38Å; A933-I937 WeakPolarHBondContact O-CG1 3.46Å; A933-I937 PolarHBondContact O-N 3.4Å; R934-I937 PolarHBondContact O-N 3.02Å; H935-I937 PolarHBondContact O-N 3.4Å; I937-G940 PolarHBondContact O-N 3.32Å; I937-L941 WeakPolarHBondContact O-CB 3.39Å; I937-L941 PolarHBondContact O-N 2.85Å; I937-G995 WeakPolarHBondContact CG2-O 3.49Å; I937-F996 HydrophobicContact CD1-CB 4.12Å; I937-F996 HydrophobicContact CD1-CD2 4.33Å; I937-F996 HydrophobicContact CG1-CD2 4.44Å; I937-F996 HydrophobicContact CG2-CB 4.43Å; I937-F996 HydrophobicContact CG2-CD2 4.13Å
938	M	82.1	Confident	86.2	Confident	49 Å²	49	26.1 Å²	26.1	24%	0.241	12%	0.119	C	C	.	.	H	α-helix	trans	-62.5	-50.1	-179	-74	-175.2	69.4	0	0	111	W706 R934 H935 G940 L941 D942	W706-M938 HydrophobicContact CE3-CE 4.47Å; W706-M938 HydrophobicContact CZ3-CB 4.44Å; W706-M938 WeakPolarHBondContact CZ3-O 3.35Å; R934-M938 HydrophobicContact CG-CG 4.49Å; R934-M938 HydrophobicContact CG-SD 4.16Å; R934-M938 WeakPolarHBondContact O-CB 3.38Å; R934-M938 VanDerWaalsContact O-CG 3.32Å; R934-M938 WeakPolarHBondContact O-CG 3.49Å; R934-M938 PolarHBondContact O-N 3.39Å; H935-M938 PolarHBondContact O-N 3.19Å; M938-G940 PolarHBondContact O-N 2.87Å; M938-L941 PolarHBondContact O-N 3.06Å; M938-D942 PolarHBondContact O-N 3.41Å
939	L	84	Confident	86.8	Confident	5 Å²	5	22.9 Å²	22.9	3%	0.026	10%	0.102	C	C	.	.	H	α-helix	trans	-64.4	-39.9	178.6	-72.7	173.1	0	0	0	112.9	F836 R840 L892 H935 L941 D942 T943	F836-L939 HydrophobicContact CB-CD1 3.67Å; F836-L939 HydrophobicContact CG-CD1 4.36Å; R840-L939 HydrophobicContact CB-CD2 4.09Å; R840-L939 HydrophobicContact CG-CD2 4.46Å; L892-L939 HydrophobicContact CD1-CB 3.9Å; L892-L939 HydrophobicContact CD2-CB 4.2Å; L892-L939 HydrophobicContact CD2-CD1 4.3Å; H935-L939 VanDerWaalsContact CE1-CD1 3.42Å; H935-L939 WeakPolarHBondContact CE1-CD1 3.5Å; H935-L939 WeakPolarHBondContact NE2-CD1 3.39Å; H935-L939 PolarHBondContact O-N 2.98Å; L939-L941 VanDerWaalsContact C-N 3.34Å; L939-L941 PolarHBondContact O-N 3.01Å; L939-D942 PolarHBondContact O-N 3.33Å; L939-T943 WeakPolarHBondContact O-CB 3.27Å; L939-T943 PolarHBondContact O-N 3.48Å; L939-T943 PolarHBondContact O-OG1 3.47Å
940	G	89.2	Confident	87.1	Confident	0 Å²	0	22.3 Å²	22.3	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-64.3	-39.9	179.1	0	0	0	0	0	111.9	H936 I937 M938 T943 I944	H936-G940 WeakPolarHBondContact O-CA 3.3Å; H936-G940 PolarHBondContact O-N 3.42Å; I937-G940 PolarHBondContact O-N 3.32Å; M938-G940 PolarHBondContact O-N 2.87Å; G940-T943 PolarHBondContact O-N 3.16Å; G940-I944 PolarHBondContact O-N 3.41Å
941	L	86.5	Confident	87.3	Confident	7 Å²	7	21.9 Å²	21.9	4%	0.037	9%	0.094	C	C	.	.	H	α-helix	trans	-67.4	-38.4	173.5	-175.3	63.1	0	0	0	111.5	W706 I937 M938 L939 T943 I944 A945 I1000 M1001 E1004	W706-L941 HydrophobicContact CE3-CD2 4.12Å; W706-L941 HydrophobicContact CH2-CB 3.36Å; W706-L941 HydrophobicContact CH2-CD2 3.29Å; W706-L941 HydrophobicContact CH2-CG 3.16Å; W706-L941 HydrophobicContact CZ2-CB 4.35Å; W706-L941 HydrophobicContact CZ2-CD2 3.65Å; W706-L941 HydrophobicContact CZ2-CG 3.68Å; W706-L941 HydrophobicContact CZ3-CB 3.68Å; W706-L941 HydrophobicContact CZ3-CD2 3.52Å; W706-L941 HydrophobicContact CZ3-CG 3.78Å; I937-L941 WeakPolarHBondContact O-CB 3.39Å; I937-L941 PolarHBondContact O-N 2.85Å; M938-L941 PolarHBondContact O-N 3.06Å; L939-L941 VanDerWaalsContact C-N 3.34Å; L939-L941 PolarHBondContact O-N 3.01Å; L941-T943 VanDerWaalsContact C-N 3.29Å; L941-T943 PolarHBondContact O-N 3.07Å; L941-I944 PolarHBondContact O-N 2.88Å; L941-A945 VanDerWaalsContact O-CB 3.32Å; L941-A945 WeakPolarHBondContact O-CB 3.45Å; L941-A945 PolarHBondContact O-N 3.32Å; L941-I1000 HydrophobicContact CD1-CG2 4.15Å; L941-I1000 HydrophobicContact CD2-CB 4.49Å; L941-I1000 HydrophobicContact CD2-CG2 4.17Å; L941-M1001 HydrophobicContact CD1-CB 4.2Å; L941-M1001 HydrophobicContact CD1-CG 4.25Å; L941-E1004 HydrophobicContact CD1-CG 4.45Å
942	D	85.3	Confident	87.8	Confident	13 Å²	13	18 Å²	18	7%	0.07	9%	0.086	C	C	.	.	H	α-helix	trans	-64.1	-38.5	175.6	-82.1	-23.5	0	0	0	111.7	W706 Y843 R847 M938 L939 A945 T946	W706-D942 HydrophobicContact CH2-CB 4.45Å; W706-D942 WeakPolarHBondContact CH2-OD1 3.31Å; W706-D942 VanDerWaalsContact CZ2-OD1 3.31Å; W706-D942 WeakPolarHBondContact CZ2-OD1 3.32Å; Y843-D942 HydrophobicContact CD2-CB 4.2Å; Y843-D942 HydrophobicContact CG-CB 4.43Å; R847-D942 IonicContact CZ-OD1 3.44Å; R847-D942 IonicContact NH2-OD1 2.97Å; R847-D942 PolarHBondContact NH2-OD1 3.25Å; R847-D942 IonicContact NH2-OD2 2.97Å; M938-D942 PolarHBondContact O-N 3.41Å; L939-D942 PolarHBondContact O-N 3.33Å; D942-A945 PolarHBondContact O-N 3.32Å; D942-T946 VanDerWaalsContact O-CB 3.26Å; D942-T946 WeakPolarHBondContact O-CB 3.38Å; D942-T946 PolarHBondContact O-N 3.12Å; D942-T946 PolarHBondContact O-OG1 3.48Å
943	T	90.8	Very high	88	Confident	0 Å²	0	17.6 Å²	17.6	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-65.6	-47.8	178	-54	0	0	0	0	110.5	Y843 L885 D888 A889 L892 L939 G940 L941 T946 L947	Y843-T943 PolarHBondContact OH-OG1 3.32Å; L885-T943 HydrophobicContact CD1-CG2 3.69Å; L885-T943 HydrophobicContact CG-CG2 4.17Å; D888-T943 HydrophobicContact CB-CG2 4.14Å; A889-T943 HydrophobicContact CB-CG2 3.85Å; L892-T943 WeakPolarHBondContact CD1-OG1 3.11Å; L939-T943 WeakPolarHBondContact O-CB 3.27Å; L939-T943 PolarHBondContact O-N 3.48Å; L939-T943 PolarHBondContact O-OG1 3.47Å; G940-T943 PolarHBondContact O-N 3.16Å; L941-T943 VanDerWaalsContact C-N 3.29Å; L941-T943 PolarHBondContact O-N 3.07Å; T943-T946 WeakPolarHBondContact O-CB 3.18Å; T943-T946 PolarHBondContact O-N 3.29Å; T943-L947 WeakPolarHBondContact O-CB 3.44Å; T943-L947 PolarHBondContact O-N 3.22Å
944	I	91.4	Very high	88	Confident	0 Å²	0	17.6 Å²	17.6	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-64.7	-42.1	176.3	-70.7	-62.8	0	0	0	111.8	A889 L893 G940 L941 T946 L947 R948 M970 E1004 I1005 I1008	A889-I944 HydrophobicContact CB-CD1 3.95Å; L893-I944 HydrophobicContact CD1-CD1 3.93Å; L893-I944 HydrophobicContact CD1-CG1 3.52Å; G940-I944 PolarHBondContact O-N 3.41Å; L941-I944 PolarHBondContact O-N 2.88Å; I944-T946 VanDerWaalsContact C-N 3.29Å; I944-T946 PolarHBondContact O-N 3.41Å; I944-L947 HydrophobicContact CD1-CD2 4.42Å; I944-L947 WeakPolarHBondContact O-CB 3.25Å; I944-L947 PolarHBondContact O-N 2.88Å; I944-R948 PolarHBondContact O-N 3.37Å; I944-M970 HydrophobicContact CD1-CE 4.33Å; I944-E1004 HydrophobicContact CG2-CB 3.8Å; I944-I1005 HydrophobicContact CG2-CG1 4.28Å; I944-I1008 HydrophobicContact CG2-CD1 4.21Å
945	A	90	Very high	88.1	Confident	3 Å²	3	16.1 Å²	16.1	3%	0.025	8%	0.082	C	C	.	.	H	α-helix	trans	-63.3	-39.3	177	0	0	0	0	0	111.4	L941 D942 R948 R949 E1004	L941-A945 VanDerWaalsContact O-CB 3.32Å; L941-A945 WeakPolarHBondContact O-CB 3.45Å; L941-A945 PolarHBondContact O-N 3.32Å; D942-A945 PolarHBondContact O-N 3.32Å; A945-R948 PolarHBondContact O-N 3.38Å; A945-R949 VanDerWaalsContact O-CG 3.25Å; A945-R949 WeakPolarHBondContact O-CG 3.5Å; A945-R949 PolarHBondContact O-N 2.7Å; A945-E1004 WeakPolarHBondContact CA-OE2 3.48Å
946	T	90.6	Very high	88.3	Confident	1 Å²	1	18.5 Å²	18.5	1%	0.006	9%	0.093	C	C	.	.	H	α-helix	trans	-63.7	-45.4	173.3	-61.2	0	0	0	0	111.1	Y843 L846 L885 D942 T943 I944 R948 R949 V950	Y843-T946 HydrophobicContact CD1-CG2 4.1Å; Y843-T946 HydrophobicContact CE1-CG2 4.42Å; L846-T946 HydrophobicContact CB-CG2 4.15Å; L846-T946 HydrophobicContact CD1-CG2 3.52Å; L846-T946 HydrophobicContact CG-CG2 4.42Å; L885-T946 HydrophobicContact CD1-CG2 4.47Å; L885-T946 HydrophobicContact CD2-CG2 4.32Å; D942-T946 VanDerWaalsContact O-CB 3.26Å; D942-T946 WeakPolarHBondContact O-CB 3.38Å; D942-T946 PolarHBondContact O-N 3.12Å; D942-T946 PolarHBondContact O-OG1 3.48Å; T943-T946 WeakPolarHBondContact O-CB 3.18Å; T943-T946 PolarHBondContact O-N 3.29Å; I944-T946 VanDerWaalsContact C-N 3.29Å; I944-T946 PolarHBondContact O-N 3.41Å; T946-R948 VanDerWaalsContact C-N 3.34Å; T946-R948 PolarHBondContact O-N 2.81Å; T946-R949 WeakPolarHBondContact O-CB 3.36Å; T946-R949 PolarHBondContact O-N 3.43Å; T946-R949 VanDerWaalsContact O-N 3.15Å; T946-V950 HydrophobicContact CG2-CG2 4.45Å; T946-V950 WeakPolarHBondContact O-CG2 3.33Å; T946-V950 PolarHBondContact O-N 3.25Å
947	L	92.4	Very high	88.4	Confident	1 Å²	1	18.5 Å²	18.5	1%	0.005	9%	0.093	C	C	.	.	H	α-helix	trans	-58.6	-45.7	176.6	-178	65.1	0	0	0	111.2	L885 V886 T943 I944 R949 V950 I951 M970 I1008	L885-L947 HydrophobicContact CD2-CB 4.06Å; L885-L947 HydrophobicContact CD2-CD1 3.92Å; V886-L947 HydrophobicContact CG2-CD1 4.49Å; T943-L947 WeakPolarHBondContact O-CB 3.44Å; T943-L947 PolarHBondContact O-N 3.22Å; I944-L947 HydrophobicContact CD1-CD2 4.42Å; I944-L947 WeakPolarHBondContact O-CB 3.25Å; I944-L947 PolarHBondContact O-N 2.88Å; L947-R949 PolarHBondContact O-N 3.23Å; L947-V950 PolarHBondContact O-N 3.45Å; L947-I951 HydrophobicContact CD1-CD1 3.84Å; L947-I951 HydrophobicContact CD1-CG1 4.22Å; L947-I951 HydrophobicContact CD2-CD1 4.29Å; L947-I951 HydrophobicContact CG-CD1 3.62Å; L947-I951 HydrophobicContact CG-CG1 4.37Å; L947-I951 WeakPolarHBondContact O-CB 3.4Å; L947-I951 VanDerWaalsContact O-CG1 3.22Å; L947-I951 WeakPolarHBondContact O-CG1 3.25Å; L947-I951 PolarHBondContact O-N 3.2Å; L947-M970 HydrophobicContact CD2-CE 3.63Å; L947-M970 HydrophobicContact CD2-SD 4.39Å; L947-I1008 HydrophobicContact CD2-CD1 4.39Å; L947-I1008 HydrophobicContact CG-CD1 4.48Å
948	R	91.8	Very high	88.4	Confident	45 Å²	45	18.1 Å²	18.1	17%	0.17	9%	0.091	C	C	.	.	H	α-helix	trans	-57.8	-46.4	174.4	-177.4	-177.5	57.6	80	-6.6	112	I944 A945 T946 V950 I951 T952 E1004 A1007 I1008 I1011	I944-R948 PolarHBondContact O-N 3.37Å; A945-R948 PolarHBondContact O-N 3.38Å; T946-R948 VanDerWaalsContact C-N 3.34Å; T946-R948 PolarHBondContact O-N 2.81Å; R948-V950 PolarHBondContact O-N 3.08Å; R948-I951 PolarHBondContact O-N 3.42Å; R948-T952 WeakPolarHBondContact O-CB 3.3Å; R948-T952 PolarHBondContact O-N 3.35Å; R948-T952 PolarHBondContact O-OG1 2.92Å; R948-E1004 WeakPolarHBondContact CD-OE2 3.36Å; R948-E1004 IonicContact CZ-OE1 3.41Å; R948-E1004 IonicContact CZ-OE2 2.85Å; R948-E1004 VanDerWaalsContact NE-CD 3.33Å; R948-E1004 IonicContact NE-OE1 3.03Å; R948-E1004 PolarHBondContact NE-OE1 3.2Å; R948-E1004 IonicContact NE-OE2 3.71Å; R948-E1004 PolarHBondContact NE-OE2 3.36Å; R948-E1004 IonicContact NH2-OE1 3.6Å; R948-E1004 PolarHBondContact NH2-OE1 2.93Å; R948-E1004 IonicContact NH2-OE2 3.84Å; R948-E1004 PolarHBondContact NH2-OE2 2.85Å; R948-A1007 VanDerWaalsContact CD-CB 3.49Å; R948-A1007 HydrophobicContact CG-CB 4.48Å; R948-I1008 HydrophobicContact CB-CD1 4.01Å; R948-I1008 HydrophobicContact CB-CG1 3.65Å; R948-I1008 HydrophobicContact CG-CG1 3.91Å; R948-I1011 HydrophobicContact CG-CD1 4.28Å
949	R	90.3	Very high	88.7	Confident	31 Å²	31	16.2 Å²	16.2	12%	0.117	8%	0.082	C	C	.	.	H	α-helix	trans	-59.2	-46.9	179.9	-72.5	172	-164.9	120.8	5.4	111.2	Y850 A945 T946 L947 T952 L953	Y850-R949 HydrophobicContact CD1-CG 4.03Å; Y850-R949 HydrophobicContact CD2-CB 3.41Å; Y850-R949 VanDerWaalsContact CD2-CB 3.41Å; Y850-R949 HydrophobicContact CD2-CG 3.52Å; Y850-R949 HydrophobicContact CE1-CG 4.38Å; Y850-R949 HydrophobicContact CE2-CB 3.83Å; Y850-R949 HydrophobicContact CE2-CG 3.89Å; Y850-R949 HydrophobicContact CG-CB 3.93Å; Y850-R949 HydrophobicContact CG-CG 3.57Å; A945-R949 VanDerWaalsContact O-CG 3.25Å; A945-R949 WeakPolarHBondContact O-CG 3.5Å; A945-R949 PolarHBondContact O-N 2.7Å; T946-R949 WeakPolarHBondContact O-CB 3.36Å; T946-R949 PolarHBondContact O-N 3.43Å; T946-R949 VanDerWaalsContact O-N 3.15Å; L947-R949 PolarHBondContact O-N 3.23Å; R949-T952 WeakPolarHBondContact O-CB 3.27Å; R949-T952 PolarHBondContact O-N 2.83Å; R949-L953 PolarHBondContact O-N 3.26Å
950	V	90.4	Very high	88.9	Confident	4 Å²	4	18.5 Å²	18.5	2%	0.024	9%	0.093	C	C	.	.	H	α-helix	trans	-65.7	-45.2	178.5	178.3	0	0	0	0	111	F859 F878 F881 L882 T946 L947 R948 T952 L953 C954	F859-V950 HydrophobicContact CE1-CG2 4.29Å; F878-V950 HydrophobicContact CE2-CG1 4.04Å; F878-V950 HydrophobicContact CZ-CG1 3.69Å; F881-V950 HydrophobicContact CE1-CG2 4.32Å; L882-V950 HydrophobicContact CD2-CG1 3.81Å; T946-V950 HydrophobicContact CG2-CG2 4.45Å; T946-V950 WeakPolarHBondContact O-CG2 3.33Å; T946-V950 PolarHBondContact O-N 3.25Å; L947-V950 PolarHBondContact O-N 3.45Å; R948-V950 PolarHBondContact O-N 3.08Å; V950-T952 VanDerWaalsContact C-N 3.28Å; V950-T952 PolarHBondContact O-N 2.84Å; V950-L953 PolarHBondContact O-N 3.07Å; V950-C954 PolarHBondContact O-N 3.41Å
951	I	90.6	Very high	88.6	Confident	0 Å²	0	21.5 Å²	21.5	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-59.7	-37.5	176.9	-74.7	169.8	0	0	0	112.2	L947 R948 L953 I958 I1008 I1011 L1012	L947-I951 HydrophobicContact CD1-CD1 3.84Å; L947-I951 HydrophobicContact CD1-CG1 4.22Å; L947-I951 HydrophobicContact CD2-CD1 4.29Å; L947-I951 HydrophobicContact CG-CD1 3.62Å; L947-I951 HydrophobicContact CG-CG1 4.37Å; L947-I951 WeakPolarHBondContact O-CB 3.4Å; L947-I951 VanDerWaalsContact O-CG1 3.22Å; L947-I951 WeakPolarHBondContact O-CG1 3.25Å; L947-I951 PolarHBondContact O-N 3.2Å; R948-I951 PolarHBondContact O-N 3.42Å; I951-L953 PolarHBondContact O-N 3.09Å; I951-I958 HydrophobicContact CD1-CG2 4.4Å; I951-I958 HydrophobicContact CG1-CD1 4.07Å; I951-I958 HydrophobicContact CG1-CG1 3.89Å; I951-I958 HydrophobicContact CG1-CG2 4.27Å; I951-I1008 HydrophobicContact CD1-CG1 4.38Å; I951-I1008 HydrophobicContact CD1-CG2 3.6Å; I951-I1011 HydrophobicContact CG2-CB 4.4Å; I951-I1011 HydrophobicContact CG2-CG2 3.95Å; I951-L1012 HydrophobicContact CD1-CD1 4.3Å; I951-L1012 HydrophobicContact CG2-CD1 4.25Å; I951-L1012 HydrophobicContact CG2-CD2 3.57Å; I951-L1012 HydrophobicContact CG2-CG 3.78Å
952	T	89.1	Confident	88.5	Confident	57 Å²	57	21.7 Å²	21.7	35%	0.35	11%	0.113	S	C	.	.	H	α-helix	trans	-60	-32.8	177.5	-53.2	0	0	0	0	111.5	Y850 R948 R949 V950 I1011	Y850-T952 HydrophobicContact CE2-CG2 4.4Å; R948-T952 WeakPolarHBondContact O-CB 3.3Å; R948-T952 PolarHBondContact O-N 3.35Å; R948-T952 PolarHBondContact O-OG1 2.92Å; R949-T952 WeakPolarHBondContact O-CB 3.27Å; R949-T952 PolarHBondContact O-N 2.83Å; V950-T952 VanDerWaalsContact C-N 3.28Å; V950-T952 PolarHBondContact O-N 2.84Å; T952-I1011 HydrophobicContact CG2-CD1 4.47Å; T952-I1011 VanDerWaalsContact OG1-CD1 3.3Å; T952-I1011 WeakPolarHBondContact OG1-CD1 3.21Å
953	L	85.9	Confident	88.6	Confident	32 Å²	32	21.1 Å²	21.1	17%	0.168	11%	0.11	C	C	.	.	H	α-helix	trans	-92.3	-38.7	-178.2	-64.5	169.4	0	0	0	112.5	Y850 D856 F859 R949 V950 I951	Y850-L953 HydrophobicContact CD2-CD1 4.37Å; D856-L953 HydrophobicContact CB-CD2 3.98Å; D856-L953 VanDerWaalsContact OD1-CD1 3.32Å; D856-L953 WeakPolarHBondContact OD1-CD1 3.2Å; F859-L953 HydrophobicContact CD2-CD1 4.05Å; F859-L953 HydrophobicContact CG-CD1 4.45Å; R949-L953 PolarHBondContact O-N 3.26Å; V950-L953 PolarHBondContact O-N 3.07Å; I951-L953 PolarHBondContact O-N 3.09Å
954	C	86.8	Confident	88.6	Confident	0 Å²	0	21.3 Å²	21.3	0%	0	11%	0.111	C	C	.	.			trans	-130.5	77.6	-168.8	-66.6	0	0	0	0	111.3	E863 F878 V950	E863-C954 HydrophobicContact CB-CB 4.22Å; E863-C954 VanDerWaalsContact CD-CA 3.46Å; E863-C954 VanDerWaalsContact CD-CB 3.44Å; E863-C954 HydrophobicContact CG-CB 4.19Å; E863-C954 WeakPolarHBondContact OE1-CA 3.19Å; E863-C954 WeakPolarHBondContact OE1-CB 3.21Å; E863-C954 VanDerWaalsContact OE2-CA 3.28Å; E863-C954 WeakPolarHBondContact OE2-CA 3.23Å; E863-C954 WeakPolarHBondContact OE2-CB 3.3Å; E863-C954 PolarHBondContact OE2-SG 3.4Å; E863-C954 VanDerWaalsContact OE2-SG 3.41Å; F878-C954 HydrophobicContact CE1-CB 3.89Å; F878-C954 HydrophobicContact CZ-CB 3.99Å; V950-C954 PolarHBondContact O-N 3.41Å
955	S	86.3	Confident	88.4	Confident	24 Å²	24	23.5 Å²	23.5	17%	0.168	12%	0.123	C	C	.	.	H	α-helix	trans	-88.3	-19.5	-177.1	58.2	0	0	0	0	113.9	E863 T959	E863-S955 PolarHBondContact OE1-N 3.32Å; S955-T959 WeakPolarHBondContact O-CB 3.29Å; S955-T959 WeakPolarHBondContact O-CG2 3.36Å; S955-T959 PolarHBondContact O-N 3.32Å; S955-T959 VanDerWaalsContact O-N 3.12Å; S955-T959 PolarHBondContact O-OG1 3.39Å
956	Q	87.4	Confident	88.3	Confident	108 Å²	108	25 Å²	25	51%	0.505	13%	0.128	S	C	.	.	H	α-helix	trans	-73.4	-42	-174.2	-61.4	-175.5	14.4	0	0	111.3	E863 L867 I958 T959 H960	E863-Q956 WeakPolarHBondContact OE1-CA 3.31Å; E863-Q956 WeakPolarHBondContact OE1-CB 3.35Å; E863-Q956 PolarHBondContact OE1-N 3.46Å; L867-Q956 HydrophobicContact CD1-CB 3.95Å; Q956-I958 VanDerWaalsContact C-N 3.34Å; Q956-I958 PolarHBondContact O-N 2.93Å; Q956-T959 WeakPolarHBondContact CA-OG1 2.96Å; Q956-T959 PolarHBondContact O-N 3.38Å; Q956-T959 PolarHBondContact O-OG1 2.86Å; Q956-T959 VanDerWaalsContact O-OG1 3.04Å; Q956-H960 PolarHBondContact O-N 3.2Å
957	L	87.5	Confident	88.3	Confident	0 Å²	0	25 Å²	25	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-68.9	-33.9	177.8	-174.1	62.9	0	0	0	112.4	E863 A866 L867 I870 F878 L879 L882 H960 L963	E863-L957 HydrophobicContact CG-CB 4.05Å; E863-L957 PolarHBondContact OE1-N 2.98Å; A866-L957 HydrophobicContact CB-CD1 4.23Å; A866-L957 HydrophobicContact CB-CD2 3.72Å; L867-L957 HydrophobicContact CD2-CD1 3.95Å; L867-L957 HydrophobicContact CG-CD1 4.39Å; I870-L957 HydrophobicContact CD1-CD1 4.09Å; F878-L957 HydrophobicContact CB-CD2 4.46Å; F878-L957 HydrophobicContact CD1-CD2 3.38Å; F878-L957 HydrophobicContact CE1-CD2 3.91Å; F878-L957 HydrophobicContact CG-CD2 4.18Å; L879-L957 HydrophobicContact CD1-CD1 4.42Å; L882-L957 HydrophobicContact CD1-CB 4.45Å; L882-L957 HydrophobicContact CD1-CD2 3.65Å; L882-L957 HydrophobicContact CD1-CG 4.03Å; L957-H960 WeakPolarHBondContact O-CB 3.5Å; L957-H960 PolarHBondContact O-N 2.84Å; L957-L963 HydrophobicContact CG-CD1 4.44Å
958	I	88.6	Confident	88.3	Confident	0 Å²	0	25 Å²	25	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-70.1	-34.1	178.1	-69	-79.6	0	0	0	111.8	L882 I951 Q956 H960 L963 V964 V967 L1012	L882-I958 HydrophobicContact CD1-CD1 3.81Å; L882-I958 HydrophobicContact CD1-CG1 4.12Å; L882-I958 HydrophobicContact CD2-CD1 4.03Å; L882-I958 HydrophobicContact CG-CD1 4.37Å; I951-I958 HydrophobicContact CD1-CG2 4.4Å; I951-I958 HydrophobicContact CG1-CD1 4.07Å; I951-I958 HydrophobicContact CG1-CG1 3.89Å; I951-I958 HydrophobicContact CG1-CG2 4.27Å; Q956-I958 VanDerWaalsContact C-N 3.34Å; Q956-I958 PolarHBondContact O-N 2.93Å; I958-H960 VanDerWaalsContact C-N 3.26Å; I958-L963 HydrophobicContact CD1-CD1 4.47Å; I958-V964 WeakPolarHBondContact O-CA 3.34Å; I958-V964 PolarHBondContact O-N 3.31Å; I958-V967 HydrophobicContact CD1-CG2 4.41Å; I958-V967 HydrophobicContact CG2-CG1 4.28Å; I958-V967 HydrophobicContact CG2-CG2 4.34Å; I958-L1012 HydrophobicContact CG2-CD1 3.83Å; I958-L1012 HydrophobicContact CG2-CD2 3.9Å
959	T	88.4	Confident	88.4	Confident	9 Å²	9	25.1 Å²	25.1	6%	0.055	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.4	-3	177.1	50.4	0	0	0	0	113.3	S955 Q956 L1012 S1037 F1041	S955-T959 WeakPolarHBondContact O-CB 3.29Å; S955-T959 WeakPolarHBondContact O-CG2 3.36Å; S955-T959 PolarHBondContact O-N 3.32Å; S955-T959 VanDerWaalsContact O-N 3.12Å; S955-T959 PolarHBondContact O-OG1 3.39Å; Q956-T959 WeakPolarHBondContact CA-OG1 2.96Å; Q956-T959 PolarHBondContact O-N 3.38Å; Q956-T959 PolarHBondContact O-OG1 2.86Å; Q956-T959 VanDerWaalsContact O-OG1 3.04Å; T959-L1012 HydrophobicContact CG2-CD2 4.12Å; T959-S1037 WeakPolarHBondContact CB-O 3.46Å; T959-S1037 VanDerWaalsContact CG2-O 3.3Å; T959-S1037 WeakPolarHBondContact CG2-O 3.45Å; T959-S1037 WeakPolarHBondContact OG1-CB 3.27Å; T959-F1041 HydrophobicContact CG2-CB 4.22Å
960	H	88.1	Confident	88.5	Confident	53 Å²	53	23.9 Å²	23.9	25%	0.245	13%	0.131	C	C	.	.	S	Bend	trans	-64.5	142.1	174.5	-167.3	-92.1	0	0	0	111.2	I870 Q956 L957 I958 I962 L963 V964	I870-H960 VanDerWaalsContact CD1-CE1 3.48Å; I870-H960 WeakPolarHBondContact CD1-CE1 3.42Å; Q956-H960 PolarHBondContact O-N 3.2Å; L957-H960 WeakPolarHBondContact O-CB 3.5Å; L957-H960 PolarHBondContact O-N 2.84Å; I958-H960 VanDerWaalsContact C-N 3.26Å; H960-I962 VanDerWaalsContact CE1-CD1 3.5Å; H960-I962 WeakPolarHBondContact CE1-CD1 3.39Å; H960-I962 WeakPolarHBondContact ND1-CG1 3.49Å; H960-I962 PolarHBondContact ND1-N 2.97Å; H960-I962 PolarHBondContact O-N 3.16Å; H960-L963 PolarHBondContact O-N 3.18Å; H960-V964 WeakPolarHBondContact O-CB 3.33Å; H960-V964 PolarHBondContact O-N 3.11Å
961	P	83.7	Confident	88.6	Confident	63 Å²	63	23.8 Å²	23.8	41%	0.409	13%	0.13	S	C	.	.	T	Hydrogen-bonded Turn	trans	-50.4	-25.6	-178.4	-31.7	35.9	0	0	0	116.1
962	I	83.5	Confident	88.8	Confident	11 Å²	11	23.8 Å²	23.8	6%	0.056	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-34.3	179.7	-64.7	168.5	0	0	0	112.4	I870 L879 H960 Y1133 L1137	I870-I962 HydrophobicContact CD1-CD1 3.93Å; I870-I962 HydrophobicContact CG1-CD1 3.82Å; L879-I962 HydrophobicContact CD1-CG2 4.47Å; H960-I962 VanDerWaalsContact CE1-CD1 3.5Å; H960-I962 WeakPolarHBondContact CE1-CD1 3.39Å; H960-I962 WeakPolarHBondContact ND1-CG1 3.49Å; H960-I962 PolarHBondContact ND1-N 2.97Å; H960-I962 PolarHBondContact O-N 3.16Å; I962-Y1133 HydrophobicContact CD1-CD1 3.75Å; I962-Y1133 HydrophobicContact CD1-CD2 4.3Å; I962-Y1133 HydrophobicContact CD1-CE1 3.84Å; I962-Y1133 HydrophobicContact CD1-CE2 4.35Å; I962-Y1133 HydrophobicContact CD1-CG 4.02Å; I962-Y1133 HydrophobicContact CG1-CD1 4.18Å; I962-Y1133 HydrophobicContact CG1-CG 4.43Å; I962-Y1133 HydrophobicContact CG2-CD1 3.75Å; I962-Y1133 HydrophobicContact CG2-CE1 4.13Å; I962-L1137 HydrophobicContact CG2-CD1 3.56Å
963	L	87.7	Confident	88.9	Confident	1 Å²	1	23.8 Å²	23.8	1%	0.005	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.6	-31.7	-174.3	-70.5	-177.8	0	0	0	113.6	L879 L882 L957 I958 H960 D965 R966 V967	L879-L963 HydrophobicContact CD1-CD1 3.72Å; L879-L963 HydrophobicContact CD1-CD2 4.1Å; L879-L963 HydrophobicContact CD1-CG 3.83Å; L882-L963 HydrophobicContact CB-CD1 3.94Å; L882-L963 HydrophobicContact CD1-CD1 4.02Å; L957-L963 HydrophobicContact CG-CD1 4.44Å; I958-L963 HydrophobicContact CD1-CD1 4.47Å; H960-L963 PolarHBondContact O-N 3.18Å; L963-D965 VanDerWaalsContact C-N 3.35Å; L963-D965 PolarHBondContact O-N 3.03Å; L963-R966 WeakPolarHBondContact O-CB 3.34Å; L963-R966 PolarHBondContact O-N 3.23Å; L963-V967 PolarHBondContact O-N 3.2Å
964	V	90.7	Very high	89.1	Confident	5 Å²	5	22.3 Å²	22.3	3%	0.03	12%	0.116	C	C	.	.	H	α-helix	trans	-57	-44.2	-166	69.7	0	0	0	0	113.2	I958 H960 R966 V967 A968 F1041 A1044	I958-V964 WeakPolarHBondContact O-CA 3.34Å; I958-V964 PolarHBondContact O-N 3.31Å; H960-V964 WeakPolarHBondContact O-CB 3.33Å; H960-V964 PolarHBondContact O-N 3.11Å; V964-R966 VanDerWaalsContact C-N 3.34Å; V964-R966 PolarHBondContact O-N 3.26Å; V964-V967 PolarHBondContact O-N 2.84Å; V964-A968 VanDerWaalsContact O-CB 3.31Å; V964-A968 WeakPolarHBondContact O-CB 3.49Å; V964-A968 PolarHBondContact O-N 3.31Å; V964-F1041 HydrophobicContact CG2-CB 4.04Å; V964-F1041 HydrophobicContact CG2-CD2 4.12Å; V964-A1044 HydrophobicContact CG1-CB 4.27Å; V964-A1044 HydrophobicContact CG2-CB 3.84Å
965	D	87.2	Confident	89.4	Confident	46 Å²	46	22.3 Å²	22.3	25%	0.246	12%	0.116	C	C	.	.	H	α-helix	trans	-63.2	-41	178.7	-68	-38.5	0	0	0	111.7	L963 A968 C969 A1044	L963-D965 VanDerWaalsContact C-N 3.35Å; L963-D965 PolarHBondContact O-N 3.03Å; D965-A968 PolarHBondContact O-N 2.87Å; D965-C969 VanDerWaalsContact O-CB 3.31Å; D965-C969 WeakPolarHBondContact O-CB 3.13Å; D965-C969 PolarHBondContact O-N 3.48Å; D965-C969 PolarHBondContact O-SG 3.42Å; D965-A1044 WeakPolarHBondContact OD1-CB 3.49Å
966	R	87.7	Confident	89.6	Confident	35 Å²	35	23.1 Å²	23.1	13%	0.132	12%	0.121	C	C	.	.	H	α-helix	trans	-66	-44.6	179.9	-56.1	-177.3	76.3	-170.2	-4.5	111.2	S883 V886 N887 L963 V964 M970 R1134 N1138	S883-R966 PolarHBondContact OG-NH1 2.93Å; V886-R966 HydrophobicContact CG1-CB 4.49Å; N887-R966 PolarHBondContact OD1-NH2 2.77Å; L963-R966 WeakPolarHBondContact O-CB 3.34Å; L963-R966 PolarHBondContact O-N 3.23Å; V964-R966 VanDerWaalsContact C-N 3.34Å; V964-R966 PolarHBondContact O-N 3.26Å; R966-M970 VanDerWaalsContact O-CB 3.28Å; R966-M970 WeakPolarHBondContact O-CB 3.27Å; R966-M970 PolarHBondContact O-N 2.81Å; R966-R1134 HydrophobicContact CG-CG 4.4Å; R966-N1138 PolarHBondContact NH2-ND2 2.92Å
967	V	91.4	Very high	89.7	Confident	0 Å²	0	20.3 Å²	20.3	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-65.4	-45.7	179.5	175.3	0	0	0	0	109.7	V886 I958 L963 V964 M970 L971 L1012	V886-V967 HydrophobicContact CG2-CG2 3.89Å; I958-V967 HydrophobicContact CD1-CG2 4.41Å; I958-V967 HydrophobicContact CG2-CG1 4.28Å; I958-V967 HydrophobicContact CG2-CG2 4.34Å; L963-V967 PolarHBondContact O-N 3.2Å; V964-V967 PolarHBondContact O-N 2.84Å; V967-M970 PolarHBondContact O-N 3.24Å; V967-L971 HydrophobicContact CG1-CD1 3.8Å; V967-L971 HydrophobicContact CG1-CG 4.3Å; V967-L971 WeakPolarHBondContact O-CB 3.22Å; V967-L971 WeakPolarHBondContact O-CG 3.49Å; V967-L971 PolarHBondContact O-N 2.86Å; V967-L1012 HydrophobicContact CG1-CD1 4.31Å
968	A	92.5	Very high	89.7	Confident	0 Å²	0	20.5 Å²	20.5	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-59.5	-49.7	176.4	0	0	0	0	0	112.1	V964 D965 M970 L971 N972 F1041 A1044 V1045	V964-A968 VanDerWaalsContact O-CB 3.31Å; V964-A968 WeakPolarHBondContact O-CB 3.49Å; V964-A968 PolarHBondContact O-N 3.31Å; D965-A968 PolarHBondContact O-N 2.87Å; A968-M970 PolarHBondContact O-N 3Å; A968-L971 PolarHBondContact O-N 3.26Å; A968-N972 WeakPolarHBondContact O-CB 3.26Å; A968-N972 PolarHBondContact O-N 3.45Å; A968-F1041 HydrophobicContact CB-CE2 4.27Å; A968-A1044 HydrophobicContact CB-CB 3.71Å; A968-V1045 HydrophobicContact CB-CG2 3.89Å
969	C	91.9	Very high	89.8	Confident	49 Å²	49	21 Å²	21	33%	0.331	11%	0.11	S	C	.	.	H	α-helix	trans	-58.7	-45.8	177.2	-69.2	0	0	0	0	111.9	D965 N972 Y973	D965-C969 VanDerWaalsContact O-CB 3.31Å; D965-C969 WeakPolarHBondContact O-CB 3.13Å; D965-C969 PolarHBondContact O-N 3.48Å; D965-C969 PolarHBondContact O-SG 3.42Å; C969-N972 PolarHBondContact O-N 3.28Å; C969-Y973 VanDerWaalsContact O-CB 3.23Å; C969-Y973 WeakPolarHBondContact O-CB 3.34Å; C969-Y973 PolarHBondContact O-N 2.97Å
970	M	93	Very high	89.6	Confident	5 Å²	5	20.9 Å²	20.9	3%	0.025	11%	0.11	C	C	.	.	H	α-helix	trans	-60	-47.9	177.5	177.5	-155.4	67.1	0	0	111.3	V886 A889 I890 I944 L947 R966 V967 A968 Y973 F974	V886-M970 HydrophobicContact CG1-SD 4.1Å; A889-M970 HydrophobicContact CB-SD 3.71Å; I890-M970 HydrophobicContact CD1-CB 4.35Å; I890-M970 HydrophobicContact CD1-CG 4.41Å; I890-M970 HydrophobicContact CG1-CB 4.08Å; I890-M970 HydrophobicContact CG1-CG 3.65Å; I890-M970 HydrophobicContact CG1-SD 4.27Å; I944-M970 HydrophobicContact CD1-CE 4.33Å; L947-M970 HydrophobicContact CD2-CE 3.63Å; L947-M970 HydrophobicContact CD2-SD 4.39Å; R966-M970 VanDerWaalsContact O-CB 3.28Å; R966-M970 WeakPolarHBondContact O-CB 3.27Å; R966-M970 PolarHBondContact O-N 2.81Å; V967-M970 PolarHBondContact O-N 3.24Å; A968-M970 PolarHBondContact O-N 3Å; M970-Y973 PolarHBondContact O-N 3.49Å; M970-F974 HydrophobicContact CG-CD2 3.78Å; M970-F974 HydrophobicContact CG-CE2 3.58Å; M970-F974 WeakPolarHBondContact O-CD2 3.29Å; M970-F974 PolarHBondContact O-N 2.94Å; M970-F974 VanDerWaalsContact O-N 3.13Å; M970-F974 HydrophobicContact SD-CE2 4.5Å
971	L	93.7	Very high	89.2	Confident	1 Å²	1	23.6 Å²	23.6	1%	0.005	13%	0.132	C	C	.	.	H	α-helix	trans	-65.1	-42.9	-179.5	-67.8	170.4	0	0	0	111.5	V967 A968 L975 I1005 I1008 Y1009 F1041	V967-L971 HydrophobicContact CG1-CD1 3.8Å; V967-L971 HydrophobicContact CG1-CG 4.3Å; V967-L971 WeakPolarHBondContact O-CB 3.22Å; V967-L971 WeakPolarHBondContact O-CG 3.49Å; V967-L971 PolarHBondContact O-N 2.86Å; A968-L971 PolarHBondContact O-N 3.26Å; L971-L975 WeakPolarHBondContact O-CB 3.49Å; L971-L975 PolarHBondContact O-N 3.44Å; L971-I1005 HydrophobicContact CD2-CG2 4.09Å; L971-I1008 HydrophobicContact CD1-CB 4.46Å; L971-I1008 HydrophobicContact CD1-CG2 3.6Å; L971-I1008 HydrophobicContact CD2-CB 4.24Å; L971-I1008 HydrophobicContact CD2-CD1 4.05Å; L971-I1008 HydrophobicContact CD2-CG2 4.03Å; L971-I1008 HydrophobicContact CG-CG2 4.47Å; L971-Y1009 HydrophobicContact CB-CE2 3.66Å; L971-Y1009 WeakPolarHBondContact CB-OH 3.41Å; L971-Y1009 HydrophobicContact CD1-CE2 4.48Å; L971-Y1009 PolarHBondContact O-OH 3.36Å; L971-F1041 HydrophobicContact CD1-CE2 4.02Å; L971-F1041 HydrophobicContact CD1-CZ 3.92Å
972	N	93.7	Very high	89	Confident	0 Å²	0	27.3 Å²	27.3	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-61.7	-47.5	177	-80.2	-23.8	0	0	0	110.5	A968 C969 F974 L975 T976 Y1009 V1045 D1048	A968-N972 WeakPolarHBondContact O-CB 3.26Å; A968-N972 PolarHBondContact O-N 3.45Å; C969-N972 PolarHBondContact O-N 3.28Å; N972-F974 PolarHBondContact O-N 3.38Å; N972-L975 PolarHBondContact O-N 3.28Å; N972-T976 WeakPolarHBondContact O-CB 3.27Å; N972-T976 PolarHBondContact O-N 3.37Å; N972-T976 PolarHBondContact O-OG1 3.1Å; N972-T976 VanDerWaalsContact O-OG1 3.06Å; N972-Y1009 VanDerWaalsContact CA-OH 3.26Å; N972-Y1009 WeakPolarHBondContact CA-OH 3.33Å; N972-Y1009 PolarHBondContact N-OH 3.3Å; N972-Y1009 PolarHBondContact OD1-OH 2.8Å; N972-V1045 PolarHBondContact ND2-O 3.41Å; N972-D1048 WeakPolarHBondContact CB-OD2 3.41Å; N972-D1048 WeakPolarHBondContact ND2-CB 3.33Å; N972-D1048 PolarHBondContact ND2-OD2 3.2Å
973	Y	91.3	Very high	88.9	Confident	57 Å²	57	30.4 Å²	30.4	22%	0.224	16%	0.156	C	C	.	.	H	α-helix	trans	-55.4	-52.9	-179.9	175.3	-111.9	0	0	0	112.4	D894 C969 M970 T976 R977 S1051	D894-Y973 PolarHBondContact OD1-OH 2.92Å; D894-Y973 PolarHBondContact OD2-OH 3.32Å; C969-Y973 VanDerWaalsContact O-CB 3.23Å; C969-Y973 WeakPolarHBondContact O-CB 3.34Å; C969-Y973 PolarHBondContact O-N 2.97Å; M970-Y973 PolarHBondContact O-N 3.49Å; Y973-T976 PolarHBondContact O-N 3.3Å; Y973-R977 PolarHBondContact O-N 3.2Å; Y973-R977 VanDerWaalsContact O-N 3.15Å; Y973-R977 PolarHBondContact OH-NH1 3.15Å; Y973-S1051 WeakPolarHBondContact CA-OG 3.46Å
974	F	90.5	Very high	88.5	Confident	1 Å²	1	39.9 Å²	39.9	0%	0.004	19%	0.192	C	C	.	.	H	α-helix	trans	-69.7	-38.2	-179.4	-69.8	-53.9	0	0	0	112.5	L893 L897 M970 N972 T976 R977 L978 I1005	L893-F974 HydrophobicContact CB-CD1 3.98Å; L893-F974 HydrophobicContact CB-CE1 3.32Å; L893-F974 HydrophobicContact CB-CE2 4.07Å; L893-F974 HydrophobicContact CB-CZ 3.39Å; L893-F974 HydrophobicContact CD1-CD1 4.36Å; L893-F974 HydrophobicContact CD1-CD2 3.94Å; L893-F974 HydrophobicContact CD1-CE1 4.27Å; L893-F974 HydrophobicContact CD1-CE2 3.81Å; L893-F974 HydrophobicContact CD1-CG 4.23Å; L893-F974 HydrophobicContact CD1-CZ 4.01Å; L893-F974 HydrophobicContact CG-CE1 4.46Å; L893-F974 HydrophobicContact CG-CZ 4.33Å; L897-F974 HydrophobicContact CD1-CD1 4.02Å; L897-F974 HydrophobicContact CD1-CE1 4.24Å; M970-F974 HydrophobicContact CG-CD2 3.78Å; M970-F974 HydrophobicContact CG-CE2 3.58Å; M970-F974 WeakPolarHBondContact O-CD2 3.29Å; M970-F974 PolarHBondContact O-N 2.94Å; M970-F974 VanDerWaalsContact O-N 3.13Å; M970-F974 HydrophobicContact SD-CE2 4.5Å; N972-F974 PolarHBondContact O-N 3.38Å; F974-T976 PolarHBondContact O-N 2.75Å; F974-R977 PolarHBondContact O-N 3.48Å; F974-L978 WeakPolarHBondContact O-CB 3.42Å; F974-L978 VanDerWaalsContact O-CG 3.26Å; F974-L978 WeakPolarHBondContact O-CG 3.35Å; F974-L978 PolarHBondContact O-N 2.75Å; F974-I1005 HydrophobicContact CB-CD1 3.88Å
975	L	92	Very high	87.8	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-61.5	-47.3	176.6	-168.2	63.1	0	0	0	110.6	L971 N972 R977 L978 V979 I1005 Y1009 L1056 L1057 A1060	L971-L975 WeakPolarHBondContact O-CB 3.49Å; L971-L975 PolarHBondContact O-N 3.44Å; N972-L975 PolarHBondContact O-N 3.28Å; L975-R977 PolarHBondContact O-N 3.24Å; L975-L978 PolarHBondContact O-N 3.31Å; L975-L978 VanDerWaalsContact O-N 3.08Å; L975-V979 HydrophobicContact CD1-CG1 3.92Å; L975-V979 HydrophobicContact CG-CG2 4.29Å; L975-V979 WeakPolarHBondContact O-CG2 3.49Å; L975-V979 PolarHBondContact O-N 3.39Å; L975-I1005 HydrophobicContact CB-CG2 4.3Å; L975-I1005 HydrophobicContact CD1-CG2 4.16Å; L975-Y1009 HydrophobicContact CD2-CD2 4.4Å; L975-Y1009 HydrophobicContact CD2-CE2 3.77Å; L975-L1056 HydrophobicContact CB-CD1 4.49Å; L975-L1056 HydrophobicContact CD2-CD1 4.42Å; L975-L1056 HydrophobicContact CD2-CD2 4.47Å; L975-L1056 HydrophobicContact CD2-CG 4.2Å; L975-L1056 HydrophobicContact CG-CD1 4.16Å; L975-L1056 HydrophobicContact CG-CG 4.46Å; L975-L1057 HydrophobicContact CD2-CD2 3.87Å; L975-A1060 HydrophobicContact CD1-CB 3.98Å; L975-A1060 HydrophobicContact CD2-CB 4.02Å; L975-A1060 HydrophobicContact CG-CB 4.29Å
976	T	91.5	Very high	87.4	Confident	42 Å²	42	41.9 Å²	41.9	26%	0.258	20%	0.202	S	C	.	.	H	α-helix	trans	-57.6	-37.2	177	-67.7	0	0	0	0	112.3	N972 Y973 F974 G980 S1051 L1056	N972-T976 WeakPolarHBondContact O-CB 3.27Å; N972-T976 PolarHBondContact O-N 3.37Å; N972-T976 PolarHBondContact O-OG1 3.1Å; N972-T976 VanDerWaalsContact O-OG1 3.06Å; Y973-T976 PolarHBondContact O-N 3.3Å; F974-T976 PolarHBondContact O-N 2.75Å; T976-G980 WeakPolarHBondContact O-CA 3.37Å; T976-G980 PolarHBondContact O-N 3.37Å; T976-S1051 PolarHBondContact OG1-O 2.77Å; T976-L1056 VanDerWaalsContact OG1-CD1 3.26Å; T976-L1056 WeakPolarHBondContact OG1-CD1 3.38Å; T976-L1056 VanDerWaalsContact OG1-CD2 3.3Å; T976-L1056 WeakPolarHBondContact OG1-CD2 3.21Å
977	R	88.5	Confident	87.1	Confident	48 Å²	48	44.6 Å²	44.6	18%	0.181	22%	0.219	C	C	.	.	H	α-helix	trans	-75.7	-28.3	179.5	-149.9	158.3	152.4	167.8	-18.5	112.9	D894 L897 Y973 F974 L975 Q983 L986	D894-R977 PolarHBondContact O-NH2 3.07Å; D894-R977 IonicContact OD1-CZ 3.02Å; D894-R977 IonicContact OD1-NH1 2.61Å; D894-R977 PolarHBondContact OD1-NH1 2.96Å; D894-R977 IonicContact OD1-NH2 3.42Å; D894-R977 PolarHBondContact OD1-NH2 2.99Å; L897-R977 VanDerWaalsContact CB-NH2 3.26Å; L897-R977 HydrophobicContact CD1-CB 4.43Å; L897-R977 HydrophobicContact CD1-CG 4.07Å; Y973-R977 PolarHBondContact O-N 3.2Å; Y973-R977 VanDerWaalsContact O-N 3.15Å; Y973-R977 PolarHBondContact OH-NH1 3.15Å; F974-R977 PolarHBondContact O-N 3.48Å; L975-R977 PolarHBondContact O-N 3.24Å; R977-Q983 WeakPolarHBondContact O-CA 3.41Å; R977-Q983 PolarHBondContact O-N 3.44Å; R977-L986 WeakPolarHBondContact O-CD1 3.48Å
978	L	88.3	Confident	86.6	Confident	4 Å²	4	44.8 Å²	44.8	2%	0.021	22%	0.22	C	C	.	.	H	α-helix	trans	-87.5	-37	-179.9	-70.8	170.1	0	0	0	114.2	F974 L975 Q983 F996 P998 M1001 V1002 I1005	F974-L978 WeakPolarHBondContact O-CB 3.42Å; F974-L978 VanDerWaalsContact O-CG 3.26Å; F974-L978 WeakPolarHBondContact O-CG 3.35Å; F974-L978 PolarHBondContact O-N 2.75Å; L975-L978 PolarHBondContact O-N 3.31Å; L975-L978 VanDerWaalsContact O-N 3.08Å; L978-Q983 WeakPolarHBondContact O-CB 3.41Å; L978-Q983 WeakPolarHBondContact O-CG 3.4Å; L978-Q983 PolarHBondContact O-OE1 2.91Å; L978-F996 HydrophobicContact CD2-CZ 4.2Å; L978-P998 HydrophobicContact CD2-CB 4.26Å; L978-M1001 HydrophobicContact CD1-CB 4.18Å; L978-M1001 HydrophobicContact CD1-CE 4.11Å; L978-M1001 HydrophobicContact CD1-CG 3.91Å; L978-M1001 HydrophobicContact CD1-SD 4.06Å; L978-M1001 HydrophobicContact CD2-SD 4.25Å; L978-V1002 HydrophobicContact CB-CG2 3.89Å; L978-V1002 HydrophobicContact CD1-CG2 4.05Å; L978-I1005 HydrophobicContact CD1-CD1 3.73Å
979	V	89.7	Confident	85.7	Confident	12 Å²	12	54.5 Å²	54.5	7%	0.073	26%	0.257	C	S	.	.	H	α-helix	trans	-108.8	-19.6	-176.3	-48.5	0	0	0	0	113.6	L975 V1002 L1056 Q1059 A1060 V1063	L975-V979 HydrophobicContact CD1-CG1 3.92Å; L975-V979 HydrophobicContact CG-CG2 4.29Å; L975-V979 WeakPolarHBondContact O-CG2 3.49Å; L975-V979 PolarHBondContact O-N 3.39Å; V979-V1002 HydrophobicContact CG1-CG1 4.44Å; V979-V1002 HydrophobicContact CG1-CG2 4.08Å; V979-L1056 HydrophobicContact CG2-CD1 3.76Å; V979-Q1059 HydrophobicContact CB-CB 4.39Å; V979-Q1059 HydrophobicContact CG2-CB 3.86Å; V979-A1060 HydrophobicContact CG1-CB 4.38Å; V979-A1060 HydrophobicContact CG2-CB 4.47Å; V979-V1063 HydrophobicContact CB-CG2 4.12Å; V979-V1063 HydrophobicContact CG1-CB 4.32Å; V979-V1063 HydrophobicContact CG1-CG2 4.06Å
980	G	84.5	Confident	85.1	Confident	6 Å²	6	56.2 Å²	56.2	6%	0.062	26%	0.263	C	S	.	.	S	Bend	trans	-80.4	-176.6	-178.6	0	0	0	0	0	113.7	T976 K982 Q983	T976-G980 WeakPolarHBondContact O-CA 3.37Å; T976-G980 PolarHBondContact O-N 3.37Å; G980-K982 PolarHBondContact O-N 2.88Å; G980-K982 VanDerWaalsContact O-N 3.17Å; G980-Q983 WeakPolarHBondContact O-CB 3.35Å; G980-Q983 PolarHBondContact O-N 3.48Å
981	P	80.2	Confident	84.5	Confident	109 Å²	109	59.2 Å²	59.2	71%	0.708	28%	0.276	S	S	*	.	G	3₁₀ helix	trans	-62.2	-28.5	-174.1	22.2	-31.5	0	0	0	113.6	Q983 R984	P981-Q983 PolarHBondContact O-N 2.92Å; P981-R984 PolarHBondContact O-N 3.39Å
982	K	78.7	Confident	83.8	Confident	142 Å²	142	62.6 Å²	62.6	62%	0.617	30%	0.304	S	S	*	.	G	3₁₀ helix	trans	-69	-13.2	177.2	-67.2	-171.7	179.4	179.5	0	113.7	G980 R984 D985	G980-K982 PolarHBondContact O-N 2.88Å; G980-K982 VanDerWaalsContact O-N 3.17Å; K982-R984 PolarHBondContact O-N 3.38Å; K982-D985 WeakPolarHBondContact O-CB 3.47Å; K982-D985 PolarHBondContact O-N 2.92Å
983	Q	83.2	Confident	82.9	Confident	75 Å²	75	64.5 Å²	64.5	35%	0.35	32%	0.32	S	S	.	.	G	3₁₀ helix	trans	-51.9	-31.7	173.2	179.5	-169.5	-4.7	0	0	112.1	R977 L978 G980 P981 D985 L986	R977-Q983 WeakPolarHBondContact O-CA 3.41Å; R977-Q983 PolarHBondContact O-N 3.44Å; L978-Q983 WeakPolarHBondContact O-CB 3.41Å; L978-Q983 WeakPolarHBondContact O-CG 3.4Å; L978-Q983 PolarHBondContact O-OE1 2.91Å; G980-Q983 WeakPolarHBondContact O-CB 3.35Å; G980-Q983 PolarHBondContact O-N 3.48Å; P981-Q983 PolarHBondContact O-N 2.92Å; Q983-D985 PolarHBondContact O-N 3.44Å; Q983-L986 WeakPolarHBondContact O-CB 3.42Å; Q983-L986 PolarHBondContact O-N 2.86Å
984	R	78.4	Confident	82.4	Confident	200 Å²	200	62.9 Å²	62.9	76%	0.755	31%	0.313	S	S	*	.	G	3₁₀ helix	trans	-58.6	-31.4	179.2	-67.3	-177.6	178.6	179.4	1.1	112.3	K904 P981 K982 L986 N987	K904-R984 PolarHBondContact NZ-O 3.06Å; P981-R984 PolarHBondContact O-N 3.39Å; K982-R984 PolarHBondContact O-N 3.38Å; R984-L986 PolarHBondContact O-N 3.18Å; R984-N987 PolarHBondContact O-N 3.38Å
985	D	77	Confident	81.8	Confident	84 Å²	84	63.5 Å²	63.5	45%	0.449	32%	0.32	S	S	.	.	G	3₁₀ helix	trans	-71.4	-19.8	-179.2	-61.8	-29.5	0	0	0	112.5	K904 K982 Q983	K904-D985 WeakPolarHBondContact CD-O 3.38Å; K982-D985 WeakPolarHBondContact O-CB 3.47Å; K982-D985 PolarHBondContact O-N 2.92Å; Q983-D985 PolarHBondContact O-N 3.44Å
986	L	78.3	Confident	81.5	Confident	9 Å²	9	64 Å²	64	5%	0.047	32%	0.322	C	S	.	.	G	3₁₀ helix	trans	-90.8	-1.4	179.6	-50.8	173.2	0	0	0	113.3	L897 R977 Q983 R984 V988 F996	L897-L986 HydrophobicContact CB-CD2 3.98Å; L897-L986 HydrophobicContact CD2-CD1 3.58Å; L897-L986 HydrophobicContact CD2-CD2 3.56Å; L897-L986 HydrophobicContact CD2-CG 4.14Å; L897-L986 HydrophobicContact CG-CD2 4.33Å; R977-L986 WeakPolarHBondContact O-CD1 3.48Å; Q983-L986 WeakPolarHBondContact O-CB 3.42Å; Q983-L986 PolarHBondContact O-N 2.86Å; R984-L986 PolarHBondContact O-N 3.18Å; L986-V988 PolarHBondContact O-N 3.15Å; L986-V988 VanDerWaalsContact O-N 3.11Å; L986-F996 HydrophobicContact CB-CE1 4.14Å; L986-F996 HydrophobicContact CB-CZ 4.4Å; L986-F996 HydrophobicContact CD1-CZ 4.41Å
987	N	80.7	Confident	81.2	Confident	92 Å²	92	65 Å²	65	49%	0.492	32%	0.323	S	S	.	.			trans	-84.9	86.4	-177.4	-160.8	50.3	0	0	0	111.2	R984 K991	R984-N987 PolarHBondContact O-N 3.38Å; N987-K991 WeakPolarHBondContact OD1-CE 3.42Å; N987-K991 PolarHBondContact OD1-NZ 2.98Å
988	V	80.6	Confident	81.1	Confident	4 Å²	4	64 Å²	64	2%	0.024	32%	0.323	C	S	.	.			trans	-81.4	158.1	167.8	-71.1	0	0	0	0	111.4	L900 K904 L986 K991 Y994	L900-V988 HydrophobicContact CD2-CG1 4.11Å; L900-V988 HydrophobicContact CD2-CG2 4Å; K904-V988 HydrophobicContact CB-CG1 4.02Å; L986-V988 PolarHBondContact O-N 3.15Å; L986-V988 VanDerWaalsContact O-N 3.11Å; V988-K991 HydrophobicContact CG2-CG 3.94Å; V988-Y994 HydrophobicContact CB-CD2 4.42Å; V988-Y994 HydrophobicContact CB-CE2 4.08Å; V988-Y994 HydrophobicContact CG1-CE2 4.47Å; V988-Y994 HydrophobicContact CG2-CD2 3.8Å; V988-Y994 HydrophobicContact CG2-CE2 3.95Å
989	R	74.6	Confident	81	Confident	205 Å²	205	67.2 Å²	67.2	77%	0.774	34%	0.34	S	S	*	.	S	Bend	trans	-64.7	-45.3	-172.5	-170.8	177.3	160	-179.6	-7.4	112.8	E907	E907-R989 PolarHBondContact OE2-N 2.56Å
990	D	78.6	Confident	80.9	Confident	85 Å²	85	69.1 Å²	69.1	46%	0.455	35%	0.349	S	S	.	.			trans	-119.4	90.4	175.5	-169.9	-10.4	0	0	0	110.9	A992 A993 Y994	D990-A992 PolarHBondContact O-N 2.94Å; D990-A992 WeakPolarHBondContact OD1-CB 3.44Å; D990-A992 PolarHBondContact OD1-N 3.22Å; D990-A993 HydrophobicContact CB-CB 3.97Å; D990-A993 PolarHBondContact O-N 3.13Å; D990-A993 PolarHBondContact OD1-N 3.04Å; D990-Y994 WeakPolarHBondContact O-CD2 3.24Å; D990-Y994 WeakPolarHBondContact O-CE2 3.42Å
991	K	81.4	Confident	81.1	Confident	67 Å²	67	69.2 Å²	69.2	29%	0.291	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-31.6	177	-63.8	177.3	-176.1	171	0	112.4	N987 V988 Y994 G995 F996	N987-K991 WeakPolarHBondContact OD1-CE 3.42Å; N987-K991 PolarHBondContact OD1-NZ 2.98Å; V988-K991 HydrophobicContact CG2-CG 3.94Å; K991-Y994 PolarHBondContact O-N 3.16Å; K991-G995 PolarHBondContact O-N 3.46Å; K991-F996 HydrophobicContact CB-CB 4.36Å; K991-F996 HydrophobicContact CD-CD1 4.39Å; K991-F996 HydrophobicContact CG-CD1 4.37Å; K991-F996 PolarHBondContact O-N 2.9Å
992	A	77.7	Confident	81.7	Confident	73 Å²	73	64.2 Å²	64.2	60%	0.603	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.3	-35.5	-177.4	0	0	0	0	0	111.1	D990 Y994 G995	D990-A992 PolarHBondContact O-N 2.94Å; D990-A992 WeakPolarHBondContact OD1-CB 3.44Å; D990-A992 PolarHBondContact OD1-N 3.22Å; A992-Y994 PolarHBondContact O-N 3.04Å; A992-G995 PolarHBondContact O-N 3.33Å
993	A	76.1	Confident	82.3	Confident	39 Å²	39	59.5 Å²	59.5	32%	0.322	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.2	-37	174.2	0	0	0	0	0	112.6	R934 D990	R934-A993 PolarHBondContact NH1-O 3.2Å; D990-A993 HydrophobicContact CB-CB 3.97Å; D990-A993 PolarHBondContact O-N 3.13Å; D990-A993 PolarHBondContact OD1-N 3.04Å
994	Y	81	Confident	82.7	Confident	23 Å²	23	57.2 Å²	57.2	9%	0.09	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.3	4.2	178.8	-47.4	-69.1	0	0	0	113.6	L900 L903 E907 R934 V988 D990 K991 A992 F996	L900-Y994 HydrophobicContact CD2-CD2 4.32Å; L900-Y994 HydrophobicContact CD2-CG 4.44Å; L903-Y994 HydrophobicContact CD1-CD1 4.12Å; L903-Y994 HydrophobicContact CD1-CE1 3.9Å; E907-Y994 PolarHBondContact OE1-OH 3.49Å; R934-Y994 WeakPolarHBondContact CA-O 3.3Å; V988-Y994 HydrophobicContact CB-CD2 4.42Å; V988-Y994 HydrophobicContact CB-CE2 4.08Å; V988-Y994 HydrophobicContact CG1-CE2 4.47Å; V988-Y994 HydrophobicContact CG2-CD2 3.8Å; V988-Y994 HydrophobicContact CG2-CE2 3.95Å; D990-Y994 WeakPolarHBondContact O-CD2 3.24Å; D990-Y994 WeakPolarHBondContact O-CE2 3.42Å; K991-Y994 PolarHBondContact O-N 3.16Å; A992-Y994 PolarHBondContact O-N 3.04Å; Y994-F996 PolarHBondContact O-N 3.49Å
995	G	77.3	Confident	83.4	Confident	14 Å²	14	47.7 Å²	47.7	14%	0.144	25%	0.25	C	S	.	.	T	Hydrogen-bonded Turn	trans	66.8	16.3	-176.2	0	0	0	0	0	114.3	I937 K991 A992 K997	I937-G995 WeakPolarHBondContact CG2-O 3.49Å; K991-G995 PolarHBondContact O-N 3.46Å; A992-G995 PolarHBondContact O-N 3.33Å; G995-K997 PolarHBondContact O-N 3.5Å
996	F	84.9	Confident	84.2	Confident	12 Å²	12	43.7 Å²	43.7	5%	0.053	23%	0.229	C	C	.	.			trans	-79.3	106.4	-176.5	-170.8	-129.1	0	0	0	111.4	L897 L900 I937 L978 L986 K991 Y994 P998	L897-F996 HydrophobicContact CD2-CE2 4.18Å; L897-F996 HydrophobicContact CD2-CZ 4.16Å; L900-F996 HydrophobicContact CD1-CB 4.4Å; L900-F996 HydrophobicContact CD1-CD1 3.92Å; L900-F996 HydrophobicContact CD1-CD2 3.76Å; L900-F996 HydrophobicContact CD1-CE1 4.09Å; L900-F996 HydrophobicContact CD1-CE2 3.95Å; L900-F996 HydrophobicContact CD1-CG 3.76Å; L900-F996 HydrophobicContact CD1-CZ 4.11Å; I937-F996 HydrophobicContact CD1-CB 4.12Å; I937-F996 HydrophobicContact CD1-CD2 4.33Å; I937-F996 HydrophobicContact CG1-CD2 4.44Å; I937-F996 HydrophobicContact CG2-CB 4.43Å; I937-F996 HydrophobicContact CG2-CD2 4.13Å; L978-F996 HydrophobicContact CD2-CZ 4.2Å; L986-F996 HydrophobicContact CB-CE1 4.14Å; L986-F996 HydrophobicContact CB-CZ 4.4Å; L986-F996 HydrophobicContact CD1-CZ 4.41Å; K991-F996 HydrophobicContact CB-CB 4.36Å; K991-F996 HydrophobicContact CD-CD1 4.39Å; K991-F996 HydrophobicContact CG-CD1 4.37Å; K991-F996 PolarHBondContact O-N 2.9Å; Y994-F996 PolarHBondContact O-N 3.49Å; F996-P998 VanDerWaalsContact C-CD 3.49Å; F996-P998 HydrophobicContact CD1-CG 4.29Å; F996-P998 HydrophobicContact CE1-CB 3.93Å; F996-P998 HydrophobicContact CE1-CG 3.98Å; F996-P998 HydrophobicContact CE2-CB 4.42Å; F996-P998 HydrophobicContact CZ-CB 3.82Å; F996-P998 HydrophobicContact CZ-CG 4.37Å; F996-P998 WeakPolarHBondContact O-CD 3.41Å
997	K	84.7	Confident	84.9	Confident	62 Å²	62	43.9 Å²	43.9	27%	0.27	23%	0.232	S	C	.	.			trans	-114	77.3	178.3	-62.9	-177.4	-172.9	172.7	0	110.4	W706 G995 D999 I1000 M1001	W706-K997 PolarHBondContact O-NZ 3.32Å; W706-K997 VanDerWaalsContact O-NZ 3.14Å; G995-K997 PolarHBondContact O-N 3.5Å; K997-D999 WeakPolarHBondContact CA-OD1 3.34Å; K997-D999 WeakPolarHBondContact CB-OD1 3.21Å; K997-D999 PolarHBondContact O-N 2.87Å; K997-I1000 HydrophobicContact CB-CB 4.19Å; K997-I1000 HydrophobicContact CB-CD1 4.04Å; K997-I1000 HydrophobicContact CB-CG1 4.03Å; K997-I1000 HydrophobicContact CD-CD1 3.51Å; K997-I1000 HydrophobicContact CD-CG1 4.38Å; K997-I1000 HydrophobicContact CG-CD1 4.39Å; K997-I1000 PolarHBondContact O-N 2.83Å; K997-M1001 PolarHBondContact O-N 3.44Å; K997-M1001 VanDerWaalsContact O-N 3.13Å
998	P	86.6	Confident	85.5	Confident	27 Å²	27	39.5 Å²	39.5	18%	0.175	21%	0.208	C	C	.	.	H	α-helix	trans	-64	-28.1	-175	25.6	-34.2	0	0	0	112.7	L978 F996 M1001 V1002	L978-P998 HydrophobicContact CD2-CB 4.26Å; F996-P998 VanDerWaalsContact C-CD 3.49Å; F996-P998 HydrophobicContact CD1-CG 4.29Å; F996-P998 HydrophobicContact CE1-CB 3.93Å; F996-P998 HydrophobicContact CE1-CG 3.98Å; F996-P998 HydrophobicContact CE2-CB 4.42Å; F996-P998 HydrophobicContact CZ-CB 3.82Å; F996-P998 HydrophobicContact CZ-CG 4.37Å; F996-P998 WeakPolarHBondContact O-CD 3.41Å; P998-M1001 PolarHBondContact O-N 3.1Å; P998-V1002 VanDerWaalsContact O-CG2 3.28Å; P998-V1002 WeakPolarHBondContact O-CG2 3.46Å; P998-V1002 PolarHBondContact O-N 2.88Å
999	D	87.6	Confident	86.1	Confident	71 Å²	71	39.3 Å²	39.3	38%	0.38	21%	0.207	S	C	.	.	H	α-helix	trans	-59.2	-51.5	172	53.9	-26.8	0	0	0	112.3	K997 M1001 V1002 L1003 I1067	K997-D999 WeakPolarHBondContact CA-OD1 3.34Å; K997-D999 WeakPolarHBondContact CB-OD1 3.21Å; K997-D999 PolarHBondContact O-N 2.87Å; D999-M1001 VanDerWaalsContact C-N 3.28Å; D999-M1001 PolarHBondContact O-N 2.93Å; D999-V1002 PolarHBondContact O-N 3.49Å; D999-L1003 WeakPolarHBondContact O-CG 3.44Å; D999-L1003 PolarHBondContact O-N 2.84Å; D999-I1067 HydrophobicContact CB-CB 4.48Å; D999-I1067 HydrophobicContact CB-CD1 4.32Å; D999-I1067 HydrophobicContact CB-CG2 4.06Å
1000	I	87.6	Confident	87	Confident	52 Å²	52	30.8 Å²	30.8	27%	0.267	18%	0.176	S	C	.	.	H	α-helix	trans	-62.9	-40	176.4	-57.6	-174.6	0	0	0	110.4	L941 K997 V1002 L1003 E1004	L941-I1000 HydrophobicContact CD1-CG2 4.15Å; L941-I1000 HydrophobicContact CD2-CB 4.49Å; L941-I1000 HydrophobicContact CD2-CG2 4.17Å; K997-I1000 HydrophobicContact CB-CB 4.19Å; K997-I1000 HydrophobicContact CB-CD1 4.04Å; K997-I1000 HydrophobicContact CB-CG1 4.03Å; K997-I1000 HydrophobicContact CD-CD1 3.51Å; K997-I1000 HydrophobicContact CD-CG1 4.38Å; K997-I1000 HydrophobicContact CG-CD1 4.39Å; K997-I1000 PolarHBondContact O-N 2.83Å; I1000-V1002 PolarHBondContact O-N 3.43Å; I1000-L1003 WeakPolarHBondContact O-CB 3.41Å; I1000-L1003 PolarHBondContact O-N 3.34Å; I1000-E1004 HydrophobicContact CG2-CG 4.16Å; I1000-E1004 WeakPolarHBondContact O-CB 3.47Å; I1000-E1004 VanDerWaalsContact O-CG 3.26Å; I1000-E1004 WeakPolarHBondContact O-CG 3.31Å; I1000-E1004 PolarHBondContact O-N 2.99Å
1001	M	88.5	Confident	87.6	Confident	8 Å²	8	28.3 Å²	28.3	4%	0.039	16%	0.163	C	C	.	.	H	α-helix	trans	-64.7	-40.8	-179.7	-157.1	172.6	162.8	0	0	112.4	L893 L941 L978 K997 P998 D999 E1004 I1005	L893-M1001 HydrophobicContact CB-CE 4.23Å; L893-M1001 HydrophobicContact CD1-CE 3.36Å; L893-M1001 HydrophobicContact CD2-CE 3.23Å; L893-M1001 HydrophobicContact CD2-SD 4.08Å; L893-M1001 HydrophobicContact CG-CE 3.76Å; L941-M1001 HydrophobicContact CD1-CB 4.2Å; L941-M1001 HydrophobicContact CD1-CG 4.25Å; L978-M1001 HydrophobicContact CD1-CB 4.18Å; L978-M1001 HydrophobicContact CD1-CE 4.11Å; L978-M1001 HydrophobicContact CD1-CG 3.91Å; L978-M1001 HydrophobicContact CD1-SD 4.06Å; L978-M1001 HydrophobicContact CD2-SD 4.25Å; K997-M1001 PolarHBondContact O-N 3.44Å; K997-M1001 VanDerWaalsContact O-N 3.13Å; P998-M1001 PolarHBondContact O-N 3.1Å; D999-M1001 VanDerWaalsContact C-N 3.28Å; D999-M1001 PolarHBondContact O-N 2.93Å; M1001-E1004 PolarHBondContact O-N 3.1Å; M1001-I1005 HydrophobicContact CE-CD1 4.48Å; M1001-I1005 HydrophobicContact CG-CD1 4.3Å; M1001-I1005 WeakPolarHBondContact O-CB 3.02Å; M1001-I1005 VanDerWaalsContact O-CG1 3.3Å; M1001-I1005 WeakPolarHBondContact O-CG1 3.4Å; M1001-I1005 PolarHBondContact O-N 2.96Å
1002	V	91.9	Very high	88	Confident	4 Å²	4	25.3 Å²	25.3	2%	0.024	15%	0.149	C	C	.	.	H	α-helix	trans	-66.1	-39.9	173	172.1	0	0	0	0	111.2	L978 V979 P998 D999 I1000 S1006 V1063 L1064	L978-V1002 HydrophobicContact CB-CG2 3.89Å; L978-V1002 HydrophobicContact CD1-CG2 4.05Å; V979-V1002 HydrophobicContact CG1-CG1 4.44Å; V979-V1002 HydrophobicContact CG1-CG2 4.08Å; P998-V1002 VanDerWaalsContact O-CG2 3.28Å; P998-V1002 WeakPolarHBondContact O-CG2 3.46Å; P998-V1002 PolarHBondContact O-N 2.88Å; D999-V1002 PolarHBondContact O-N 3.49Å; I1000-V1002 PolarHBondContact O-N 3.43Å; V1002-S1006 WeakPolarHBondContact O-CB 3.5Å; V1002-S1006 PolarHBondContact O-N 2.94Å; V1002-S1006 PolarHBondContact O-OG 3.46Å; V1002-V1063 HydrophobicContact CG1-CG1 4.17Å; V1002-L1064 HydrophobicContact CG1-CD2 4.09Å; V1002-L1064 HydrophobicContact CG1-CG 4.48Å
1003	L	92.3	Very high	88.7	Confident	43 Å²	43	21.8 Å²	21.8	23%	0.225	12%	0.121	C	C	.	.	H	α-helix	trans	-58.7	-49.3	174.9	-76.5	166.9	0	0	0	111.6	D999 I1000 S1006 A1007 L1064 I1067 A1069 L1073	D999-L1003 WeakPolarHBondContact O-CG 3.44Å; D999-L1003 PolarHBondContact O-N 2.84Å; I1000-L1003 WeakPolarHBondContact O-CB 3.41Å; I1000-L1003 PolarHBondContact O-N 3.34Å; L1003-S1006 PolarHBondContact O-N 3.34Å; L1003-A1007 VanDerWaalsContact O-CB 3.28Å; L1003-A1007 WeakPolarHBondContact O-CB 3.13Å; L1003-A1007 PolarHBondContact O-N 2.86Å; L1003-L1064 HydrophobicContact CD2-CD2 4Å; L1003-I1067 HydrophobicContact CD1-CD1 4.23Å; L1003-I1067 HydrophobicContact CD2-CD1 4.05Å; L1003-I1067 HydrophobicContact CG-CD1 3.77Å; L1003-A1069 HydrophobicContact CD2-CB 3.47Å; L1003-A1069 VanDerWaalsContact CD2-CB 3.47Å; L1003-L1073 HydrophobicContact CD2-CD2 3.61Å
1004	E	91.1	Very high	89.3	Confident	28 Å²	28	23.8 Å²	23.8	13%	0.131	12%	0.12	C	C	.	.	H	α-helix	trans	-63.1	-47.1	-179	-71.6	-71.7	149.2	0	0	111.6	L941 I944 A945 R948 I1000 M1001 A1007 I1008	L941-E1004 HydrophobicContact CD1-CG 4.45Å; I944-E1004 HydrophobicContact CG2-CB 3.8Å; A945-E1004 WeakPolarHBondContact CA-OE2 3.48Å; R948-E1004 WeakPolarHBondContact CD-OE2 3.36Å; R948-E1004 IonicContact CZ-OE1 3.41Å; R948-E1004 IonicContact CZ-OE2 2.85Å; R948-E1004 VanDerWaalsContact NE-CD 3.33Å; R948-E1004 IonicContact NE-OE1 3.03Å; R948-E1004 PolarHBondContact NE-OE1 3.2Å; R948-E1004 IonicContact NE-OE2 3.71Å; R948-E1004 PolarHBondContact NE-OE2 3.36Å; R948-E1004 IonicContact NH2-OE1 3.6Å; R948-E1004 PolarHBondContact NH2-OE1 2.93Å; R948-E1004 IonicContact NH2-OE2 3.84Å; R948-E1004 PolarHBondContact NH2-OE2 2.85Å; I1000-E1004 HydrophobicContact CG2-CG 4.16Å; I1000-E1004 WeakPolarHBondContact O-CB 3.47Å; I1000-E1004 VanDerWaalsContact O-CG 3.26Å; I1000-E1004 WeakPolarHBondContact O-CG 3.31Å; I1000-E1004 PolarHBondContact O-N 2.99Å; M1001-E1004 PolarHBondContact O-N 3.1Å; E1004-A1007 PolarHBondContact O-N 3.15Å; E1004-I1008 WeakPolarHBondContact O-CG1 3.47Å; E1004-I1008 PolarHBondContact O-N 2.94Å; E1004-I1008 VanDerWaalsContact O-N 3.13Å
1005	I	93.5	Very high	88.9	Confident	0 Å²	0	23.4 Å²	23.4	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-63.6	-45.8	177.2	-69.2	168.6	0	0	0	111	I944 L971 F974 L975 L978 M1001 A1007 I1008 Y1009	I944-I1005 HydrophobicContact CG2-CG1 4.28Å; L971-I1005 HydrophobicContact CD2-CG2 4.09Å; F974-I1005 HydrophobicContact CB-CD1 3.88Å; L975-I1005 HydrophobicContact CB-CG2 4.3Å; L975-I1005 HydrophobicContact CD1-CG2 4.16Å; L978-I1005 HydrophobicContact CD1-CD1 3.73Å; M1001-I1005 HydrophobicContact CE-CD1 4.48Å; M1001-I1005 HydrophobicContact CG-CD1 4.3Å; M1001-I1005 WeakPolarHBondContact O-CB 3.02Å; M1001-I1005 VanDerWaalsContact O-CG1 3.3Å; M1001-I1005 WeakPolarHBondContact O-CG1 3.4Å; M1001-I1005 PolarHBondContact O-N 2.96Å; I1005-A1007 VanDerWaalsContact C-N 3.28Å; I1005-A1007 PolarHBondContact O-N 2.87Å; I1005-I1008 WeakPolarHBondContact O-CB 3.38Å; I1005-I1008 PolarHBondContact O-N 3.4Å; I1005-I1008 VanDerWaalsContact O-N 3.07Å; I1005-Y1009 HydrophobicContact CG2-CD2 3.91Å; I1005-Y1009 HydrophobicContact CG2-CE2 3.7Å; I1005-Y1009 WeakPolarHBondContact O-CD2 3.45Å; I1005-Y1009 PolarHBondContact O-N 2.91Å; I1005-Y1009 VanDerWaalsContact O-N 3.09Å
1006	S	93.7	Very high	88.2	Confident	0 Å²	0	26.7 Å²	26.7	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-64.5	-35.1	-180	-56	0	0	0	0	111.8	V1002 L1003 I1008 Y1009 Q1010 F1077	V1002-S1006 WeakPolarHBondContact O-CB 3.5Å; V1002-S1006 PolarHBondContact O-N 2.94Å; V1002-S1006 PolarHBondContact O-OG 3.46Å; L1003-S1006 PolarHBondContact O-N 3.34Å; S1006-I1008 VanDerWaalsContact C-N 3.33Å; S1006-Y1009 PolarHBondContact O-N 3.3Å; S1006-Q1010 PolarHBondContact O-N 3.47Å; S1006-Q1010 VanDerWaalsContact O-N 3.07Å; S1006-F1077 WeakPolarHBondContact O-CD2 3.43Å
1007	A	92.8	Very high	86.5	Confident	13 Å²	13	32.8 Å²	32.8	11%	0.107	18%	0.177	C	C	.	.	H	α-helix	trans	-65.3	-35.7	173.3	0	0	0	0	0	112.1	R948 L1003 E1004 I1005 Q1010 I1011 L1073	R948-A1007 VanDerWaalsContact CD-CB 3.49Å; R948-A1007 HydrophobicContact CG-CB 4.48Å; L1003-A1007 VanDerWaalsContact O-CB 3.28Å; L1003-A1007 WeakPolarHBondContact O-CB 3.13Å; L1003-A1007 PolarHBondContact O-N 2.86Å; E1004-A1007 PolarHBondContact O-N 3.15Å; I1005-A1007 VanDerWaalsContact C-N 3.28Å; I1005-A1007 PolarHBondContact O-N 2.87Å; A1007-Q1010 WeakPolarHBondContact O-CG 3.34Å; A1007-I1011 WeakPolarHBondContact O-CD1 3.44Å; A1007-I1011 WeakPolarHBondContact O-CG1 3.31Å; A1007-I1011 PolarHBondContact O-N 2.75Å; A1007-L1073 HydrophobicContact CB-CD1 3.97Å
1008	I	93.6	Very high	84.3	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-64.4	-47.9	173.4	-65	167.5	0	0	0	110.7	I944 L947 R948 I951 L971 E1004 I1005 S1006 Q1010 I1011 L1012	I944-I1008 HydrophobicContact CG2-CD1 4.21Å; L947-I1008 HydrophobicContact CD2-CD1 4.39Å; L947-I1008 HydrophobicContact CG-CD1 4.48Å; R948-I1008 HydrophobicContact CB-CD1 4.01Å; R948-I1008 HydrophobicContact CB-CG1 3.65Å; R948-I1008 HydrophobicContact CG-CG1 3.91Å; I951-I1008 HydrophobicContact CD1-CG1 4.38Å; I951-I1008 HydrophobicContact CD1-CG2 3.6Å; L971-I1008 HydrophobicContact CD1-CB 4.46Å; L971-I1008 HydrophobicContact CD1-CG2 3.6Å; L971-I1008 HydrophobicContact CD2-CB 4.24Å; L971-I1008 HydrophobicContact CD2-CD1 4.05Å; L971-I1008 HydrophobicContact CD2-CG2 4.03Å; L971-I1008 HydrophobicContact CG-CG2 4.47Å; E1004-I1008 WeakPolarHBondContact O-CG1 3.47Å; E1004-I1008 PolarHBondContact O-N 2.94Å; E1004-I1008 VanDerWaalsContact O-N 3.13Å; I1005-I1008 WeakPolarHBondContact O-CB 3.38Å; I1005-I1008 PolarHBondContact O-N 3.4Å; I1005-I1008 VanDerWaalsContact O-N 3.07Å; S1006-I1008 VanDerWaalsContact C-N 3.33Å; I1008-Q1010 VanDerWaalsContact C-N 3.33Å; I1008-Q1010 PolarHBondContact O-N 2.79Å; I1008-I1011 PolarHBondContact O-N 2.62Å; I1008-L1012 HydrophobicContact CG2-CD1 3.85Å; I1008-L1012 HydrophobicContact CG2-CG 4.43Å; I1008-L1012 PolarHBondContact O-N 2.77Å; I1008-L1012 VanDerWaalsContact O-N 3.11Å
1009	Y	93.4	Very high	81.7	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-54.4	-47.7	177.2	-88.9	-80.4	0	0	0	112.5	L971 N972 L975 I1005 S1006 I1011 L1012 A1013 F1041 V1045 L1057 F1077 I1084	L971-Y1009 HydrophobicContact CB-CE2 3.66Å; L971-Y1009 WeakPolarHBondContact CB-OH 3.41Å; L971-Y1009 HydrophobicContact CD1-CE2 4.48Å; L971-Y1009 PolarHBondContact O-OH 3.36Å; N972-Y1009 VanDerWaalsContact CA-OH 3.26Å; N972-Y1009 WeakPolarHBondContact CA-OH 3.33Å; N972-Y1009 PolarHBondContact N-OH 3.3Å; N972-Y1009 PolarHBondContact OD1-OH 2.8Å; L975-Y1009 HydrophobicContact CD2-CD2 4.4Å; L975-Y1009 HydrophobicContact CD2-CE2 3.77Å; I1005-Y1009 HydrophobicContact CG2-CD2 3.91Å; I1005-Y1009 HydrophobicContact CG2-CE2 3.7Å; I1005-Y1009 WeakPolarHBondContact O-CD2 3.45Å; I1005-Y1009 PolarHBondContact O-N 2.91Å; I1005-Y1009 VanDerWaalsContact O-N 3.09Å; S1006-Y1009 PolarHBondContact O-N 3.3Å; Y1009-I1011 VanDerWaalsContact C-N 3.33Å; Y1009-I1011 PolarHBondContact O-N 2.82Å; Y1009-L1012 PolarHBondContact O-N 3.13Å; Y1009-A1013 WeakPolarHBondContact O-CB 3.33Å; Y1009-A1013 PolarHBondContact O-N 3.14Å; Y1009-F1041 AromaticContact CD1-CE1 3.98Å; Y1009-F1041 HydrophobicContact CD1-CE1 3.98Å; Y1009-F1041 AromaticContact CD1-CZ 3.96Å; Y1009-F1041 HydrophobicContact CD1-CZ 3.96Å; Y1009-F1041 HydrophobicContact CE1-CE1 4.49Å; Y1009-F1041 HydrophobicContact CE1-CZ 4.18Å; Y1009-V1045 HydrophobicContact CD1-CG2 4.48Å; Y1009-V1045 HydrophobicContact CE1-CG1 4.08Å; Y1009-V1045 HydrophobicContact CE1-CG2 3.88Å; Y1009-L1057 HydrophobicContact CE1-CD2 4.3Å; Y1009-F1077 HydrophobicContact CD2-CE2 4.29Å; Y1009-F1077 HydrophobicContact CG-CE2 4.08Å; Y1009-I1084 HydrophobicContact CD1-CD1 4.16Å
1010	Q	92.1	Very high	79	Confident	26 Å²	26	39 Å²	39	12%	0.121	24%	0.235	C	C	.	.	H	α-helix	trans	-69.2	-31.8	-176	75.6	78.7	30.1	0	0	112.7	S1006 A1007 I1008 R1014 L1073 K1076 F1077 A1080	S1006-Q1010 PolarHBondContact O-N 3.47Å; S1006-Q1010 VanDerWaalsContact O-N 3.07Å; A1007-Q1010 WeakPolarHBondContact O-CG 3.34Å; I1008-Q1010 VanDerWaalsContact C-N 3.33Å; I1008-Q1010 PolarHBondContact O-N 2.79Å; Q1010-R1014 VanDerWaalsContact O-CB 3.31Å; Q1010-R1014 WeakPolarHBondContact O-CB 3.43Å; Q1010-R1014 WeakPolarHBondContact O-CG 3.46Å; Q1010-R1014 PolarHBondContact O-N 3.32Å; Q1010-L1073 HydrophobicContact CG-CD1 3.89Å; Q1010-K1076 HydrophobicContact CB-CB 4.23Å; Q1010-K1076 HydrophobicContact CG-CB 4.21Å; Q1010-F1077 HydrophobicContact CB-CB 4.45Å; Q1010-A1080 HydrophobicContact CB-CB 4.26Å
1011	I	90.9	Very high	76	Confident	33 Å²	33	46.1 Å²	46.1	17%	0.169	27%	0.267	C	S	.	.	H	α-helix	trans	-64.9	-53.2	175.3	-65.7	164	0	0	0	109.6	R948 I951 T952 A1007 I1008 Y1009 G1015	R948-I1011 HydrophobicContact CG-CD1 4.28Å; I951-I1011 HydrophobicContact CG2-CB 4.4Å; I951-I1011 HydrophobicContact CG2-CG2 3.95Å; T952-I1011 HydrophobicContact CG2-CD1 4.47Å; T952-I1011 VanDerWaalsContact OG1-CD1 3.3Å; T952-I1011 WeakPolarHBondContact OG1-CD1 3.21Å; A1007-I1011 WeakPolarHBondContact O-CD1 3.44Å; A1007-I1011 WeakPolarHBondContact O-CG1 3.31Å; A1007-I1011 PolarHBondContact O-N 2.75Å; I1008-I1011 PolarHBondContact O-N 2.62Å; Y1009-I1011 VanDerWaalsContact C-N 3.33Å; Y1009-I1011 PolarHBondContact O-N 2.82Å; I1011-G1015 PolarHBondContact O-N 3.35Å
1012	L	91.8	Very high	73	Confident	3 Å²	3	51.1 Å²	51.1	2%	0.016	30%	0.298	C	S	.	.	H	α-helix	trans	-74.6	-36.2	-172.1	-65.9	178.5	0	0	0	113.2	I951 I958 T959 V967 I1008 Y1009 S1038 F1041	I951-L1012 HydrophobicContact CD1-CD1 4.3Å; I951-L1012 HydrophobicContact CG2-CD1 4.25Å; I951-L1012 HydrophobicContact CG2-CD2 3.57Å; I951-L1012 HydrophobicContact CG2-CG 3.78Å; I958-L1012 HydrophobicContact CG2-CD1 3.83Å; I958-L1012 HydrophobicContact CG2-CD2 3.9Å; T959-L1012 HydrophobicContact CG2-CD2 4.12Å; V967-L1012 HydrophobicContact CG1-CD1 4.31Å; I1008-L1012 HydrophobicContact CG2-CD1 3.85Å; I1008-L1012 HydrophobicContact CG2-CG 4.43Å; I1008-L1012 PolarHBondContact O-N 2.77Å; I1008-L1012 VanDerWaalsContact O-N 3.11Å; Y1009-L1012 PolarHBondContact O-N 3.13Å; L1012-S1038 WeakPolarHBondContact O-CA 3.35Å; L1012-F1041 HydrophobicContact CB-CB 4.27Å; L1012-F1041 HydrophobicContact CB-CD1 3.47Å; L1012-F1041 VanDerWaalsContact CB-CD1 3.47Å; L1012-F1041 HydrophobicContact CB-CD2 3.92Å; L1012-F1041 HydrophobicContact CB-CE1 3.66Å; L1012-F1041 HydrophobicContact CB-CE2 4.09Å; L1012-F1041 HydrophobicContact CB-CG 3.6Å; L1012-F1041 HydrophobicContact CB-CZ 3.97Å; L1012-F1041 HydrophobicContact CD1-CD2 3.73Å; L1012-F1041 HydrophobicContact CD1-CE1 4.48Å; L1012-F1041 HydrophobicContact CD1-CE2 3.52Å; L1012-F1041 HydrophobicContact CD1-CG 4.3Å; L1012-F1041 HydrophobicContact CD1-CZ 3.93Å; L1012-F1041 HydrophobicContact CG-CD2 4.45Å; L1012-F1041 HydrophobicContact CG-CE2 4.48Å
1013	A	91.3	Very high	69.7	Low	0 Å²	0	57.7 Å²	57.7	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-77.2	-31.6	-176.9	0	0	0	0	0	113.7	Y1009 F1041 R1042 A1080 I1084	Y1009-A1013 WeakPolarHBondContact O-CB 3.33Å; Y1009-A1013 PolarHBondContact O-N 3.14Å; A1013-F1041 HydrophobicContact CB-CD1 4.12Å; A1013-F1041 HydrophobicContact CB-CE1 4.22Å; A1013-R1042 HydrophobicContact CB-CG 4.14Å; A1013-R1042 PolarHBondContact O-NH1 3.03Å; A1013-R1042 VanDerWaalsContact O-NH1 3.13Å; A1013-A1080 HydrophobicContact CB-CB 3.77Å; A1013-I1084 HydrophobicContact CB-CD1 3.98Å; A1013-I1084 HydrophobicContact CB-CG1 4.14Å
1014	R	88	Confident	66.7	Low	80 Å²	80	60.3 Å²	60.3	30%	0.302	36%	0.361	S	S	.	.	H	α-helix	trans	-84.6	-34.9	179.2	-65.6	179.2	65.8	-121.8	-5.3	112.4	Q1010 K1076 A1080 L1083	Q1010-R1014 VanDerWaalsContact O-CB 3.31Å; Q1010-R1014 WeakPolarHBondContact O-CB 3.43Å; Q1010-R1014 WeakPolarHBondContact O-CG 3.46Å; Q1010-R1014 PolarHBondContact O-N 3.32Å; R1014-K1076 WeakPolarHBondContact CD-O 3.39Å; R1014-A1080 HydrophobicContact CG-CB 4.28Å; R1014-L1083 HydrophobicContact CG-CD1 4.43Å
1015	G	73.9	Confident	63.7	Low	15 Å²	15	67.8 Å²	67.8	16%	0.155	40%	0.396	C	S	.	.			trans	77.8	161.8	-172.1	0	0	0	0	0	113.5	I1011 D1017 S1038	I1011-G1015 PolarHBondContact O-N 3.35Å; G1015-D1017 VanDerWaalsContact C-N 3.26Å; G1015-D1017 PolarHBondContact O-N 3.29Å; G1015-S1038 WeakPolarHBondContact CA-OG 3.44Å; G1015-S1038 PolarHBondContact N-OG 2.99Å
1016	S	61.4	Low	60.6	Low	84 Å²	84	73.2 Å²	73.2	59%	0.587	43%	0.429	S	S	*	.	S	Bend	trans	-77.7	-4.5	177.8	51.8	0	0	0	0	114.4	S1018	S1016-S1018 PolarHBondContact O-N 3.07Å
1017	D	50.7	Low	57.6	Low	140 Å²	140	80.3 Å²	80.3	75%	0.749	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.9	21.1	-171.4	-64.6	-17.5	0	0	0	114.7	G1015	G1015-D1017 VanDerWaalsContact C-N 3.26Å; G1015-D1017 PolarHBondContact O-N 3.29Å
1018	S	38.4	Very low	54.5	Low	91 Å²	91	84.3 Å²	84.3	64%	0.636	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.6	3.9	177.7	176.5	0	0	0	0	113.6	S1016	S1016-S1018 PolarHBondContact O-N 3.07Å
1019	A	30.8	Very low	51.3	Low	90 Å²	90	90.3 Å²	90.3	74%	0.744	54%	0.536	S	S	*	.	S	Bend	trans	-125.2	10.6	-170.2	0	0	0	0	0	116.7
1020	V	30.5	Very low	48.2	Very low	109 Å²	109	94.6 Å²	94.6	66%	0.661	57%	0.566	S	S	*	*			trans	-125.7	102.5	166.5	-174.8	0	0	0	0	108.4	T1022	V1020-T1022 HydrophobicContact CG1-CG2 3.93Å; V1020-T1022 PolarHBondContact O-N 2.96Å; V1020-T1022 PolarHBondContact O-OG1 3.41Å
1021	E	25.1	Very low	45.1	Very low	202 Å²	202	99.6 Å²	99.6	94%	0.944	60%	0.604	S	S	*	*			trans	-54.6	95.5	157.2	-69.9	178.6	167.2	0	0	107.3
1022	T	25.2	Very low	42.3	Very low	112 Å²	112	102.1 Å²	102.1	69%	0.687	62%	0.624	S	S	*	*			trans	-124.1	126.9	164.1	19.5	0	0	0	0	106.5	V1020	V1020-T1022 HydrophobicContact CG1-CG2 3.93Å; V1020-T1022 PolarHBondContact O-N 2.96Å; V1020-T1022 PolarHBondContact O-OG1 3.41Å
1023	D	23.9	Very low	39.9	Very low	142 Å²	142	107.8 Å²	107.8	76%	0.759	66%	0.664	S	S	*	*			trans	-49.5	136.7	-160.9	-59.4	-59.4	0	0	0	114.1	E1025	D1023-E1025 PolarHBondContact O-N 2.91Å
1024	A	28	Very low	37.7	Very low	99 Å²	99	114.7 Å²	114.7	82%	0.818	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.9	20.3	-177.3	0	0	0	0	0	115.5
1025	E	28.5	Very low	36.3	Very low	185 Å²	185	114.1 Å²	114.1	86%	0.864	71%	0.707	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.8	1.5	-177.9	-80.7	-171.8	154.7	0	0	115.1	D1023	D1023-E1025 PolarHBondContact O-N 2.91Å
1026	T	27.8	Very low	36.2	Very low	113 Å²	113	116.2 Å²	116.2	69%	0.693	72%	0.719	S	S	*	*	S	Bend	trans	-120.1	39.9	-178.1	-34.3	0	0	0	0	114
1027	I	32.7	Very low	36.9	Very low	150 Å²	150	114.5 Å²	114.5	77%	0.769	71%	0.707	S	S	*	*	S	Bend	trans	-111.1	-4.9	176.9	-64.2	176.6	0	0	0	112.4
1028	A	27.3	Very low	38.4	Very low	97 Å²	97	108.3 Å²	108.3	80%	0.802	67%	0.674	S	S	*	*	S	Bend	trans	-89.9	3.7	-172.3	0	0	0	0	0	116.5
1029	T	25.7	Very low	40.7	Very low	126 Å²	126	106.9 Å²	106.9	77%	0.773	66%	0.658	S	S	*	*	S	Bend	trans	-134.6	12.4	-170.3	45.1	0	0	0	0	117.6
1030	S	28.3	Very low	43.5	Very low	90 Å²	90	103.8 Å²	103.8	63%	0.629	63%	0.631	S	S	*	*			trans	-119.7	81.2	168.8	45.8	0	0	0	0	111.7	S1032	S1030-S1032 PolarHBondContact O-N 3.28Å
1031	S	27.4	Very low	46.4	Very low	131 Å²	131	98.6 Å²	98.6	92%	0.916	60%	0.599	S	S	*	*			trans	-66.4	71.6	154.9	56.8	0	0	0	0	109.3
1032	S	31.5	Very low	49.6	Very low	86 Å²	86	90.6 Å²	90.6	60%	0.601	56%	0.56	S	S	*	*			trans	-100.9	119.7	165.9	57.5	0	0	0	0	108	S1030 L1034	S1030-S1032 PolarHBondContact O-N 3.28Å; S1032-L1034 PolarHBondContact O-N 3.01Å
1033	S	41.2	Very low	52.7	Low	122 Å²	122	87.9 Å²	87.9	85%	0.853	54%	0.538	S	S	*	.	S	Bend	trans	-69.8	31.5	-170.1	55.7	0	0	0	0	115.9
1034	L	45.8	Very low	55.9	Low	145 Å²	145	81.3 Å²	81.3	76%	0.759	50%	0.503	S	S	*	.			trans	-115.4	124.8	174.8	-113.4	81.9	0	0	0	109.8	S1032	S1032-L1034 PolarHBondContact O-N 3.01Å
1035	P	58.9	Low	59	Low	68 Å²	68	76.6 Å²	76.6	44%	0.442	46%	0.464	S	S	.	.			trans	-60.4	144.4	175	22.8	-29.8	0	0	0	110.6	E1039	P1035-E1039 HydrophobicContact CB-CB 4.19Å; P1035-E1039 HydrophobicContact CB-CG 4.01Å
1036	S	71	Confident	62	Low	59 Å²	59	68 Å²	68	41%	0.413	42%	0.424	S	S	.	.			trans	-58.4	151.5	173.2	59.6	0	0	0	0	110.3	S1038 E1039 S1040	S1036-S1038 PolarHBondContact O-N 3.37Å; S1036-E1039 PolarHBondContact N-OE2 2.97Å; S1036-E1039 WeakPolarHBondContact O-CA 3.48Å; S1036-E1039 WeakPolarHBondContact O-CB 3.28Å; S1036-E1039 PolarHBondContact O-N 2.97Å; S1036-E1039 WeakPolarHBondContact OG-CB 3.24Å; S1036-E1039 PolarHBondContact OG-OE2 2.73Å; S1036-S1040 PolarHBondContact O-N 3.47Å; S1036-S1040 PolarHBondContact O-OG 2.96Å
1037	S	76.6	Confident	64.8	Low	48 Å²	48	64.8 Å²	64.8	34%	0.336	41%	0.406	S	S	.	.	H	α-helix	trans	-51.1	-44.1	-178.1	48.8	0	0	0	0	112.6	T959 S1040 F1041	T959-S1037 WeakPolarHBondContact CB-O 3.46Å; T959-S1037 VanDerWaalsContact CG2-O 3.3Å; T959-S1037 WeakPolarHBondContact CG2-O 3.45Å; T959-S1037 WeakPolarHBondContact OG1-CB 3.27Å; S1037-S1040 WeakPolarHBondContact O-CB 3.19Å; S1037-S1040 PolarHBondContact O-N 3.11Å; S1037-F1041 PolarHBondContact O-N 2.94Å
1038	S	82.4	Confident	67.4	Low	9 Å²	9	58 Å²	58	6%	0.063	37%	0.371	C	S	.	.	H	α-helix	trans	-66.9	-35.6	176.7	-43.8	0	0	0	0	113.2	L1012 G1015 S1036 F1041 R1042	L1012-S1038 WeakPolarHBondContact O-CA 3.35Å; G1015-S1038 WeakPolarHBondContact CA-OG 3.44Å; G1015-S1038 PolarHBondContact N-OG 2.99Å; S1036-S1038 PolarHBondContact O-N 3.37Å; S1038-F1041 PolarHBondContact O-N 2.7Å; S1038-R1042 WeakPolarHBondContact O-CG 3.32Å; S1038-R1042 PolarHBondContact O-N 3.26Å
1039	E	87	Confident	70	Confident	61 Å²	61	61 Å²	61	29%	0.285	37%	0.369	S	S	.	.	H	α-helix	trans	-66.7	-39.6	175.9	-175	179.2	-178.6	0	0	111.5	P1035 S1036 F1041 R1042 R1043	P1035-E1039 HydrophobicContact CB-CB 4.19Å; P1035-E1039 HydrophobicContact CB-CG 4.01Å; S1036-E1039 PolarHBondContact N-OE2 2.97Å; S1036-E1039 WeakPolarHBondContact O-CA 3.48Å; S1036-E1039 WeakPolarHBondContact O-CB 3.28Å; S1036-E1039 PolarHBondContact O-N 2.97Å; S1036-E1039 WeakPolarHBondContact OG-CB 3.24Å; S1036-E1039 PolarHBondContact OG-OE2 2.73Å; E1039-F1041 VanDerWaalsContact C-N 3.29Å; E1039-F1041 PolarHBondContact O-N 2.93Å; E1039-R1042 VanDerWaalsContact CA-NH2 3.35Å; E1039-R1042 VanDerWaalsContact CB-NH2 3.32Å; E1039-R1042 PolarHBondContact O-N 3.01Å; E1039-R1043 VanDerWaalsContact O-CB 3.29Å; E1039-R1043 WeakPolarHBondContact O-CB 3.49Å; E1039-R1043 PolarHBondContact O-N 3.06Å
1040	S	87.7	Confident	72.8	Confident	26 Å²	26	61.1 Å²	61.1	18%	0.182	36%	0.355	C	S	.	.	H	α-helix	trans	-57.2	-43.2	174.3	-57.5	0	0	0	0	111.4	S1036 S1037 A1044	S1036-S1040 PolarHBondContact O-N 3.47Å; S1036-S1040 PolarHBondContact O-OG 2.96Å; S1037-S1040 WeakPolarHBondContact O-CB 3.19Å; S1037-S1040 PolarHBondContact O-N 3.11Å; S1040-A1044 WeakPolarHBondContact O-CB 3.38Å; S1040-A1044 PolarHBondContact O-N 3.08Å
1041	F	92.1	Very high	75.6	Confident	0 Å²	0	57.7 Å²	57.7	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-67.3	-46.1	175	178.8	-102.7	0	0	0	113.1	T959 V964 A968 L971 Y1009 L1012 A1013 S1037 S1038 E1039 R1043 A1044 V1045	T959-F1041 HydrophobicContact CG2-CB 4.22Å; V964-F1041 HydrophobicContact CG2-CB 4.04Å; V964-F1041 HydrophobicContact CG2-CD2 4.12Å; A968-F1041 HydrophobicContact CB-CE2 4.27Å; L971-F1041 HydrophobicContact CD1-CE2 4.02Å; L971-F1041 HydrophobicContact CD1-CZ 3.92Å; Y1009-F1041 AromaticContact CD1-CE1 3.98Å; Y1009-F1041 HydrophobicContact CD1-CE1 3.98Å; Y1009-F1041 AromaticContact CD1-CZ 3.96Å; Y1009-F1041 HydrophobicContact CD1-CZ 3.96Å; Y1009-F1041 HydrophobicContact CE1-CE1 4.49Å; Y1009-F1041 HydrophobicContact CE1-CZ 4.18Å; L1012-F1041 HydrophobicContact CB-CB 4.27Å; L1012-F1041 HydrophobicContact CB-CD1 3.47Å; L1012-F1041 VanDerWaalsContact CB-CD1 3.47Å; L1012-F1041 HydrophobicContact CB-CD2 3.92Å; L1012-F1041 HydrophobicContact CB-CE1 3.66Å; L1012-F1041 HydrophobicContact CB-CE2 4.09Å; L1012-F1041 HydrophobicContact CB-CG 3.6Å; L1012-F1041 HydrophobicContact CB-CZ 3.97Å; L1012-F1041 HydrophobicContact CD1-CD2 3.73Å; L1012-F1041 HydrophobicContact CD1-CE1 4.48Å; L1012-F1041 HydrophobicContact CD1-CE2 3.52Å; L1012-F1041 HydrophobicContact CD1-CG 4.3Å; L1012-F1041 HydrophobicContact CD1-CZ 3.93Å; L1012-F1041 HydrophobicContact CG-CD2 4.45Å; L1012-F1041 HydrophobicContact CG-CE2 4.48Å; A1013-F1041 HydrophobicContact CB-CD1 4.12Å; A1013-F1041 HydrophobicContact CB-CE1 4.22Å; S1037-F1041 PolarHBondContact O-N 2.94Å; S1038-F1041 PolarHBondContact O-N 2.7Å; E1039-F1041 VanDerWaalsContact C-N 3.29Å; E1039-F1041 PolarHBondContact O-N 2.93Å; F1041-R1043 PolarHBondContact O-N 2.81Å; F1041-A1044 PolarHBondContact O-N 3.15Å; F1041-V1045 HydrophobicContact CD1-CG2 4.13Å; F1041-V1045 HydrophobicContact CD2-CG2 4.39Å; F1041-V1045 HydrophobicContact CE1-CG2 3.66Å; F1041-V1045 HydrophobicContact CE2-CG2 3.94Å; F1041-V1045 HydrophobicContact CG-CG2 4.49Å; F1041-V1045 HydrophobicContact CZ-CG2 3.55Å; F1041-V1045 WeakPolarHBondContact O-CG2 3.37Å; F1041-V1045 PolarHBondContact O-N 3.32Å
1042	R	93.2	Very high	78.6	Confident	33 Å²	33	52.5 Å²	52.5	13%	0.125	29%	0.292	C	S	.	.	H	α-helix	trans	-58.2	-42.6	177.7	-68.2	-171	-55.4	-91.5	0.4	110.9	A1013 S1038 E1039 V1045 V1046 I1084 E1087	A1013-R1042 HydrophobicContact CB-CG 4.14Å; A1013-R1042 PolarHBondContact O-NH1 3.03Å; A1013-R1042 VanDerWaalsContact O-NH1 3.13Å; S1038-R1042 WeakPolarHBondContact O-CG 3.32Å; S1038-R1042 PolarHBondContact O-N 3.26Å; E1039-R1042 VanDerWaalsContact CA-NH2 3.35Å; E1039-R1042 VanDerWaalsContact CB-NH2 3.32Å; E1039-R1042 PolarHBondContact O-N 3.01Å; R1042-V1045 PolarHBondContact O-N 2.9Å; R1042-V1046 WeakPolarHBondContact O-CG2 3.43Å; R1042-V1046 PolarHBondContact O-N 3.48Å; R1042-I1084 HydrophobicContact CB-CG1 4.35Å; R1042-I1084 HydrophobicContact CG-CG1 3.9Å; R1042-E1087 HydrophobicContact CB-CB 3.97Å; R1042-E1087 HydrophobicContact CB-CG 3.84Å; R1042-E1087 IonicContact NE-OE2 2.85Å; R1042-E1087 IonicContact NH2-OE2 3.38Å
1043	R	90.1	Very high	81.3	Confident	56 Å²	56	51.5 Å²	51.5	21%	0.211	28%	0.283	C	S	.	.	H	α-helix	trans	-63.6	-44.9	177.8	-173.8	65.2	79.4	124.9	10.5	111.1	E1039 F1041 V1045 V1046 S1047 E1087 E1094	E1039-R1043 VanDerWaalsContact O-CB 3.29Å; E1039-R1043 WeakPolarHBondContact O-CB 3.49Å; E1039-R1043 PolarHBondContact O-N 3.06Å; F1041-R1043 PolarHBondContact O-N 2.81Å; R1043-V1045 VanDerWaalsContact C-N 3.34Å; R1043-V1045 PolarHBondContact O-N 3.39Å; R1043-V1046 WeakPolarHBondContact O-CG2 3.48Å; R1043-V1046 PolarHBondContact O-N 2.92Å; R1043-S1047 WeakPolarHBondContact O-CB 3.49Å; R1043-S1047 PolarHBondContact O-N 3.4Å; R1043-S1047 PolarHBondContact O-OG 3.34Å; R1043-E1087 HydrophobicContact CB-CG 4.35Å; R1043-E1087 IonicContact CZ-OE1 2.82Å; R1043-E1087 IonicContact NE-OE1 2.66Å; R1043-E1087 PolarHBondContact NE-OE1 3.15Å; R1043-E1087 IonicContact NH2-OE1 3.36Å; R1043-E1094 IonicContact CZ-OE1 3.73Å; R1043-E1094 IonicContact CZ-OE2 3.57Å; R1043-E1094 IonicContact NH1-OE1 3.46Å; R1043-E1094 IonicContact NH1-OE2 3.61Å; R1043-E1094 PolarHBondContact NH1-OE2 3.37Å; R1043-E1094 IonicContact NH2-OE1 3.42Å; R1043-E1094 PolarHBondContact NH2-OE1 3.06Å; R1043-E1094 IonicContact NH2-OE2 2.8Å; R1043-E1094 PolarHBondContact NH2-OE2 2.9Å
1044	A	90.4	Very high	83.2	Confident	3 Å²	3	49.5 Å²	49.5	3%	0.025	27%	0.267	C	S	.	.	H	α-helix	trans	-59.6	-42	175.7	0	0	0	0	0	112.6	V964 D965 A968 S1040 F1041 V1046 S1047 D1048	V964-A1044 HydrophobicContact CG1-CB 4.27Å; V964-A1044 HydrophobicContact CG2-CB 3.84Å; D965-A1044 WeakPolarHBondContact OD1-CB 3.49Å; A968-A1044 HydrophobicContact CB-CB 3.71Å; S1040-A1044 WeakPolarHBondContact O-CB 3.38Å; S1040-A1044 PolarHBondContact O-N 3.08Å; F1041-A1044 PolarHBondContact O-N 3.15Å; A1044-V1046 PolarHBondContact O-N 2.73Å; A1044-S1047 PolarHBondContact O-N 2.87Å; A1044-S1047 VanDerWaalsContact O-N 3.16Å; A1044-D1048 PolarHBondContact O-N 3.32Å
1045	V	92.7	Very high	85.3	Confident	0 Å²	0	47 Å²	47	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-60	-43.7	178.3	169.3	0	0	0	0	112.2	A968 N972 Y1009 F1041 R1042 R1043 S1047 F1052 I1084	A968-V1045 HydrophobicContact CB-CG2 3.89Å; N972-V1045 PolarHBondContact ND2-O 3.41Å; Y1009-V1045 HydrophobicContact CD1-CG2 4.48Å; Y1009-V1045 HydrophobicContact CE1-CG1 4.08Å; Y1009-V1045 HydrophobicContact CE1-CG2 3.88Å; F1041-V1045 HydrophobicContact CD1-CG2 4.13Å; F1041-V1045 HydrophobicContact CD2-CG2 4.39Å; F1041-V1045 HydrophobicContact CE1-CG2 3.66Å; F1041-V1045 HydrophobicContact CE2-CG2 3.94Å; F1041-V1045 HydrophobicContact CG-CG2 4.49Å; F1041-V1045 HydrophobicContact CZ-CG2 3.55Å; F1041-V1045 WeakPolarHBondContact O-CG2 3.37Å; F1041-V1045 PolarHBondContact O-N 3.32Å; R1042-V1045 PolarHBondContact O-N 2.9Å; R1043-V1045 VanDerWaalsContact C-N 3.34Å; R1043-V1045 PolarHBondContact O-N 3.39Å; V1045-S1047 VanDerWaalsContact C-N 3.31Å; V1045-F1052 HydrophobicContact CG1-CD2 3.79Å; V1045-F1052 HydrophobicContact CG1-CE2 3.86Å; V1045-F1052 WeakPolarHBondContact O-CB 3.37Å; V1045-F1052 WeakPolarHBondContact O-CG 3.2Å; V1045-I1084 HydrophobicContact CB-CG2 4.48Å; V1045-I1084 HydrophobicContact CG1-CD1 4.44Å; V1045-I1084 HydrophobicContact CG1-CG2 3.86Å
1046	V	92.2	Very high	86.9	Confident	5 Å²	5	43.8 Å²	43.8	3%	0.03	23%	0.233	C	C	.	.	H	α-helix	trans	-81	-12.7	179.1	-60.2	0	0	0	0	113.2	R1042 R1043 A1044 F1052 I1084 E1087 N1088 K1091	R1042-V1046 WeakPolarHBondContact O-CG2 3.43Å; R1042-V1046 PolarHBondContact O-N 3.48Å; R1043-V1046 WeakPolarHBondContact O-CG2 3.48Å; R1043-V1046 PolarHBondContact O-N 2.92Å; A1044-V1046 PolarHBondContact O-N 2.73Å; V1046-F1052 HydrophobicContact CB-CE1 4.26Å; V1046-F1052 HydrophobicContact CG1-CE1 3.87Å; V1046-F1052 HydrophobicContact CG1-CZ 3.86Å; V1046-I1084 HydrophobicContact CG1-CG2 3.7Å; V1046-E1087 HydrophobicContact CG2-CG 4.28Å; V1046-N1088 HydrophobicContact CB-CB 4.25Å; V1046-N1088 HydrophobicContact CG1-CB 3.66Å; V1046-K1091 HydrophobicContact CB-CD 4.29Å; V1046-K1091 HydrophobicContact CG2-CB 4.1Å; V1046-K1091 HydrophobicContact CG2-CD 3.55Å; V1046-K1091 HydrophobicContact CG2-CG 4.46Å; V1046-K1091 PolarHBondContact O-NZ 3.17Å
1047	S	86.2	Confident	87.9	Confident	46 Å²	46	41.1 Å²	41.1	32%	0.322	21%	0.214	S	C	.	.	H	α-helix	trans	-82.4	-17.1	176.7	-57	0	0	0	0	113.2	R1043 A1044 V1045 E1049 K1091	R1043-S1047 WeakPolarHBondContact O-CB 3.49Å; R1043-S1047 PolarHBondContact O-N 3.4Å; R1043-S1047 PolarHBondContact O-OG 3.34Å; A1044-S1047 PolarHBondContact O-N 2.87Å; A1044-S1047 VanDerWaalsContact O-N 3.16Å; V1045-S1047 VanDerWaalsContact C-N 3.31Å; S1047-E1049 PolarHBondContact O-N 2.73Å; S1047-K1091 VanDerWaalsContact CA-CE 3.47Å; S1047-K1091 WeakPolarHBondContact OG-CD 3.24Å; S1047-K1091 WeakPolarHBondContact OG-CE 3.33Å
1048	D	87.5	Confident	88.6	Confident	6 Å²	6	40.8 Å²	40.8	3%	0.032	21%	0.209	C	C	.	.			trans	-78.3	88.1	175.8	173	28.1	0	0	0	111.8	N972 A1044 R1050 S1051 F1052	N972-D1048 WeakPolarHBondContact CB-OD2 3.41Å; N972-D1048 WeakPolarHBondContact ND2-CB 3.33Å; N972-D1048 PolarHBondContact ND2-OD2 3.2Å; A1044-D1048 PolarHBondContact O-N 3.32Å; D1048-R1050 PolarHBondContact O-N 3.09Å; D1048-R1050 VanDerWaalsContact O-N 3.08Å; D1048-R1050 VanDerWaalsContact OD1-CB 3.3Å; D1048-R1050 WeakPolarHBondContact OD1-CB 3.31Å; D1048-R1050 PolarHBondContact OD1-N 2.94Å; D1048-R1050 VanDerWaalsContact OD1-N 3.15Å; D1048-S1051 PolarHBondContact OD1-N 2.87Å; D1048-S1051 VanDerWaalsContact OD2-CB 3.3Å; D1048-S1051 WeakPolarHBondContact OD2-CB 3.31Å; D1048-F1052 WeakPolarHBondContact O-CB 3.49Å; D1048-F1052 PolarHBondContact O-N 3.47Å; D1048-F1052 VanDerWaalsContact O-N 3.1Å
1049	E	82.1	Confident	89.1	Confident	161 Å²	161	42.8 Å²	42.8	75%	0.752	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-15.4	177.5	-60.4	-177.4	172.5	0	0	114	S1047	S1047-E1049 PolarHBondContact O-N 2.73Å
1050	R	83.7	Confident	89.3	Confident	129 Å²	129	39.9 Å²	39.9	49%	0.487	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.7	-39.9	-165	-46.4	170.3	146.7	-155.9	-14.4	110.2	D773 I776 D1048	D773-R1050 IonicContact OD1-CZ 3Å; D773-R1050 IonicContact OD1-NH1 3.67Å; D773-R1050 PolarHBondContact OD1-NH1 2.97Å; D773-R1050 IonicContact OD1-NH2 3.26Å; I776-R1050 HydrophobicContact CB-CG 4.45Å; I776-R1050 VanDerWaalsContact CB-NH1 3.26Å; I776-R1050 VanDerWaalsContact CD1-CD 3.47Å; I776-R1050 HydrophobicContact CG1-CB 4.17Å; I776-R1050 VanDerWaalsContact CG1-CD 3.48Å; I776-R1050 HydrophobicContact CG1-CG 4.24Å; I776-R1050 HydrophobicContact CG2-CB 4.08Å; I776-R1050 HydrophobicContact CG2-CG 3.55Å; D1048-R1050 PolarHBondContact O-N 3.09Å; D1048-R1050 VanDerWaalsContact O-N 3.08Å; D1048-R1050 VanDerWaalsContact OD1-CB 3.3Å; D1048-R1050 WeakPolarHBondContact OD1-CB 3.31Å; D1048-R1050 PolarHBondContact OD1-N 2.94Å; D1048-R1050 VanDerWaalsContact OD1-N 3.15Å
1051	S	87.5	Confident	89.5	Confident	18 Å²	18	40 Å²	40	13%	0.126	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-120.5	-24.6	-177.8	-52.8	0	0	0	0	114.5	Y973 T976 D1048	Y973-S1051 WeakPolarHBondContact CA-OG 3.46Å; T976-S1051 PolarHBondContact OG1-O 2.77Å; D1048-S1051 PolarHBondContact OD1-N 2.87Å; D1048-S1051 VanDerWaalsContact OD2-CB 3.3Å; D1048-S1051 WeakPolarHBondContact OD2-CB 3.31Å
1052	F	90.2	Very high	89.5	Confident	22 Å²	22	47.3 Å²	47.3	10%	0.096	23%	0.231	C	C	.	.			trans	-74.4	133.6	-179.4	-175.3	-105.4	0	0	0	111.4	V1045 V1046 D1048 L1057 I1084	V1045-F1052 HydrophobicContact CG1-CD2 3.79Å; V1045-F1052 HydrophobicContact CG1-CE2 3.86Å; V1045-F1052 WeakPolarHBondContact O-CB 3.37Å; V1045-F1052 WeakPolarHBondContact O-CG 3.2Å; V1046-F1052 HydrophobicContact CB-CE1 4.26Å; V1046-F1052 HydrophobicContact CG1-CE1 3.87Å; V1046-F1052 HydrophobicContact CG1-CZ 3.86Å; D1048-F1052 WeakPolarHBondContact O-CB 3.49Å; D1048-F1052 PolarHBondContact O-N 3.47Å; D1048-F1052 VanDerWaalsContact O-N 3.1Å; F1052-L1057 HydrophobicContact CE2-CD1 4.08Å; F1052-L1057 HydrophobicContact CE2-CG 4.28Å; F1052-I1084 HydrophobicContact CE2-CG2 4.08Å; F1052-I1084 HydrophobicContact CZ-CG2 4.12Å
1053	T	88.5	Confident	89.4	Confident	65 Å²	65	46.6 Å²	46.6	40%	0.399	23%	0.231	S	C	.	.			trans	-133.1	150.4	166.9	58.3	0	0	0	0	109	D1055 L1056	T1053-D1055 PolarHBondContact O-N 3Å; T1053-L1056 VanDerWaalsContact O-CB 3.3Å; T1053-L1056 WeakPolarHBondContact O-CB 3.37Å; T1053-L1056 PolarHBondContact O-N 3.26Å; T1053-L1056 WeakPolarHBondContact OG1-CB 3.28Å; T1053-L1056 PolarHBondContact OG1-N 3.07Å
1054	P	81.9	Confident	89.4	Confident	79 Å²	79	44 Å²	44	51%	0.513	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55	-27.6	-179.5	-27.5	35.1	0	0	0	114.1	K1085	P1054-K1085 WeakPolarHBondContact O-CE 3.43Å
1055	D	89.5	Confident	89.4	Confident	93 Å²	93	49.2 Å²	49.2	50%	0.497	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.1	-12.5	-179.5	-61.2	-33	0	0	0	113.8	T1053 L1057 D1058 Q1059	T1053-D1055 PolarHBondContact O-N 3Å; D1055-L1057 VanDerWaalsContact C-N 3.32Å; D1055-L1057 PolarHBondContact O-N 3.01Å; D1055-D1058 WeakPolarHBondContact O-CB 3.12Å; D1055-D1058 PolarHBondContact O-N 3.39Å; D1055-D1058 VanDerWaalsContact O-N 3.12Å; D1055-Q1059 WeakPolarHBondContact O-CG 3.37Å; D1055-Q1059 PolarHBondContact O-N 3Å
1056	L	91.7	Very high	89.3	Confident	1 Å²	1	57.9 Å²	57.9	1%	0.005	28%	0.281	C	S	.	.	H	α-helix	trans	-54.5	-49.6	-174.5	172.4	59.3	0	0	0	111.5	L975 T976 V979 T1053 D1058 Q1059 A1060	L975-L1056 HydrophobicContact CB-CD1 4.49Å; L975-L1056 HydrophobicContact CD2-CD1 4.42Å; L975-L1056 HydrophobicContact CD2-CD2 4.47Å; L975-L1056 HydrophobicContact CD2-CG 4.2Å; L975-L1056 HydrophobicContact CG-CD1 4.16Å; L975-L1056 HydrophobicContact CG-CG 4.46Å; T976-L1056 VanDerWaalsContact OG1-CD1 3.26Å; T976-L1056 WeakPolarHBondContact OG1-CD1 3.38Å; T976-L1056 VanDerWaalsContact OG1-CD2 3.3Å; T976-L1056 WeakPolarHBondContact OG1-CD2 3.21Å; V979-L1056 HydrophobicContact CG2-CD1 3.76Å; T1053-L1056 VanDerWaalsContact O-CB 3.3Å; T1053-L1056 WeakPolarHBondContact O-CB 3.37Å; T1053-L1056 PolarHBondContact O-N 3.26Å; T1053-L1056 WeakPolarHBondContact OG1-CB 3.28Å; T1053-L1056 PolarHBondContact OG1-N 3.07Å; L1056-D1058 VanDerWaalsContact C-N 3.33Å; L1056-D1058 PolarHBondContact O-N 2.85Å; L1056-Q1059 WeakPolarHBondContact O-CB 3.44Å; L1056-Q1059 PolarHBondContact O-N 3.14Å; L1056-A1060 PolarHBondContact O-N 3.05Å
1057	L	92.1	Very high	89.1	Confident	2 Å²	2	60.4 Å²	60.4	1%	0.01	29%	0.294	C	S	.	.	H	α-helix	trans	-71	-30.3	-177.7	-60.3	-178.4	0	0	0	111.9	L975 Y1009 F1052 D1055 A1060 C1061 F1077 V1081 I1084	L975-L1057 HydrophobicContact CD2-CD2 3.87Å; Y1009-L1057 HydrophobicContact CE1-CD2 4.3Å; F1052-L1057 HydrophobicContact CE2-CD1 4.08Å; F1052-L1057 HydrophobicContact CE2-CG 4.28Å; D1055-L1057 VanDerWaalsContact C-N 3.32Å; D1055-L1057 PolarHBondContact O-N 3.01Å; L1057-A1060 WeakPolarHBondContact O-CB 3.14Å; L1057-A1060 PolarHBondContact O-N 2.54Å; L1057-C1061 PolarHBondContact O-N 3.21Å; L1057-C1061 PolarHBondContact O-SG 3.09Å; L1057-C1061 VanDerWaalsContact O-SG 3.37Å; L1057-F1077 HydrophobicContact CD2-CZ 4.17Å; L1057-V1081 HydrophobicContact CB-CB 4.27Å; L1057-V1081 HydrophobicContact CB-CG1 3.73Å; L1057-V1081 HydrophobicContact CB-CG2 3.67Å; L1057-V1081 HydrophobicContact CD1-CG1 4.29Å; L1057-V1081 HydrophobicContact CD1-CG2 4.29Å; L1057-I1084 HydrophobicContact CD1-CB 4.02Å; L1057-I1084 HydrophobicContact CD1-CD1 3.76Å; L1057-I1084 HydrophobicContact CD1-CG2 3.8Å
1058	D	92.4	Very high	89	Confident	41 Å²	41	62.5 Å²	62.5	22%	0.219	31%	0.314	C	S	.	.	H	α-helix	trans	-68.7	-37.1	172.8	-64.3	-36	0	0	0	111.6	D1055 L1056 A1060 C1061 R1062 K1085	D1055-D1058 WeakPolarHBondContact O-CB 3.12Å; D1055-D1058 PolarHBondContact O-N 3.39Å; D1055-D1058 VanDerWaalsContact O-N 3.12Å; L1056-D1058 VanDerWaalsContact C-N 3.33Å; L1056-D1058 PolarHBondContact O-N 2.85Å; D1058-A1060 VanDerWaalsContact C-N 3.32Å; D1058-C1061 PolarHBondContact O-N 3.27Å; D1058-R1062 WeakPolarHBondContact O-CG 3.42Å; D1058-R1062 PolarHBondContact O-N 3.33Å; D1058-R1062 VanDerWaalsContact O-N 3.09Å; D1058-K1085 IonicContact OD1-NZ 3.77Å; D1058-K1085 PolarHBondContact OD1-NZ 2.96Å; D1058-K1085 IonicContact OD2-NZ 3.67Å; D1058-K1085 PolarHBondContact OD2-NZ 2.93Å
1059	Q	91.5	Very high	88.8	Confident	52 Å²	52	62.7 Å²	62.7	24%	0.243	32%	0.317	C	S	.	.	H	α-helix	trans	-62.9	-42.3	173.1	-67.2	168.9	24.3	0	0	110.5	V979 D1055 L1056 R1062 V1063	V979-Q1059 HydrophobicContact CB-CB 4.39Å; V979-Q1059 HydrophobicContact CG2-CB 3.86Å; D1055-Q1059 WeakPolarHBondContact O-CG 3.37Å; D1055-Q1059 PolarHBondContact O-N 3Å; L1056-Q1059 WeakPolarHBondContact O-CB 3.44Å; L1056-Q1059 PolarHBondContact O-N 3.14Å; Q1059-R1062 PolarHBondContact O-N 2.98Å; Q1059-V1063 WeakPolarHBondContact O-CG2 3.35Å; Q1059-V1063 PolarHBondContact O-N 3.04Å
1060	A	92.2	Very high	89.2	Confident	0 Å²	0	59 Å²	59	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-60.9	-45.5	174.7	0	0	0	0	0	112.3	L975 V979 L1056 L1057 D1058 R1062 V1063 L1064 F1077	L975-A1060 HydrophobicContact CD1-CB 3.98Å; L975-A1060 HydrophobicContact CD2-CB 4.02Å; L975-A1060 HydrophobicContact CG-CB 4.29Å; V979-A1060 HydrophobicContact CG1-CB 4.38Å; V979-A1060 HydrophobicContact CG2-CB 4.47Å; L1056-A1060 PolarHBondContact O-N 3.05Å; L1057-A1060 WeakPolarHBondContact O-CB 3.14Å; L1057-A1060 PolarHBondContact O-N 2.54Å; D1058-A1060 VanDerWaalsContact C-N 3.32Å; A1060-R1062 VanDerWaalsContact C-N 3.34Å; A1060-R1062 PolarHBondContact O-N 3.46Å; A1060-V1063 PolarHBondContact O-N 2.97Å; A1060-V1063 VanDerWaalsContact O-N 3.09Å; A1060-L1064 WeakPolarHBondContact O-CG 3.45Å; A1060-L1064 PolarHBondContact O-N 3.22Å; A1060-F1077 HydrophobicContact CB-CE1 3.84Å; A1060-F1077 HydrophobicContact CB-CZ 3.87Å
1061	C	92.4	Very high	89.4	Confident	27 Å²	27	59.1 Å²	59.1	18%	0.182	32%	0.315	C	S	.	.	H	α-helix	trans	-54.5	-47.5	173.5	-70.6	0	0	0	0	112	L1057 D1058 V1063 L1064 D1065 F1077	L1057-C1061 PolarHBondContact O-N 3.21Å; L1057-C1061 PolarHBondContact O-SG 3.09Å; L1057-C1061 VanDerWaalsContact O-SG 3.37Å; D1058-C1061 PolarHBondContact O-N 3.27Å; C1061-V1063 VanDerWaalsContact C-N 3.26Å; C1061-V1063 PolarHBondContact O-N 3.33Å; C1061-L1064 WeakPolarHBondContact O-CB 3.44Å; C1061-L1064 PolarHBondContact O-N 3.43Å; C1061-D1065 PolarHBondContact O-N 3.32Å; C1061-F1077 VanDerWaalsContact SG-CD1 3.59Å
1062	R	91.7	Very high	89.6	Confident	154 Å²	154	62.8 Å²	62.8	58%	0.581	33%	0.333	S	S	*	.	H	α-helix	trans	-62.9	-32.8	178.5	-66.9	171.6	-166.1	159.2	6.8	112.9	D1058 Q1059 A1060 R1066	D1058-R1062 WeakPolarHBondContact O-CG 3.42Å; D1058-R1062 PolarHBondContact O-N 3.33Å; D1058-R1062 VanDerWaalsContact O-N 3.09Å; Q1059-R1062 PolarHBondContact O-N 2.98Å; A1060-R1062 VanDerWaalsContact C-N 3.34Å; A1060-R1062 PolarHBondContact O-N 3.46Å; R1062-R1066 WeakPolarHBondContact O-CB 3.4Å; R1062-R1066 PolarHBondContact O-N 3.43Å
1063	V	90.2	Very high	89.6	Confident	19 Å²	19	62.8 Å²	62.8	12%	0.115	34%	0.335	C	S	.	.	H	α-helix	trans	-72.3	-44	175.5	173.1	0	0	0	0	110.3	V979 V1002 Q1059 A1060 C1061 D1065 R1066 I1067	V979-V1063 HydrophobicContact CB-CG2 4.12Å; V979-V1063 HydrophobicContact CG1-CB 4.32Å; V979-V1063 HydrophobicContact CG1-CG2 4.06Å; V1002-V1063 HydrophobicContact CG1-CG1 4.17Å; Q1059-V1063 WeakPolarHBondContact O-CG2 3.35Å; Q1059-V1063 PolarHBondContact O-N 3.04Å; A1060-V1063 PolarHBondContact O-N 2.97Å; A1060-V1063 VanDerWaalsContact O-N 3.09Å; C1061-V1063 VanDerWaalsContact C-N 3.26Å; C1061-V1063 PolarHBondContact O-N 3.33Å; V1063-D1065 VanDerWaalsContact C-N 3.33Å; V1063-D1065 PolarHBondContact O-N 3.18Å; V1063-R1066 WeakPolarHBondContact O-CB 3.38Å; V1063-R1066 PolarHBondContact O-N 3.47Å; V1063-R1066 VanDerWaalsContact O-N 3.08Å; V1063-I1067 HydrophobicContact CG1-CG2 4.38Å; V1063-I1067 WeakPolarHBondContact O-CG1 3.33Å; V1063-I1067 PolarHBondContact O-N 2.91Å
1064	L	91.3	Very high	89.7	Confident	1 Å²	1	60.6 Å²	60.6	1%	0.005	32%	0.322	C	S	.	.	H	α-helix	trans	-57.6	-43.8	175.8	-70.8	173.1	0	0	0	112.1	V1002 L1003 A1060 C1061 R1066 I1067 A1068 A1069 F1077	V1002-L1064 HydrophobicContact CG1-CD2 4.09Å; V1002-L1064 HydrophobicContact CG1-CG 4.48Å; L1003-L1064 HydrophobicContact CD2-CD2 4Å; A1060-L1064 WeakPolarHBondContact O-CG 3.45Å; A1060-L1064 PolarHBondContact O-N 3.22Å; C1061-L1064 WeakPolarHBondContact O-CB 3.44Å; C1061-L1064 PolarHBondContact O-N 3.43Å; L1064-R1066 VanDerWaalsContact C-N 3.31Å; L1064-R1066 PolarHBondContact O-N 3.08Å; L1064-I1067 HydrophobicContact CD2-CD1 4.17Å; L1064-I1067 WeakPolarHBondContact O-CG1 3.46Å; L1064-I1067 PolarHBondContact O-N 3.24Å; L1064-A1068 PolarHBondContact O-N 3.44Å; L1064-A1069 HydrophobicContact CB-CB 4.23Å; L1064-A1069 HydrophobicContact CD2-CB 4.03Å; L1064-A1069 WeakPolarHBondContact O-CB 3.46Å; L1064-A1069 PolarHBondContact O-N 3.17Å; L1064-A1069 VanDerWaalsContact O-N 3.15Å; L1064-F1077 HydrophobicContact CD1-CB 4.23Å; L1064-F1077 HydrophobicContact CD1-CD1 3.51Å; L1064-F1077 HydrophobicContact CD1-CE1 4Å; L1064-F1077 HydrophobicContact CD1-CG 3.9Å
1065	D	90.5	Very high	90.1	Very high	112 Å²	112	61.8 Å²	61.8	60%	0.599	32%	0.324	S	S	*	.	H	α-helix	trans	-63	-39.2	175.2	-68.8	-26	0	0	0	111.7	C1061 V1063 A1068	C1061-D1065 PolarHBondContact O-N 3.32Å; V1063-D1065 VanDerWaalsContact C-N 3.33Å; V1063-D1065 PolarHBondContact O-N 3.18Å; D1065-A1068 PolarHBondContact O-N 3.37Å
1066	R	89.6	Confident	90.3	Very high	183 Å²	183	60.4 Å²	60.4	69%	0.691	31%	0.313	S	S	*	.	H	α-helix	trans	-69.4	-36.3	-179.6	-170.6	-175.5	-57	149.8	7.1	112.8	R1062 V1063 L1064 A1068	R1062-R1066 WeakPolarHBondContact O-CB 3.4Å; R1062-R1066 PolarHBondContact O-N 3.43Å; V1063-R1066 WeakPolarHBondContact O-CB 3.38Å; V1063-R1066 PolarHBondContact O-N 3.47Å; V1063-R1066 VanDerWaalsContact O-N 3.08Å; L1064-R1066 VanDerWaalsContact C-N 3.31Å; L1064-R1066 PolarHBondContact O-N 3.08Å; R1066-A1068 PolarHBondContact O-N 3.46Å
1067	I	87.5	Confident	90.4	Very high	57 Å²	57	60.4 Å²	60.4	29%	0.292	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.2	4.1	178.7	67.4	177	0	0	0	112.8	D999 L1003 V1063 L1064 A1069	D999-I1067 HydrophobicContact CB-CB 4.48Å; D999-I1067 HydrophobicContact CB-CD1 4.32Å; D999-I1067 HydrophobicContact CB-CG2 4.06Å; L1003-I1067 HydrophobicContact CD1-CD1 4.23Å; L1003-I1067 HydrophobicContact CD2-CD1 4.05Å; L1003-I1067 HydrophobicContact CG-CD1 3.77Å; V1063-I1067 HydrophobicContact CG1-CG2 4.38Å; V1063-I1067 WeakPolarHBondContact O-CG1 3.33Å; V1063-I1067 PolarHBondContact O-N 2.91Å; L1064-I1067 HydrophobicContact CD2-CD1 4.17Å; L1064-I1067 WeakPolarHBondContact O-CG1 3.46Å; L1064-I1067 PolarHBondContact O-N 3.24Å; I1067-A1069 VanDerWaalsContact C-N 3.3Å; I1067-A1069 HydrophobicContact CD1-CB 4.46Å; I1067-A1069 HydrophobicContact CG1-CB 4.18Å; I1067-A1069 PolarHBondContact O-N 2.88Å
1068	A	85.5	Confident	90.4	Very high	91 Å²	91	62.6 Å²	62.6	75%	0.752	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.4	45.8	-176.8	0	0	0	0	0	112.6	L1064 D1065 R1066	L1064-A1068 PolarHBondContact O-N 3.44Å; D1065-A1068 PolarHBondContact O-N 3.37Å; R1066-A1068 PolarHBondContact O-N 3.46Å
1069	A	83.4	Confident	90.4	Very high	10 Å²	10	64.1 Å²	64.1	8%	0.083	34%	0.337	C	S	.	.			trans	-57.4	157.3	175.9	0	0	0	0	0	112	L1003 L1064 I1067 I1071	L1003-A1069 HydrophobicContact CD2-CB 3.47Å; L1003-A1069 VanDerWaalsContact CD2-CB 3.47Å; L1064-A1069 HydrophobicContact CB-CB 4.23Å; L1064-A1069 HydrophobicContact CD2-CB 4.03Å; L1064-A1069 WeakPolarHBondContact O-CB 3.46Å; L1064-A1069 PolarHBondContact O-N 3.17Å; L1064-A1069 VanDerWaalsContact O-N 3.15Å; I1067-A1069 VanDerWaalsContact C-N 3.3Å; I1067-A1069 HydrophobicContact CD1-CB 4.46Å; I1067-A1069 HydrophobicContact CG1-CB 4.18Å; I1067-A1069 PolarHBondContact O-N 2.88Å; A1069-I1071 PolarHBondContact O-N 3.16Å
1070	P	89.1	Confident	90.5	Very high	82 Å²	82	61.6 Å²	61.6	53%	0.532	33%	0.326	S	S	.	.			trans	-53.4	128.2	175.9	-25.2	34.1	0	0	0	111.4	D1072 L1073 C1074	P1070-D1072 PolarHBondContact O-N 2.9Å; P1070-D1072 VanDerWaalsContact O-N 3.13Å; P1070-L1073 HydrophobicContact CB-CB 4.39Å; P1070-L1073 WeakPolarHBondContact O-CA 3.43Å; P1070-L1073 WeakPolarHBondContact O-CB 3.42Å; P1070-L1073 PolarHBondContact O-N 3.5Å; P1070-C1074 PolarHBondContact O-N 3.36Å; P1070-C1074 VanDerWaalsContact O-N 3.1Å
1071	I	88.8	Confident	90.5	Very high	133 Å²	133	62 Å²	62	68%	0.682	33%	0.328	S	S	*	.	H	α-helix	trans	-54	-38	-175.6	-74.1	153.7	0	0	0	112.2	A1069 L1073 C1074 N1075	A1069-I1071 PolarHBondContact O-N 3.16Å; I1071-L1073 VanDerWaalsContact C-N 3.35Å; I1071-L1073 PolarHBondContact O-N 3.46Å; I1071-C1074 PolarHBondContact O-N 2.96Å; I1071-N1075 VanDerWaalsContact O-CG 3.26Å; I1071-N1075 PolarHBondContact O-N 2.8Å; I1071-N1075 PolarHBondContact O-ND2 3.4Å
1072	D	90.8	Very high	90.5	Very high	94 Å²	94	67.2 Å²	67.2	50%	0.503	34%	0.344	S	S	.	.	H	α-helix	trans	-60.9	-41.9	176.5	-178.4	58.5	0	0	0	112.3	P1070 K1076	P1070-D1072 PolarHBondContact O-N 2.9Å; P1070-D1072 VanDerWaalsContact O-N 3.13Å; D1072-K1076 VanDerWaalsContact CG-NZ 3.28Å; D1072-K1076 WeakPolarHBondContact O-CB 3.43Å; D1072-K1076 VanDerWaalsContact O-CG 3.24Å; D1072-K1076 WeakPolarHBondContact O-CG 3.43Å; D1072-K1076 PolarHBondContact O-N 2.92Å; D1072-K1076 WeakPolarHBondContact OD1-CE 3.41Å; D1072-K1076 IonicContact OD1-NZ 3.95Å; D1072-K1076 PolarHBondContact OD1-NZ 2.89Å; D1072-K1076 VanDerWaalsContact OD1-NZ 3.13Å; D1072-K1076 WeakPolarHBondContact OD2-CE 3.38Å; D1072-K1076 IonicContact OD2-NZ 3.99Å; D1072-K1076 PolarHBondContact OD2-NZ 3.31Å
1073	L	90.4	Very high	90.6	Very high	23 Å²	23	61.8 Å²	61.8	12%	0.12	33%	0.326	C	S	.	.	H	α-helix	trans	-66.2	-45.1	175.7	176.3	61.7	0	0	0	111.1	L1003 A1007 Q1010 P1070 I1071 N1075 K1076 F1077	L1003-L1073 HydrophobicContact CD2-CD2 3.61Å; A1007-L1073 HydrophobicContact CB-CD1 3.97Å; Q1010-L1073 HydrophobicContact CG-CD1 3.89Å; P1070-L1073 HydrophobicContact CB-CB 4.39Å; P1070-L1073 WeakPolarHBondContact O-CA 3.43Å; P1070-L1073 WeakPolarHBondContact O-CB 3.42Å; P1070-L1073 PolarHBondContact O-N 3.5Å; I1071-L1073 VanDerWaalsContact C-N 3.35Å; I1071-L1073 PolarHBondContact O-N 3.46Å; L1073-N1075 VanDerWaalsContact C-N 3.35Å; L1073-N1075 PolarHBondContact O-N 3.11Å; L1073-K1076 PolarHBondContact O-N 3.45Å; L1073-F1077 VanDerWaalsContact O-CB 3.23Å; L1073-F1077 WeakPolarHBondContact O-CB 3.24Å; L1073-F1077 PolarHBondContact O-N 2.85Å
1074	C	90.4	Very high	90.7	Very high	19 Å²	19	61 Å²	61	13%	0.128	32%	0.321	C	S	.	.	H	α-helix	trans	-58.7	-46.2	178.6	-66.8	0	0	0	0	111.8	P1070 I1071 F1077 A1078	P1070-C1074 PolarHBondContact O-N 3.36Å; P1070-C1074 VanDerWaalsContact O-N 3.1Å; I1071-C1074 PolarHBondContact O-N 2.96Å; C1074-F1077 PolarHBondContact O-N 3.47Å; C1074-A1078 WeakPolarHBondContact O-CB 3.36Å; C1074-A1078 PolarHBondContact O-N 3.3Å
1075	N	92.1	Very high	90.7	Very high	104 Å²	104	64.3 Å²	64.3	56%	0.556	34%	0.336	S	S	*	.	H	α-helix	trans	-64.2	-45.9	179.8	-69.5	-20.4	0	0	0	111.7	I1071 L1073 A1078 E1079	I1071-N1075 VanDerWaalsContact O-CG 3.26Å; I1071-N1075 PolarHBondContact O-N 2.8Å; I1071-N1075 PolarHBondContact O-ND2 3.4Å; L1073-N1075 VanDerWaalsContact C-N 3.35Å; L1073-N1075 PolarHBondContact O-N 3.11Å; N1075-A1078 PolarHBondContact O-N 3.2Å; N1075-E1079 PolarHBondContact O-N 3.33Å; N1075-E1079 VanDerWaalsContact O-N 3.08Å
1076	K	92.7	Very high	90.7	Very high	63 Å²	63	61.2 Å²	61.2	27%	0.274	33%	0.326	S	S	.	.	H	α-helix	trans	-65.5	-39.4	178.3	-71.7	172	176.7	167.6	0	111.8	Q1010 R1014 D1072 L1073 E1079 A1080	Q1010-K1076 HydrophobicContact CB-CB 4.23Å; Q1010-K1076 HydrophobicContact CG-CB 4.21Å; R1014-K1076 WeakPolarHBondContact CD-O 3.39Å; D1072-K1076 VanDerWaalsContact CG-NZ 3.28Å; D1072-K1076 WeakPolarHBondContact O-CB 3.43Å; D1072-K1076 VanDerWaalsContact O-CG 3.24Å; D1072-K1076 WeakPolarHBondContact O-CG 3.43Å; D1072-K1076 PolarHBondContact O-N 2.92Å; D1072-K1076 WeakPolarHBondContact OD1-CE 3.41Å; D1072-K1076 IonicContact OD1-NZ 3.95Å; D1072-K1076 PolarHBondContact OD1-NZ 2.89Å; D1072-K1076 VanDerWaalsContact OD1-NZ 3.13Å; D1072-K1076 WeakPolarHBondContact OD2-CE 3.38Å; D1072-K1076 IonicContact OD2-NZ 3.99Å; D1072-K1076 PolarHBondContact OD2-NZ 3.31Å; L1073-K1076 PolarHBondContact O-N 3.45Å; K1076-E1079 PolarHBondContact O-N 2.97Å; K1076-A1080 PolarHBondContact O-N 3.29Å
1077	F	93.5	Very high	90.7	Very high	2 Å²	2	52.8 Å²	52.8	1%	0.009	29%	0.294	C	S	.	.	H	α-helix	trans	-66.8	-44.2	176.3	-173.8	-103.2	0	0	0	111.3	S1006 Y1009 Q1010 L1057 A1060 C1061 L1064 L1073 C1074 E1079 A1080 V1081	S1006-F1077 WeakPolarHBondContact O-CD2 3.43Å; Y1009-F1077 HydrophobicContact CD2-CE2 4.29Å; Y1009-F1077 HydrophobicContact CG-CE2 4.08Å; Q1010-F1077 HydrophobicContact CB-CB 4.45Å; L1057-F1077 HydrophobicContact CD2-CZ 4.17Å; A1060-F1077 HydrophobicContact CB-CE1 3.84Å; A1060-F1077 HydrophobicContact CB-CZ 3.87Å; C1061-F1077 VanDerWaalsContact SG-CD1 3.59Å; L1064-F1077 HydrophobicContact CD1-CB 4.23Å; L1064-F1077 HydrophobicContact CD1-CD1 3.51Å; L1064-F1077 HydrophobicContact CD1-CE1 4Å; L1064-F1077 HydrophobicContact CD1-CG 3.9Å; L1073-F1077 VanDerWaalsContact O-CB 3.23Å; L1073-F1077 WeakPolarHBondContact O-CB 3.24Å; L1073-F1077 PolarHBondContact O-N 2.85Å; C1074-F1077 PolarHBondContact O-N 3.47Å; F1077-E1079 VanDerWaalsContact C-N 3.27Å; F1077-E1079 PolarHBondContact O-N 3.01Å; F1077-A1080 CarbonylContact O-C 3.57Å; F1077-A1080 WeakPolarHBondContact O-CA 3.42Å; F1077-A1080 VanDerWaalsContact O-CB 3.32Å; F1077-A1080 WeakPolarHBondContact O-CB 3.25Å; F1077-A1080 PolarHBondContact O-N 3.28Å; F1077-V1081 HydrophobicContact CD1-CG2 3.95Å; F1077-V1081 HydrophobicContact CE1-CG2 3.7Å; F1077-V1081 HydrophobicContact CZ-CG2 4.14Å; F1077-V1081 VanDerWaalsContact O-CG2 3.28Å; F1077-V1081 WeakPolarHBondContact O-CG2 3.48Å; F1077-V1081 PolarHBondContact O-N 3.27Å
1078	A	92.7	Very high	90.8	Very high	48 Å²	48	51.9 Å²	51.9	40%	0.397	29%	0.29	S	S	.	.	H	α-helix	trans	-58.3	-39.1	175.6	0	0	0	0	0	112.4	C1074 N1075 V1081 R1082	C1074-A1078 WeakPolarHBondContact O-CB 3.36Å; C1074-A1078 PolarHBondContact O-N 3.3Å; N1075-A1078 PolarHBondContact O-N 3.2Å; A1078-V1081 WeakPolarHBondContact O-CB 3.26Å; A1078-V1081 PolarHBondContact O-N 3.42Å; A1078-R1082 PolarHBondContact O-N 3.3Å
1079	E	92.2	Very high	90.9	Very high	72 Å²	72	51.7 Å²	51.7	34%	0.336	28%	0.279	S	S	.	.	H	α-helix	trans	-66.4	-41.4	173.7	-178.7	58.4	-171.5	0	0	112.1	N1075 K1076 F1077 V1081 R1082 L1083	N1075-E1079 PolarHBondContact O-N 3.33Å; N1075-E1079 VanDerWaalsContact O-N 3.08Å; K1076-E1079 PolarHBondContact O-N 2.97Å; F1077-E1079 VanDerWaalsContact C-N 3.27Å; F1077-E1079 PolarHBondContact O-N 3.01Å; E1079-V1081 VanDerWaalsContact C-N 3.32Å; E1079-V1081 PolarHBondContact O-N 3.22Å; E1079-R1082 WeakPolarHBondContact O-CB 3.3Å; E1079-R1082 PolarHBondContact O-N 2.98Å; E1079-R1082 IonicContact OE1-CZ 2.78Å; E1079-R1082 IonicContact OE1-NE 3.29Å; E1079-R1082 PolarHBondContact OE1-NE 2.87Å; E1079-R1082 IonicContact OE1-NH2 3.96Å; E1079-R1082 PolarHBondContact OE1-NH2 3.02Å; E1079-R1082 IonicContact OE2-CZ 2.93Å; E1079-R1082 IonicContact OE2-NE 2.78Å; E1079-R1082 PolarHBondContact OE2-NE 2.99Å; E1079-R1082 IonicContact OE2-NH2 3.62Å; E1079-L1083 WeakPolarHBondContact O-CG 3.29Å; E1079-L1083 PolarHBondContact O-N 2.97Å
1080	A	92.6	Very high	91	Very high	0 Å²	0	54.8 Å²	54.8	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-58.6	-42.5	171.8	0	0	0	0	0	112	Q1010 A1013 R1014 K1076 F1077 R1082 L1083 I1084	Q1010-A1080 HydrophobicContact CB-CB 4.26Å; A1013-A1080 HydrophobicContact CB-CB 3.77Å; R1014-A1080 HydrophobicContact CG-CB 4.28Å; K1076-A1080 PolarHBondContact O-N 3.29Å; F1077-A1080 CarbonylContact O-C 3.57Å; F1077-A1080 WeakPolarHBondContact O-CA 3.42Å; F1077-A1080 VanDerWaalsContact O-CB 3.32Å; F1077-A1080 WeakPolarHBondContact O-CB 3.25Å; F1077-A1080 PolarHBondContact O-N 3.28Å; A1080-R1082 VanDerWaalsContact C-N 3.33Å; A1080-R1082 PolarHBondContact O-N 3.34Å; A1080-L1083 PolarHBondContact O-N 3.34Å; A1080-I1084 VanDerWaalsContact O-CG1 3.27Å; A1080-I1084 WeakPolarHBondContact O-CG1 3.49Å; A1080-I1084 PolarHBondContact O-N 2.96Å
1081	V	93.3	Very high	90.7	Very high	8 Å²	8	51.5 Å²	51.5	5%	0.048	27%	0.271	C	S	.	.	H	α-helix	trans	-59.1	-44.4	175.3	178.4	0	0	0	0	111.1	L1057 F1077 A1078 E1079 L1083 I1084 K1085	L1057-V1081 HydrophobicContact CB-CB 4.27Å; L1057-V1081 HydrophobicContact CB-CG1 3.73Å; L1057-V1081 HydrophobicContact CB-CG2 3.67Å; L1057-V1081 HydrophobicContact CD1-CG1 4.29Å; L1057-V1081 HydrophobicContact CD1-CG2 4.29Å; F1077-V1081 HydrophobicContact CD1-CG2 3.95Å; F1077-V1081 HydrophobicContact CE1-CG2 3.7Å; F1077-V1081 HydrophobicContact CZ-CG2 4.14Å; F1077-V1081 VanDerWaalsContact O-CG2 3.28Å; F1077-V1081 WeakPolarHBondContact O-CG2 3.48Å; F1077-V1081 PolarHBondContact O-N 3.27Å; A1078-V1081 WeakPolarHBondContact O-CB 3.26Å; A1078-V1081 PolarHBondContact O-N 3.42Å; E1079-V1081 VanDerWaalsContact C-N 3.32Å; E1079-V1081 PolarHBondContact O-N 3.22Å; V1081-L1083 VanDerWaalsContact C-N 3.35Å; V1081-L1083 PolarHBondContact O-N 3.38Å; V1081-I1084 PolarHBondContact O-N 3.37Å; V1081-K1085 HydrophobicContact CG1-CD 4.07Å; V1081-K1085 HydrophobicContact CG1-CG 4.39Å; V1081-K1085 WeakPolarHBondContact O-CB 3.22Å; V1081-K1085 WeakPolarHBondContact O-CG 3.49Å; V1081-K1085 PolarHBondContact O-N 3.05Å
1082	R	92.8	Very high	90.3	Very high	136 Å²	136	48.3 Å²	48.3	51%	0.513	26%	0.257	S	S	.	.	H	α-helix	trans	-59.9	-45.2	178.2	-169.8	-169.3	68.9	76.7	-0.4	111.6	A1078 E1079 A1080 K1085 A1086	A1078-R1082 PolarHBondContact O-N 3.3Å; E1079-R1082 WeakPolarHBondContact O-CB 3.3Å; E1079-R1082 PolarHBondContact O-N 2.98Å; E1079-R1082 IonicContact OE1-CZ 2.78Å; E1079-R1082 IonicContact OE1-NE 3.29Å; E1079-R1082 PolarHBondContact OE1-NE 2.87Å; E1079-R1082 IonicContact OE1-NH2 3.96Å; E1079-R1082 PolarHBondContact OE1-NH2 3.02Å; E1079-R1082 IonicContact OE2-CZ 2.93Å; E1079-R1082 IonicContact OE2-NE 2.78Å; E1079-R1082 PolarHBondContact OE2-NE 2.99Å; E1079-R1082 IonicContact OE2-NH2 3.62Å; A1080-R1082 VanDerWaalsContact C-N 3.33Å; A1080-R1082 PolarHBondContact O-N 3.34Å; R1082-K1085 PolarHBondContact O-N 3.21Å; R1082-A1086 PolarHBondContact O-N 3Å; R1082-A1086 VanDerWaalsContact O-N 3.09Å
1083	L	92.7	Very high	89.7	Confident	40 Å²	40	47 Å²	47	21%	0.209	25%	0.25	C	S	.	.	H	α-helix	trans	-65.9	-44.1	178.9	-66	171.5	0	0	0	111.9	R1014 E1079 A1080 V1081 K1085 A1086 E1087	R1014-L1083 HydrophobicContact CG-CD1 4.43Å; E1079-L1083 WeakPolarHBondContact O-CG 3.29Å; E1079-L1083 PolarHBondContact O-N 2.97Å; A1080-L1083 PolarHBondContact O-N 3.34Å; V1081-L1083 VanDerWaalsContact C-N 3.35Å; V1081-L1083 PolarHBondContact O-N 3.38Å; L1083-K1085 VanDerWaalsContact C-N 3.33Å; L1083-K1085 PolarHBondContact O-N 3.36Å; L1083-A1086 PolarHBondContact O-N 3.22Å; L1083-E1087 PolarHBondContact O-N 3.12Å
1084	I	92.7	Very high	89	Confident	2 Å²	2	49.2 Å²	49.2	1%	0.01	26%	0.26	C	S	.	.	H	α-helix	trans	-63.7	-40	177.8	-66.6	163.9	0	0	0	110.8	Y1009 A1013 R1042 V1045 V1046 F1052 L1057 A1080 V1081 A1086 E1087 N1088	Y1009-I1084 HydrophobicContact CD1-CD1 4.16Å; A1013-I1084 HydrophobicContact CB-CD1 3.98Å; A1013-I1084 HydrophobicContact CB-CG1 4.14Å; R1042-I1084 HydrophobicContact CB-CG1 4.35Å; R1042-I1084 HydrophobicContact CG-CG1 3.9Å; V1045-I1084 HydrophobicContact CB-CG2 4.48Å; V1045-I1084 HydrophobicContact CG1-CD1 4.44Å; V1045-I1084 HydrophobicContact CG1-CG2 3.86Å; V1046-I1084 HydrophobicContact CG1-CG2 3.7Å; F1052-I1084 HydrophobicContact CE2-CG2 4.08Å; F1052-I1084 HydrophobicContact CZ-CG2 4.12Å; L1057-I1084 HydrophobicContact CD1-CB 4.02Å; L1057-I1084 HydrophobicContact CD1-CD1 3.76Å; L1057-I1084 HydrophobicContact CD1-CG2 3.8Å; A1080-I1084 VanDerWaalsContact O-CG1 3.27Å; A1080-I1084 WeakPolarHBondContact O-CG1 3.49Å; A1080-I1084 PolarHBondContact O-N 2.96Å; V1081-I1084 PolarHBondContact O-N 3.37Å; I1084-A1086 VanDerWaalsContact C-N 3.35Å; I1084-A1086 PolarHBondContact O-N 3.05Å; I1084-E1087 WeakPolarHBondContact O-CB 3.2Å; I1084-E1087 PolarHBondContact O-N 3.48Å; I1084-N1088 PolarHBondContact O-N 3.47Å
1085	K	91	Very high	88.2	Confident	72 Å²	72	51.5 Å²	51.5	31%	0.313	27%	0.269	S	S	.	.	H	α-helix	trans	-63.9	-38.5	175.6	-78	-178.9	170.8	-177.1	0	112.8	P1054 D1058 V1081 R1082 L1083 E1087 N1088 V1089	P1054-K1085 WeakPolarHBondContact O-CE 3.43Å; D1058-K1085 IonicContact OD1-NZ 3.77Å; D1058-K1085 PolarHBondContact OD1-NZ 2.96Å; D1058-K1085 IonicContact OD2-NZ 3.67Å; D1058-K1085 PolarHBondContact OD2-NZ 2.93Å; V1081-K1085 HydrophobicContact CG1-CD 4.07Å; V1081-K1085 HydrophobicContact CG1-CG 4.39Å; V1081-K1085 WeakPolarHBondContact O-CB 3.22Å; V1081-K1085 WeakPolarHBondContact O-CG 3.49Å; V1081-K1085 PolarHBondContact O-N 3.05Å; R1082-K1085 PolarHBondContact O-N 3.21Å; L1083-K1085 VanDerWaalsContact C-N 3.33Å; L1083-K1085 PolarHBondContact O-N 3.36Å; K1085-E1087 VanDerWaalsContact C-N 3.34Å; K1085-N1088 WeakPolarHBondContact O-CB 3.32Å; K1085-N1088 PolarHBondContact O-N 3.24Å; K1085-V1089 PolarHBondContact O-N 3.19Å
1086	A	90.7	Very high	87.1	Confident	47 Å²	47	52.1 Å²	52.1	39%	0.388	27%	0.272	S	S	.	.	H	α-helix	trans	-63.4	-43.2	174.2	0	0	0	0	0	111.1	R1082 L1083 I1084 N1088 V1089 I1090	R1082-A1086 PolarHBondContact O-N 3Å; R1082-A1086 VanDerWaalsContact O-N 3.09Å; L1083-A1086 PolarHBondContact O-N 3.22Å; I1084-A1086 VanDerWaalsContact C-N 3.35Å; I1084-A1086 PolarHBondContact O-N 3.05Å; A1086-N1088 VanDerWaalsContact C-N 3.32Å; A1086-N1088 PolarHBondContact O-N 2.92Å; A1086-V1089 PolarHBondContact O-N 3.48Å; A1086-I1090 PolarHBondContact O-N 3.06Å
1087	E	89.9	Confident	85.9	Confident	6 Å²	6	50.4 Å²	50.4	3%	0.028	27%	0.266	C	S	.	.	H	α-helix	trans	-61.5	-39.1	175.3	-163	66.3	-142.1	0	0	112.2	R1042 R1043 V1046 L1083 I1084 K1085 V1089 I1090 K1091	R1042-E1087 HydrophobicContact CB-CB 3.97Å; R1042-E1087 HydrophobicContact CB-CG 3.84Å; R1042-E1087 IonicContact NE-OE2 2.85Å; R1042-E1087 IonicContact NH2-OE2 3.38Å; R1043-E1087 HydrophobicContact CB-CG 4.35Å; R1043-E1087 IonicContact CZ-OE1 2.82Å; R1043-E1087 IonicContact NE-OE1 2.66Å; R1043-E1087 PolarHBondContact NE-OE1 3.15Å; R1043-E1087 IonicContact NH2-OE1 3.36Å; V1046-E1087 HydrophobicContact CG2-CG 4.28Å; L1083-E1087 PolarHBondContact O-N 3.12Å; I1084-E1087 WeakPolarHBondContact O-CB 3.2Å; I1084-E1087 PolarHBondContact O-N 3.48Å; K1085-E1087 VanDerWaalsContact C-N 3.34Å; E1087-V1089 VanDerWaalsContact C-N 3.26Å; E1087-V1089 PolarHBondContact O-N 3.38Å; E1087-I1090 WeakPolarHBondContact O-CB 3.23Å; E1087-I1090 PolarHBondContact O-N 2.71Å; E1087-I1090 VanDerWaalsContact O-N 3.07Å; E1087-K1091 PolarHBondContact O-N 3.28Å
1088	N	89.1	Confident	84.7	Confident	37 Å²	37	52.2 Å²	52.2	20%	0.198	28%	0.277	C	S	.	.	H	α-helix	trans	-58	-40	176.5	-170	49.7	0	0	0	112	V1046 I1084 K1085 A1086 T1092	V1046-N1088 HydrophobicContact CB-CB 4.25Å; V1046-N1088 HydrophobicContact CG1-CB 3.66Å; I1084-N1088 PolarHBondContact O-N 3.47Å; K1085-N1088 WeakPolarHBondContact O-CB 3.32Å; K1085-N1088 PolarHBondContact O-N 3.24Å; A1086-N1088 VanDerWaalsContact C-N 3.32Å; A1086-N1088 PolarHBondContact O-N 2.92Å; N1088-T1092 WeakPolarHBondContact O-CB 3.32Å; N1088-T1092 PolarHBondContact O-N 3.02Å; N1088-T1092 PolarHBondContact O-OG1 3.31Å
1089	V	87.8	Confident	83.6	Confident	88 Å²	88	56.8 Å²	56.8	53%	0.533	29%	0.294	S	S	.	.	H	α-helix	trans	-67.3	-38.3	176.6	177.1	0	0	0	0	111.2	K1085 A1086 E1087 N1093	K1085-V1089 PolarHBondContact O-N 3.19Å; A1086-V1089 PolarHBondContact O-N 3.48Å; E1087-V1089 VanDerWaalsContact C-N 3.26Å; E1087-V1089 PolarHBondContact O-N 3.38Å; V1089-N1093 WeakPolarHBondContact O-CB 3.31Å; V1089-N1093 PolarHBondContact O-N 2.99Å; V1089-N1093 PolarHBondContact O-ND2 2.89Å
1090	I	86.2	Confident	82.9	Confident	75 Å²	75	57.4 Å²	57.4	39%	0.385	30%	0.3	S	S	.	.	H	α-helix	trans	-65.5	-50.6	176.6	-63.4	168.6	0	0	0	109.9	A1086 E1087 N1093 E1094	A1086-I1090 PolarHBondContact O-N 3.06Å; E1087-I1090 WeakPolarHBondContact O-CB 3.23Å; E1087-I1090 PolarHBondContact O-N 2.71Å; E1087-I1090 VanDerWaalsContact O-N 3.07Å; I1090-N1093 WeakPolarHBondContact O-CB 2.88Å; I1090-N1093 PolarHBondContact O-N 3.4Å; I1090-E1094 PolarHBondContact O-N 3Å
1091	K	82.3	Confident	82.2	Confident	13 Å²	13	58.3 Å²	58.3	6%	0.057	31%	0.307	C	S	.	.	H	α-helix	trans	-60	-49.1	178.9	179.3	177.7	175.6	-94.7	0	112.7	V1046 S1047 E1087 N1093 E1094 E1095	V1046-K1091 HydrophobicContact CB-CD 4.29Å; V1046-K1091 HydrophobicContact CG2-CB 4.1Å; V1046-K1091 HydrophobicContact CG2-CD 3.55Å; V1046-K1091 HydrophobicContact CG2-CG 4.46Å; V1046-K1091 PolarHBondContact O-NZ 3.17Å; S1047-K1091 VanDerWaalsContact CA-CE 3.47Å; S1047-K1091 WeakPolarHBondContact OG-CD 3.24Å; S1047-K1091 WeakPolarHBondContact OG-CE 3.33Å; E1087-K1091 PolarHBondContact O-N 3.28Å; K1091-N1093 PolarHBondContact O-N 3.12Å; K1091-E1094 PolarHBondContact O-N 3.33Å; K1091-E1095 WeakPolarHBondContact CE-OE1 3.35Å; K1091-E1095 HydrophobicContact CG-CG 4.22Å; K1091-E1095 IonicContact NZ-OE1 3.25Å; K1091-E1095 PolarHBondContact NZ-OE1 2.93Å; K1091-E1095 IonicContact NZ-OE2 2.72Å; K1091-E1095 PolarHBondContact NZ-OE2 3.3Å; K1091-E1095 PolarHBondContact O-N 3.46Å
1092	T	80.4	Confident	81.7	Confident	65 Å²	65	60.1 Å²	60.1	40%	0.399	32%	0.319	S	S	.	.	H	α-helix	trans	-57.6	-36.1	179	-54	0	0	0	0	110.9	N1088 L1096	N1088-T1092 WeakPolarHBondContact O-CB 3.32Å; N1088-T1092 PolarHBondContact O-N 3.02Å; N1088-T1092 PolarHBondContact O-OG1 3.31Å; T1092-L1096 WeakPolarHBondContact O-CD1 3.18Å; T1092-L1096 WeakPolarHBondContact O-CG 3.22Å; T1092-L1096 PolarHBondContact O-N 3Å
1093	N	78.3	Confident	81.3	Confident	66 Å²	66	60.4 Å²	60.4	35%	0.353	33%	0.331	S	S	.	.	H	α-helix	trans	-65.5	-47.6	173.4	-83.6	-51.9	0	0	0	111.4	V1089 I1090 K1091 L1096 R1175	V1089-N1093 WeakPolarHBondContact O-CB 3.31Å; V1089-N1093 PolarHBondContact O-N 2.99Å; V1089-N1093 PolarHBondContact O-ND2 2.89Å; I1090-N1093 WeakPolarHBondContact O-CB 2.88Å; I1090-N1093 PolarHBondContact O-N 3.4Å; K1091-N1093 PolarHBondContact O-N 3.12Å; N1093-L1096 PolarHBondContact O-N 3.25Å; N1093-R1175 PolarHBondContact O-NH1 3.28Å; N1093-R1175 PolarHBondContact OD1-NH2 2.84Å
1094	E	76.1	Confident	80.9	Confident	70 Å²	70	64.7 Å²	64.7	33%	0.327	35%	0.35	S	S	.	.	H	α-helix	trans	-65.9	-38.5	-179.1	-70.9	175.2	-168.1	0	0	113.2	R1043 I1090 K1091 L1096 D1097 V1098	R1043-E1094 IonicContact CZ-OE1 3.73Å; R1043-E1094 IonicContact CZ-OE2 3.57Å; R1043-E1094 IonicContact NH1-OE1 3.46Å; R1043-E1094 IonicContact NH1-OE2 3.61Å; R1043-E1094 PolarHBondContact NH1-OE2 3.37Å; R1043-E1094 IonicContact NH2-OE1 3.42Å; R1043-E1094 PolarHBondContact NH2-OE1 3.06Å; R1043-E1094 IonicContact NH2-OE2 2.8Å; R1043-E1094 PolarHBondContact NH2-OE2 2.9Å; I1090-E1094 PolarHBondContact O-N 3Å; K1091-E1094 PolarHBondContact O-N 3.33Å; E1094-L1096 VanDerWaalsContact C-N 3.29Å; E1094-L1096 PolarHBondContact O-N 3.39Å; E1094-D1097 WeakPolarHBondContact O-CA 3.46Å; E1094-D1097 VanDerWaalsContact O-CB 3.25Å; E1094-D1097 WeakPolarHBondContact O-CB 3.22Å; E1094-D1097 PolarHBondContact O-N 2.95Å; E1094-V1098 WeakPolarHBondContact O-CG2 3.4Å
1095	E	72.3	Confident	80.7	Confident	68 Å²	68	65.3 Å²	65.3	32%	0.318	35%	0.353	S	S	.	.	H	α-helix	trans	-60.8	-37.9	178.7	-75.6	178.4	146.5	0	0	112.2	K1091 D1097 V1098 D1099	K1091-E1095 WeakPolarHBondContact CE-OE1 3.35Å; K1091-E1095 HydrophobicContact CG-CG 4.22Å; K1091-E1095 IonicContact NZ-OE1 3.25Å; K1091-E1095 PolarHBondContact NZ-OE1 2.93Å; K1091-E1095 IonicContact NZ-OE2 2.72Å; K1091-E1095 PolarHBondContact NZ-OE2 3.3Å; K1091-E1095 PolarHBondContact O-N 3.46Å; E1095-D1097 PolarHBondContact O-N 3.22Å; E1095-D1097 VanDerWaalsContact O-N 3.08Å; E1095-V1098 PolarHBondContact O-N 3.35Å; E1095-D1099 PolarHBondContact O-N 3.41Å
1096	L	69.3	Low	80.5	Confident	117 Å²	117	64.2 Å²	64.2	61%	0.613	35%	0.35	S	S	*	.	H	α-helix	trans	-59.7	-19.8	172.9	-70.1	165.5	0	0	0	113.4	T1092 N1093 E1094	T1092-L1096 WeakPolarHBondContact O-CD1 3.18Å; T1092-L1096 WeakPolarHBondContact O-CG 3.22Å; T1092-L1096 PolarHBondContact O-N 3Å; N1093-L1096 PolarHBondContact O-N 3.25Å; E1094-L1096 VanDerWaalsContact C-N 3.29Å; E1094-L1096 PolarHBondContact O-N 3.39Å
1097	D	67.7	Low	80.3	Confident	27 Å²	27	62 Å²	62	14%	0.144	33%	0.332	C	S	.	.	H	α-helix	trans	-85.8	-21	178.9	-60.7	-22.3	0	0	0	113	E1094 E1095 R1175	E1094-D1097 WeakPolarHBondContact O-CA 3.46Å; E1094-D1097 VanDerWaalsContact O-CB 3.25Å; E1094-D1097 WeakPolarHBondContact O-CB 3.22Å; E1094-D1097 PolarHBondContact O-N 2.95Å; E1095-D1097 PolarHBondContact O-N 3.22Å; E1095-D1097 VanDerWaalsContact O-N 3.08Å; D1097-R1175 WeakPolarHBondContact OD1-CD 3.48Å; D1097-R1175 IonicContact OD1-CZ 3.93Å; D1097-R1175 IonicContact OD1-NE 3.56Å; D1097-R1175 IonicContact OD1-NH1 3.01Å; D1097-R1175 PolarHBondContact OD1-NH1 2.9Å; D1097-R1175 IonicContact OD2-CZ 2.69Å; D1097-R1175 IonicContact OD2-NH1 2.81Å; D1097-R1175 PolarHBondContact OD2-NH1 3.47Å
1098	V	69.8	Low	80.1	Confident	40 Å²	40	65 Å²	65	24%	0.242	35%	0.352	C	S	.	.	H	α-helix	trans	-120.6	2.8	-171.7	-72.5	0	0	0	0	114.4	E1094 E1095 D1100 A1101 W1167 I1168	E1094-V1098 WeakPolarHBondContact O-CG2 3.4Å; E1095-V1098 PolarHBondContact O-N 3.35Å; V1098-D1100 PolarHBondContact O-N 3.04Å; V1098-A1101 WeakPolarHBondContact O-CB 3.45Å; V1098-A1101 PolarHBondContact O-N 3.4Å; V1098-W1167 HydrophobicContact CB-CH2 4.01Å; V1098-W1167 HydrophobicContact CB-CZ3 3.9Å; V1098-W1167 HydrophobicContact CG1-CE3 4.48Å; V1098-W1167 HydrophobicContact CG1-CH2 4.01Å; V1098-W1167 HydrophobicContact CG1-CZ3 3.52Å; V1098-I1168 HydrophobicContact CG1-CG1 4.5Å
1099	D	68.5	Low	79.8	Confident	143 Å²	143	66.5 Å²	66.5	77%	0.765	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	-19.8	-178.5	-132.9	18	0	0	0	114.1	E1095	E1095-D1099 PolarHBondContact O-N 3.41Å
1100	D	77.1	Confident	79.3	Confident	85 Å²	85	65.9 Å²	65.9	46%	0.455	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.1	31.3	176.8	70.2	-30.9	0	0	0	113.8	V1098 R1171	V1098-D1100 PolarHBondContact O-N 3.04Å; D1100-R1171 IonicContact OD1-CZ 3.46Å; D1100-R1171 IonicContact OD1-NH1 2.67Å; D1100-R1171 PolarHBondContact OD1-NH1 2.78Å; D1100-R1171 IonicContact OD1-NH2 3.71Å; D1100-R1171 IonicContact OD2-CZ 3.09Å; D1100-R1171 IonicContact OD2-NH1 3.83Å; D1100-R1171 PolarHBondContact OD2-NH1 3.43Å; D1100-R1171 IonicContact OD2-NH2 2.71Å; D1100-R1171 PolarHBondContact OD2-NH2 3.23Å
1101	A	78.2	Confident	79	Confident	19 Å²	19	65 Å²	65	16%	0.157	36%	0.361	C	S	.	.			trans	-60.8	132.1	174.1	0	0	0	0	0	112	V1098 I1106 L1113 W1167	V1098-A1101 WeakPolarHBondContact O-CB 3.45Å; V1098-A1101 PolarHBondContact O-N 3.4Å; A1101-I1106 HydrophobicContact CB-CD1 4.48Å; A1101-I1106 HydrophobicContact CB-CG1 4.43Å; A1101-L1113 HydrophobicContact CB-CD1 3.67Å; A1101-W1167 HydrophobicContact CB-CH2 3.54Å; A1101-W1167 HydrophobicContact CB-CZ2 4.21Å; A1101-W1167 HydrophobicContact CB-CZ3 3.87Å
1102	P	83.9	Confident	78.8	Confident	46 Å²	46	66.9 Å²	66.9	30%	0.299	38%	0.375	S	S	.	.			trans	-56.6	139.6	169.6	-25.1	33.6	0	0	0	112.2	E1104 F1105	P1102-E1104 HydrophobicContact CB-CG 3.79Å; P1102-E1104 PolarHBondContact O-N 3.45Å; P1102-F1105 HydrophobicContact CB-CD2 4.27Å; P1102-F1105 HydrophobicContact CB-CE2 4.41Å; P1102-F1105 HydrophobicContact CG-CD2 3.97Å; P1102-F1105 HydrophobicContact CG-CE2 3.85Å; P1102-F1105 HydrophobicContact CG-CZ 4.49Å; P1102-F1105 WeakPolarHBondContact O-CB 3.49Å; P1102-F1105 PolarHBondContact O-N 3.3Å
1103	D	83	Confident	79	Confident	143 Å²	143	65.7 Å²	65.7	77%	0.765	37%	0.366	S	S	*	.	G	3₁₀ helix	trans	-53	-30.1	179.4	-64.5	-16.6	0	0	0	113.2	F1105 I1106	D1103-F1105 PolarHBondContact O-N 3.05Å; D1103-I1106 PolarHBondContact O-N 3.04Å; D1103-I1106 VanDerWaalsContact O-N 3.13Å
1104	E	85.9	Confident	79.4	Confident	130 Å²	130	62.8 Å²	62.8	61%	0.607	35%	0.35	S	S	*	.	G	3₁₀ helix	trans	-65.8	-17	176.8	56.3	175.1	-170.4	0	0	114.4	P1102 M1114	P1102-E1104 HydrophobicContact CB-CG 3.79Å; P1102-E1104 PolarHBondContact O-N 3.45Å; E1104-M1114 VanDerWaalsContact O-CE 3.25Å; E1104-M1114 WeakPolarHBondContact O-CE 3.34Å
1105	F	88.3	Confident	79.8	Confident	14 Å²	14	65.4 Å²	65.4	6%	0.061	36%	0.362	C	S	.	.	G	3₁₀ helix	trans	-96.4	-5.2	176.5	-60.4	-14.1	0	0	0	112.5	P1102 D1103 L1113 M1114 L1160 A1163 V1164 W1167	P1102-F1105 HydrophobicContact CB-CD2 4.27Å; P1102-F1105 HydrophobicContact CB-CE2 4.41Å; P1102-F1105 HydrophobicContact CG-CD2 3.97Å; P1102-F1105 HydrophobicContact CG-CE2 3.85Å; P1102-F1105 HydrophobicContact CG-CZ 4.49Å; P1102-F1105 WeakPolarHBondContact O-CB 3.49Å; P1102-F1105 PolarHBondContact O-N 3.3Å; D1103-F1105 PolarHBondContact O-N 3.05Å; F1105-L1113 HydrophobicContact CB-CD1 3.75Å; F1105-M1114 PolarHBondContact O-N 3.22Å; F1105-L1160 HydrophobicContact CD1-CD1 3.8Å; F1105-L1160 HydrophobicContact CE1-CD1 3.85Å; F1105-A1163 HydrophobicContact CE1-CB 4.31Å; F1105-A1163 HydrophobicContact CZ-CB 4.36Å; F1105-V1164 HydrophobicContact CB-CG2 3.86Å; F1105-V1164 HydrophobicContact CD1-CG2 3.67Å; F1105-V1164 HydrophobicContact CD2-CG2 4.29Å; F1105-V1164 HydrophobicContact CE1-CG2 4.34Å; F1105-V1164 HydrophobicContact CG-CG2 3.68Å; F1105-W1167 HydrophobicContact CD2-CB 4.48Å; F1105-W1167 HydrophobicContact CD2-CD2 4.26Å; F1105-W1167 HydrophobicContact CD2-CE3 4.43Å; F1105-W1167 HydrophobicContact CD2-CG 4.26Å; F1105-W1167 HydrophobicContact CE2-CB 3.86Å; F1105-W1167 HydrophobicContact CE2-CD2 4.22Å; F1105-W1167 AromaticContact CE2-CG 3.76Å; F1105-W1167 HydrophobicContact CE2-CG 3.76Å
1106	I	85.6	Confident	80.5	Confident	49 Å²	49	63.4 Å²	63.4	25%	0.251	35%	0.354	S	S	.	.	B	Isolated β-bridge	trans	-97.3	134.9	-175.3	-58.6	-176.8	0	0	0	109.9	A1101 D1103 C1112	A1101-I1106 HydrophobicContact CB-CD1 4.48Å; A1101-I1106 HydrophobicContact CB-CG1 4.43Å; D1103-I1106 PolarHBondContact O-N 3.04Å; D1103-I1106 VanDerWaalsContact O-N 3.13Å; I1106-C1112 WeakPolarHBondContact CA-O 3.4Å
1107	D	86.4	Confident	81.6	Confident	1 Å²	1	57.9 Å²	57.9	1%	0.005	33%	0.325	C	S	.	.			trans	-65.8	124.8	173.7	-176.9	-60.5	0	0	0	109.6	I1109 M1110 G1111 C1112 M1114 D1128 T1131	D1107-I1109 PolarHBondContact O-N 3.45Å; D1107-I1109 WeakPolarHBondContact OD1-CA 3.4Å; D1107-I1109 WeakPolarHBondContact OD1-CB 3.42Å; D1107-I1109 PolarHBondContact OD1-N 2.94Å; D1107-M1110 HydrophobicContact CB-CB 4.2Å; D1107-M1110 PolarHBondContact OD1-N 3.28Å; D1107-G1111 WeakPolarHBondContact O-CA 3.46Å; D1107-G1111 PolarHBondContact O-N 2.98Å; D1107-C1112 WeakPolarHBondContact CB-O 3.42Å; D1107-C1112 PolarHBondContact N-O 2.92Å; D1107-M1114 HydrophobicContact CB-CG 3.84Å; D1107-D1128 VanDerWaalsContact OD2-CB 3.28Å; D1107-D1128 WeakPolarHBondContact OD2-CB 3.38Å; D1107-D1128 PolarHBondContact OD2-N 3.02Å; D1107-T1131 VanDerWaalsContact OD2-CB 3.27Å; D1107-T1131 WeakPolarHBondContact OD2-CB 3.48Å; D1107-T1131 PolarHBondContact OD2-OG1 3.23Å
1108	P	85.5	Confident	82.8	Confident	70 Å²	70	56.6 Å²	56.6	46%	0.455	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71	-12.9	-174.7	27.2	-34.5	0	0	0	114.5	I1126 V1127 F1144	P1108-I1126 WeakPolarHBondContact CD-O 3.38Å; P1108-I1126 WeakPolarHBondContact CG-O 3.29Å; P1108-V1127 HydrophobicContact CG-CG1 3.68Å; P1108-F1144 HydrophobicContact CB-CZ 4.48Å; P1108-F1144 HydrophobicContact CG-CZ 4.06Å
1109	I	83.1	Confident	83.8	Confident	67 Å²	67	58.2 Å²	58.2	34%	0.344	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.7	-47.4	176.6	-56.7	176.4	0	0	0	109.8	D1107 V1127 T1131 P1143 F1144	D1107-I1109 PolarHBondContact O-N 3.45Å; D1107-I1109 WeakPolarHBondContact OD1-CA 3.4Å; D1107-I1109 WeakPolarHBondContact OD1-CB 3.42Å; D1107-I1109 PolarHBondContact OD1-N 2.94Å; I1109-V1127 HydrophobicContact CD1-CG1 4.05Å; I1109-V1127 HydrophobicContact CG1-CG1 4.3Å; I1109-T1131 HydrophobicContact CB-CG2 3.86Å; I1109-T1131 HydrophobicContact CD1-CG2 3.95Å; I1109-T1131 HydrophobicContact CG1-CG2 4.41Å; I1109-T1131 HydrophobicContact CG2-CG2 4.05Å; I1109-P1143 HydrophobicContact CD1-CB 4.36Å; I1109-P1143 HydrophobicContact CD1-CG 3.81Å; I1109-F1144 HydrophobicContact CD1-CE2 4.04Å; I1109-F1144 HydrophobicContact CD1-CZ 3.84Å; I1109-F1144 HydrophobicContact CG1-CE1 4.35Å; I1109-F1144 HydrophobicContact CG1-CE2 4.31Å; I1109-F1144 HydrophobicContact CG1-CZ 3.61Å
1110	M	78.5	Confident	84.9	Confident	75 Å²	75	51.4 Å²	51.4	37%	0.369	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.6	-16.4	-172.2	-66.5	-55.8	-64.2	0	0	114.4	D1107 C1112 T1131 R1134	D1107-M1110 HydrophobicContact CB-CB 4.2Å; D1107-M1110 PolarHBondContact OD1-N 3.28Å; M1110-C1112 WeakPolarHBondContact CB-SG 3.29Å; M1110-C1112 PolarHBondContact O-N 3.47Å; M1110-T1131 HydrophobicContact CG-CG2 3.66Å; M1110-T1131 WeakPolarHBondContact CG-OG1 3.36Å; M1110-R1134 PolarHBondContact SD-NH2 3.24Å
1111	G	78.2	Confident	85.4	Confident	57 Å²	57	50.3 Å²	50.3	59%	0.588	28%	0.283	S	S	*	.			trans	66.3	13.8	-178.8	0	0	0	0	0	114	D1107	D1107-G1111 WeakPolarHBondContact O-CA 3.46Å; D1107-G1111 PolarHBondContact O-N 2.98Å
1112	C	79.4	Confident	85.8	Confident	53 Å²	53	51.7 Å²	51.7	36%	0.358	29%	0.289	S	S	.	.	S	Bend	trans	-112.8	161.3	179	61.8	0	0	0	0	111.3	I1106 D1107 M1110 M1114	I1106-C1112 WeakPolarHBondContact CA-O 3.4Å; D1107-C1112 WeakPolarHBondContact CB-O 3.42Å; D1107-C1112 PolarHBondContact N-O 2.92Å; M1110-C1112 WeakPolarHBondContact CB-SG 3.29Å; M1110-C1112 PolarHBondContact O-N 3.47Å; C1112-M1114 PolarHBondContact O-N 2.92Å
1113	L	84.1	Confident	86	Confident	39 Å²	39	51.1 Å²	51.1	20%	0.204	29%	0.286	C	S	.	.	B	Isolated β-bridge	trans	-60.4	131.2	179.5	-161	82.6	0	0	0	111.2	A1101 F1105 E1115 V1164 W1167 I1168	A1101-L1113 HydrophobicContact CB-CD1 3.67Å; F1105-L1113 HydrophobicContact CB-CD1 3.75Å; L1113-E1115 PolarHBondContact O-N 3.4Å; L1113-V1164 HydrophobicContact CD1-CG1 4.35Å; L1113-V1164 HydrophobicContact CD2-CG1 3.76Å; L1113-V1164 HydrophobicContact CG-CG1 3.9Å; L1113-W1167 HydrophobicContact CD1-CZ3 4.17Å; L1113-I1168 HydrophobicContact CD2-CD1 3.5Å; L1113-I1168 HydrophobicContact CD2-CG1 3.72Å
1114	M	86.8	Confident	86.2	Confident	5 Å²	5	46.1 Å²	46.1	3%	0.025	27%	0.269	C	S	.	.			trans	-73.1	123.3	177.9	-67.8	-176.6	-79.4	0	0	111.3	E1104 F1105 D1107 C1112 P1117 I1126 D1128 L1160 V1164	E1104-M1114 VanDerWaalsContact O-CE 3.25Å; E1104-M1114 WeakPolarHBondContact O-CE 3.34Å; F1105-M1114 PolarHBondContact O-N 3.22Å; D1107-M1114 HydrophobicContact CB-CG 3.84Å; C1112-M1114 PolarHBondContact O-N 2.92Å; M1114-P1117 HydrophobicContact CB-CB 4.21Å; M1114-P1117 HydrophobicContact SD-CB 3.91Å; M1114-I1126 HydrophobicContact CE-CG2 4.32Å; M1114-I1126 HydrophobicContact SD-CG2 3.95Å; M1114-D1128 HydrophobicContact CG-CB 4.26Å; M1114-L1160 HydrophobicContact CE-CD2 3.88Å; M1114-V1164 WeakPolarHBondContact O-CG1 3.1Å
1115	E	84.5	Confident	86.5	Confident	125 Å²	125	44.2 Å²	44.2	58%	0.584	26%	0.26	S	S	*	.	S	Bend	trans	-89.2	-36.1	175.9	-70.5	170.5	-142.9	0	0	112.1	L1113 D1128 K1130 R1161	L1113-E1115 PolarHBondContact O-N 3.4Å; E1115-D1128 PolarHBondContact N-OD2 2.95Å; E1115-K1130 IonicContact OE1-NZ 3.4Å; E1115-K1130 PolarHBondContact OE1-NZ 3.43Å; E1115-K1130 IonicContact OE2-NZ 3.84Å; E1115-R1161 PolarHBondContact O-NE 3.18Å
1116	D	87.7	Confident	86.7	Confident	27 Å²	27	46.1 Å²	46.1	14%	0.144	27%	0.27	C	S	.	.	S	Bend	trans	-138	77.6	178.3	-166.3	35.8	0	0	0	110.9	V1118 D1128 R1129 R1161	D1116-V1118 PolarHBondContact O-N 3.29Å; D1116-D1128 PolarHBondContact N-OD2 3.45Å; D1116-R1129 HydrophobicContact CB-CB 4.09Å; D1116-R1129 WeakPolarHBondContact O-CB 3.25Å; D1116-R1129 PolarHBondContact O-N 3.24Å; D1116-R1129 VanDerWaalsContact OD2-CD 3.26Å; D1116-R1129 WeakPolarHBondContact OD2-CD 3.42Å; D1116-R1129 IonicContact OD2-CZ 3.97Å; D1116-R1129 IonicContact OD2-NE 3.32Å; D1116-R1129 PolarHBondContact OD2-NE 3.2Å; D1116-R1129 IonicContact OD2-NH2 2.83Å; D1116-R1161 IonicContact OD1-CZ 3.21Å; D1116-R1161 IonicContact OD1-NE 3.2Å; D1116-R1161 PolarHBondContact OD1-NE 2.82Å; D1116-R1161 IonicContact OD1-NH1 3.73Å; D1116-R1161 PolarHBondContact OD1-NH1 3.39Å; D1116-R1161 IonicContact OD1-NH2 2.65Å
1117	P	91.7	Very high	87	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	130.5	-176.4	24	-32.2	0	0	0	112.2	M1114 I1126 Q1157 L1160 R1161	M1114-P1117 HydrophobicContact CB-CB 4.21Å; M1114-P1117 HydrophobicContact SD-CB 3.91Å; P1117-I1126 HydrophobicContact CB-CG2 3.75Å; P1117-Q1157 HydrophobicContact CB-CB 4.2Å; P1117-Q1157 HydrophobicContact CG-CB 4.3Å; P1117-Q1157 WeakPolarHBondContact O-CB 3.04Å; P1117-Q1157 PolarHBondContact O-N 3.42Å; P1117-L1160 HydrophobicContact CB-CB 4.45Å; P1117-L1160 HydrophobicContact CB-CD2 3.83Å; P1117-L1160 HydrophobicContact CB-CG 4.31Å; P1117-L1160 HydrophobicContact CG-CB 3.96Å; P1117-L1160 HydrophobicContact CG-CD2 4.14Å; P1117-L1160 HydrophobicContact CG-CG 4.06Å; P1117-R1161 HydrophobicContact CG-CB 3.94Å
1118	V	91.9	Very high	87.2	Confident	0 Å²	0	44 Å²	44	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	143.4	176.3	-61.7	0	0	0	0	110.4	D1116 I1126 V1127 R1129 I1132 V1154 E1155	D1116-V1118 PolarHBondContact O-N 3.29Å; V1118-I1126 WeakPolarHBondContact O-CA 3.36Å; V1118-V1127 HydrophobicContact CG2-CG2 4.15Å; V1118-V1127 WeakPolarHBondContact CG2-O 3.44Å; V1118-V1127 PolarHBondContact N-O 2.86Å; V1118-V1127 PolarHBondContact O-N 2.98Å; V1118-V1127 VanDerWaalsContact O-O 3.08Å; V1118-R1129 HydrophobicContact CG1-CB 3.91Å; V1118-R1129 HydrophobicContact CG1-CG 4.29Å; V1118-R1129 HydrophobicContact CG2-CB 4.43Å; V1118-I1132 HydrophobicContact CG2-CG2 3.76Å; V1118-V1154 HydrophobicContact CB-CB 4.27Å; V1118-V1154 HydrophobicContact CB-CG2 4.39Å; V1118-V1154 HydrophobicContact CG2-CB 4.36Å; V1118-V1154 HydrophobicContact CG2-CG2 4.48Å; V1118-E1155 CarbonylContact C-O 3.58Å; V1118-E1155 WeakPolarHBondContact CA-O 3.34Å
1119	K	92.5	Very high	87.3	Confident	75 Å²	75	43.5 Å²	43.5	33%	0.326	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	132.2	179	-176.4	-176.2	176.9	-168.3	0	110.5	H1125 I1126 E1155 Q1157	K1119-H1125 WeakPolarHBondContact CA-O 3.43Å; K1119-I1126 HydrophobicContact CB-CG1 4.26Å; K1119-I1126 HydrophobicContact CG-CG1 4.37Å; K1119-E1155 HydrophobicContact CB-CB 4.3Å; K1119-E1155 PolarHBondContact N-O 3.48Å; K1119-E1155 PolarHBondContact O-N 3.39Å; K1119-Q1157 HydrophobicContact CB-CG 4Å; K1119-Q1157 VanDerWaalsContact CB-NE2 3.34Å
1120	L	91.8	Very high	87.5	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	24%	0.24	C	C	.	.			trans	-83.1	122.5	174.6	-51.6	-177.1	0	0	0	109.2	T1122 G1124 H1125 V1127 I1132 F1144 L1149 V1154	L1120-T1122 VanDerWaalsContact C-N 3.33Å; L1120-T1122 PolarHBondContact O-N 3.08Å; L1120-G1124 WeakPolarHBondContact O-CA 3.45Å; L1120-G1124 PolarHBondContact O-N 3.28Å; L1120-H1125 PolarHBondContact N-O 2.89Å; L1120-V1127 HydrophobicContact CD1-CG2 4.08Å; L1120-V1127 HydrophobicContact CD2-CG2 3.75Å; L1120-V1127 HydrophobicContact CG-CG2 3.92Å; L1120-I1132 HydrophobicContact CD1-CD1 4.1Å; L1120-I1132 HydrophobicContact CD2-CB 4.23Å; L1120-I1132 HydrophobicContact CD2-CD1 3.76Å; L1120-I1132 HydrophobicContact CD2-CG1 3.61Å; L1120-F1144 HydrophobicContact CD1-CD2 3.77Å; L1120-F1144 HydrophobicContact CD1-CE2 3.82Å; L1120-L1149 HydrophobicContact CD2-CD2 3.91Å; L1120-V1154 HydrophobicContact CD2-CG1 3.87Å
1121	P	87.5	Confident	87.8	Confident	61 Å²	61	38.9 Å²	38.9	40%	0.396	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-30	-174.6	26.7	-35.1	0	0	0	113.2	L1149 Q1153	P1121-L1149 HydrophobicContact CG-CD1 3.85Å; P1121-Q1153 WeakPolarHBondContact CD-O 3.49Å; P1121-Q1153 HydrophobicContact CG-CB 4.05Å; P1121-Q1153 WeakPolarHBondContact CG-O 3.35Å
1122	T	85.1	Confident	88.3	Confident	48 Å²	48	36.1 Å²	36.1	29%	0.294	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.3	-46.7	-176.2	32.4	0	0	0	0	112.8	L1120 D1142 Q1147	L1120-T1122 VanDerWaalsContact C-N 3.33Å; L1120-T1122 PolarHBondContact O-N 3.08Å; T1122-D1142 WeakPolarHBondContact OG1-CB 3.4Å; T1122-D1142 PolarHBondContact OG1-OD2 3.44Å; T1122-Q1147 HydrophobicContact CG2-CB 3.95Å
1123	S	88.8	Confident	88.5	Confident	34 Å²	34	34.1 Å²	34.1	24%	0.238	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.4	-18.8	-180	61.3	0	0	0	0	114.2	H1125 D1142	S1123-H1125 PolarHBondContact O-N 3.37Å; S1123-D1142 WeakPolarHBondContact CB-OD2 3.44Å; S1123-D1142 PolarHBondContact N-OD2 3.32Å; S1123-D1142 VanDerWaalsContact N-OD2 3.11Å; S1123-D1142 PolarHBondContact OG-OD1 3.27Å; S1123-D1142 PolarHBondContact OG-OD2 3.34Å
1124	G	87.8	Confident	88.4	Confident	38 Å²	38	34.5 Å²	34.5	39%	0.392	18%	0.179	S	C	.	.			trans	76.9	-3.9	-176.4	0	0	0	0	0	114.8	L1120	L1120-G1124 WeakPolarHBondContact O-CA 3.45Å; L1120-G1124 PolarHBondContact O-N 3.28Å
1125	H	91.8	Very high	88.2	Confident	90 Å²	90	36.6 Å²	36.6	42%	0.417	19%	0.189	S	C	.	.			trans	-69.1	148.7	177.5	-78.3	-79.6	0	0	0	111.8	K1119 L1120 S1123 F1144	K1119-H1125 WeakPolarHBondContact CA-O 3.43Å; L1120-H1125 PolarHBondContact N-O 2.89Å; S1123-H1125 PolarHBondContact O-N 3.37Å; H1125-F1144 HydrophobicContact CB-CD2 3.98Å; H1125-F1144 HydrophobicContact CB-CE2 3.85Å; H1125-F1144 HydrophobicContact CB-CZ 4.37Å; H1125-F1144 AromaticContact CD2-CD2 3.99Å; H1125-F1144 AromaticContact CD2-CG 3.76Å
1126	I	92.5	Very high	88.2	Confident	55 Å²	55	31.8 Å²	31.8	28%	0.282	17%	0.167	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	126.9	172.6	-55.7	174.1	0	0	0	107.6	P1108 M1114 P1117 V1118 K1119 Q1157 L1160	P1108-I1126 WeakPolarHBondContact CD-O 3.38Å; P1108-I1126 WeakPolarHBondContact CG-O 3.29Å; M1114-I1126 HydrophobicContact CE-CG2 4.32Å; M1114-I1126 HydrophobicContact SD-CG2 3.95Å; P1117-I1126 HydrophobicContact CB-CG2 3.75Å; V1118-I1126 WeakPolarHBondContact O-CA 3.36Å; K1119-I1126 HydrophobicContact CB-CG1 4.26Å; K1119-I1126 HydrophobicContact CG-CG1 4.37Å; I1126-Q1157 HydrophobicContact CD1-CG 4.23Å; I1126-Q1157 HydrophobicContact CG1-CG 4.39Å; I1126-Q1157 HydrophobicContact CG2-CG 4.18Å; I1126-L1160 HydrophobicContact CD1-CD2 4.18Å; I1126-L1160 HydrophobicContact CG2-CD2 3.9Å
1127	V	91.4	Very high	87.7	Confident	0 Å²	0	31.7 Å²	31.7	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	163.4	180	-69.9	0	0	0	0	108.9	P1108 I1109 V1118 L1120 I1132 F1144	P1108-V1127 HydrophobicContact CG-CG1 3.68Å; I1109-V1127 HydrophobicContact CD1-CG1 4.05Å; I1109-V1127 HydrophobicContact CG1-CG1 4.3Å; V1118-V1127 HydrophobicContact CG2-CG2 4.15Å; V1118-V1127 WeakPolarHBondContact CG2-O 3.44Å; V1118-V1127 PolarHBondContact N-O 2.86Å; V1118-V1127 PolarHBondContact O-N 2.98Å; V1118-V1127 VanDerWaalsContact O-O 3.08Å; L1120-V1127 HydrophobicContact CD1-CG2 4.08Å; L1120-V1127 HydrophobicContact CD2-CG2 3.75Å; L1120-V1127 HydrophobicContact CG-CG2 3.92Å; V1127-I1132 HydrophobicContact CG2-CB 3.85Å; V1127-I1132 HydrophobicContact CG2-CG2 4.23Å; V1127-F1144 HydrophobicContact CG1-CE2 3.85Å; V1127-F1144 HydrophobicContact CG1-CZ 4.11Å
1128	D	90.4	Very high	86.9	Confident	4 Å²	4	35.2 Å²	35.2	2%	0.021	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	142.5	171.7	-166.1	-84.1	0	0	0	111	D1107 M1114 E1115 D1116 K1130 T1131 I1132	D1107-D1128 VanDerWaalsContact OD2-CB 3.28Å; D1107-D1128 WeakPolarHBondContact OD2-CB 3.38Å; D1107-D1128 PolarHBondContact OD2-N 3.02Å; M1114-D1128 HydrophobicContact CG-CB 4.26Å; E1115-D1128 PolarHBondContact N-OD2 2.95Å; D1116-D1128 PolarHBondContact N-OD2 3.45Å; D1128-K1130 PolarHBondContact O-N 3.1Å; D1128-K1130 WeakPolarHBondContact OD1-CD 3.45Å; D1128-K1130 WeakPolarHBondContact OD1-CG 3.42Å; D1128-K1130 PolarHBondContact OD1-N 3.19Å; D1128-T1131 WeakPolarHBondContact O-CB 3.37Å; D1128-T1131 PolarHBondContact O-N 3.34Å; D1128-T1131 VanDerWaalsContact O-N 3.09Å; D1128-I1132 PolarHBondContact O-N 3.31Å
1129	R	88.2	Confident	86.2	Confident	61 Å²	61	38.9 Å²	38.9	23%	0.23	21%	0.205	C	C	.	.	H	α-helix	trans	-51.8	-44.1	177.3	-173	-179.1	-72.4	-86.8	-10.3	111.8	D1116 V1118 T1131 I1132 Y1133 M1151	D1116-R1129 HydrophobicContact CB-CB 4.09Å; D1116-R1129 WeakPolarHBondContact O-CB 3.25Å; D1116-R1129 PolarHBondContact O-N 3.24Å; D1116-R1129 VanDerWaalsContact OD2-CD 3.26Å; D1116-R1129 WeakPolarHBondContact OD2-CD 3.42Å; D1116-R1129 IonicContact OD2-CZ 3.97Å; D1116-R1129 IonicContact OD2-NE 3.32Å; D1116-R1129 PolarHBondContact OD2-NE 3.2Å; D1116-R1129 IonicContact OD2-NH2 2.83Å; V1118-R1129 HydrophobicContact CG1-CB 3.91Å; V1118-R1129 HydrophobicContact CG1-CG 4.29Å; V1118-R1129 HydrophobicContact CG2-CB 4.43Å; R1129-T1131 VanDerWaalsContact C-N 3.3Å; R1129-T1131 PolarHBondContact O-N 2.9Å; R1129-I1132 WeakPolarHBondContact O-CG2 3.44Å; R1129-Y1133 VanDerWaalsContact O-CB 3.24Å; R1129-Y1133 WeakPolarHBondContact O-CB 3.46Å; R1129-Y1133 PolarHBondContact O-N 3.17Å; R1129-M1151 HydrophobicContact CG-CE 3.34Å
1130	K	86	Confident	85.7	Confident	40 Å²	40	39.2 Å²	39.2	17%	0.174	22%	0.217	C	C	.	.	H	α-helix	trans	-66.6	-35.9	-177.5	78.3	-157.9	165.8	173.9	0	111.4	E1115 D1128 R1134	E1115-K1130 IonicContact OE1-NZ 3.4Å; E1115-K1130 PolarHBondContact OE1-NZ 3.43Å; E1115-K1130 IonicContact OE2-NZ 3.84Å; D1128-K1130 PolarHBondContact O-N 3.1Å; D1128-K1130 WeakPolarHBondContact OD1-CD 3.45Å; D1128-K1130 WeakPolarHBondContact OD1-CG 3.42Å; D1128-K1130 PolarHBondContact OD1-N 3.19Å; K1130-R1134 VanDerWaalsContact O-CB 3.25Å; K1130-R1134 WeakPolarHBondContact O-CB 3.39Å; K1130-R1134 PolarHBondContact O-N 3.23Å; K1130-R1134 VanDerWaalsContact O-N 3.09Å
1131	T	86.8	Confident	85.4	Confident	4 Å²	4	40.6 Å²	40.6	3%	0.025	23%	0.225	C	C	.	.	H	α-helix	trans	-64.3	-51.7	179.1	-55.5	0	0	0	0	111.3	D1107 I1109 M1110 D1128 R1129 R1134 H1135	D1107-T1131 VanDerWaalsContact OD2-CB 3.27Å; D1107-T1131 WeakPolarHBondContact OD2-CB 3.48Å; D1107-T1131 PolarHBondContact OD2-OG1 3.23Å; I1109-T1131 HydrophobicContact CB-CG2 3.86Å; I1109-T1131 HydrophobicContact CD1-CG2 3.95Å; I1109-T1131 HydrophobicContact CG1-CG2 4.41Å; I1109-T1131 HydrophobicContact CG2-CG2 4.05Å; M1110-T1131 HydrophobicContact CG-CG2 3.66Å; M1110-T1131 WeakPolarHBondContact CG-OG1 3.36Å; D1128-T1131 WeakPolarHBondContact O-CB 3.37Å; D1128-T1131 PolarHBondContact O-N 3.34Å; D1128-T1131 VanDerWaalsContact O-N 3.09Å; R1129-T1131 VanDerWaalsContact C-N 3.3Å; R1129-T1131 PolarHBondContact O-N 2.9Å; T1131-R1134 PolarHBondContact O-N 3.41Å; T1131-H1135 PolarHBondContact O-N 3.42Å
1132	I	88.3	Confident	85.3	Confident	0 Å²	0	37.7 Å²	37.7	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-71	-39.8	-179.1	-169.3	66.3	0	0	0	112.1	V1118 L1120 V1127 D1128 R1129 R1134 H1135 L1136 P1143 L1149 M1151 V1154	V1118-I1132 HydrophobicContact CG2-CG2 3.76Å; L1120-I1132 HydrophobicContact CD1-CD1 4.1Å; L1120-I1132 HydrophobicContact CD2-CB 4.23Å; L1120-I1132 HydrophobicContact CD2-CD1 3.76Å; L1120-I1132 HydrophobicContact CD2-CG1 3.61Å; V1127-I1132 HydrophobicContact CG2-CB 3.85Å; V1127-I1132 HydrophobicContact CG2-CG2 4.23Å; D1128-I1132 PolarHBondContact O-N 3.31Å; R1129-I1132 WeakPolarHBondContact O-CG2 3.44Å; I1132-R1134 PolarHBondContact O-N 3.21Å; I1132-H1135 HydrophobicContact CD1-CB 4.45Å; I1132-H1135 WeakPolarHBondContact O-CB 3.28Å; I1132-H1135 PolarHBondContact O-N 3.46Å; I1132-L1136 HydrophobicContact CG1-CD1 4.16Å; I1132-L1136 HydrophobicContact CG1-CG 4.27Å; I1132-L1136 WeakPolarHBondContact O-CG 3.32Å; I1132-L1136 PolarHBondContact O-N 2.75Å; I1132-P1143 HydrophobicContact CD1-CG 4.02Å; I1132-L1149 HydrophobicContact CD1-CD2 4Å; I1132-L1149 HydrophobicContact CG1-CD2 4.14Å; I1132-M1151 HydrophobicContact CG2-CE 4.17Å; I1132-M1151 HydrophobicContact CG2-SD 4.22Å; I1132-V1154 HydrophobicContact CG2-CG1 4.49Å
1133	Y	84	Confident	85.4	Confident	10 Å²	10	37.6 Å²	37.6	4%	0.039	21%	0.206	C	C	.	.	H	α-helix	trans	-57.6	-43.3	177.5	-165.6	-68.6	0	0	0	110.3	I870 L879 I962 R1129 H1135 L1136 L1137 M1151	I870-Y1133 WeakPolarHBondContact O-CE2 3.34Å; I870-Y1133 VanDerWaalsContact O-CZ 3.26Å; I870-Y1133 PolarHBondContact O-OH 3.35Å; L879-Y1133 HydrophobicContact CD2-CE1 3.87Å; I962-Y1133 HydrophobicContact CD1-CD1 3.75Å; I962-Y1133 HydrophobicContact CD1-CD2 4.3Å; I962-Y1133 HydrophobicContact CD1-CE1 3.84Å; I962-Y1133 HydrophobicContact CD1-CE2 4.35Å; I962-Y1133 HydrophobicContact CD1-CG 4.02Å; I962-Y1133 HydrophobicContact CG1-CD1 4.18Å; I962-Y1133 HydrophobicContact CG1-CG 4.43Å; I962-Y1133 HydrophobicContact CG2-CD1 3.75Å; I962-Y1133 HydrophobicContact CG2-CE1 4.13Å; R1129-Y1133 VanDerWaalsContact O-CB 3.24Å; R1129-Y1133 WeakPolarHBondContact O-CB 3.46Å; R1129-Y1133 PolarHBondContact O-N 3.17Å; Y1133-H1135 VanDerWaalsContact C-N 3.33Å; Y1133-H1135 PolarHBondContact O-N 2.97Å; Y1133-L1136 PolarHBondContact O-N 3.36Å; Y1133-L1137 HydrophobicContact CD1-CD1 3.85Å; Y1133-L1137 HydrophobicContact CD1-CG 3.88Å; Y1133-L1137 HydrophobicContact CE1-CD1 3.79Å; Y1133-L1137 HydrophobicContact CE1-CD2 3.9Å; Y1133-L1137 HydrophobicContact CE1-CG 3.7Å; Y1133-L1137 PolarHBondContact O-N 2.75Å; Y1133-M1151 HydrophobicContact CD2-CE 3.96Å; Y1133-M1151 HydrophobicContact CD2-CG 3.67Å; Y1133-M1151 HydrophobicContact CD2-SD 3.68Å; Y1133-M1151 HydrophobicContact CE2-CG 3.97Å; Y1133-M1151 HydrophobicContact CG-SD 4.27Å
1134	R	80.2	Confident	85.4	Confident	48 Å²	48	39.7 Å²	39.7	18%	0.181	21%	0.212	C	C	.	.	H	α-helix	trans	-62.3	-37.3	176.5	-173.3	-178.8	68.9	-174.2	6.5	113.2	R966 M1110 K1130 T1131 I1132	R966-R1134 HydrophobicContact CG-CG 4.4Å; M1110-R1134 PolarHBondContact SD-NH2 3.24Å; K1130-R1134 VanDerWaalsContact O-CB 3.25Å; K1130-R1134 WeakPolarHBondContact O-CB 3.39Å; K1130-R1134 PolarHBondContact O-N 3.23Å; K1130-R1134 VanDerWaalsContact O-N 3.09Å; T1131-R1134 PolarHBondContact O-N 3.41Å; I1132-R1134 PolarHBondContact O-N 3.21Å
1135	H	83.4	Confident	85.3	Confident	48 Å²	48	39.9 Å²	39.9	22%	0.222	21%	0.207	C	C	.	.	H	α-helix	trans	-63.9	-49.5	173.8	179	70.9	0	0	0	110.5	T1131 I1132 Y1133 L1137 N1138 D1139 T1141	T1131-H1135 PolarHBondContact O-N 3.42Å; I1132-H1135 HydrophobicContact CD1-CB 4.45Å; I1132-H1135 WeakPolarHBondContact O-CB 3.28Å; I1132-H1135 PolarHBondContact O-N 3.46Å; Y1133-H1135 VanDerWaalsContact C-N 3.33Å; Y1133-H1135 PolarHBondContact O-N 2.97Å; H1135-L1137 PolarHBondContact O-N 3.36Å; H1135-N1138 PolarHBondContact O-N 3.1Å; H1135-D1139 CarbonylContact C-O 3.59Å; H1135-D1139 PolarHBondContact O-N 3.04Å; H1135-T1141 PolarHBondContact CD2-O 3.05Å; H1135-T1141 PolarHBondContact NE2-O 2.8Å
1136	L	83.6	Confident	85	Confident	25 Å²	25	45.6 Å²	45.6	13%	0.131	23%	0.225	C	C	.	.	H	α-helix	trans	-62.7	-25.5	-178.5	-65.7	178.5	0	0	0	114.5	I1132 Y1133 N1138 D1139 T1141 L1149 M1151	I1132-L1136 HydrophobicContact CG1-CD1 4.16Å; I1132-L1136 HydrophobicContact CG1-CG 4.27Å; I1132-L1136 WeakPolarHBondContact O-CG 3.32Å; I1132-L1136 PolarHBondContact O-N 2.75Å; Y1133-L1136 PolarHBondContact O-N 3.36Å; L1136-N1138 PolarHBondContact O-N 2.55Å; L1136-D1139 VanDerWaalsContact CA-O 3.29Å; L1136-D1139 WeakPolarHBondContact CA-O 3.43Å; L1136-T1141 WeakPolarHBondContact CD2-O 3.38Å; L1136-L1149 HydrophobicContact CD2-CB 4.17Å; L1136-L1149 HydrophobicContact CD2-CD2 4.35Å; L1136-L1149 HydrophobicContact CD2-CG 4.36Å; L1136-L1149 WeakPolarHBondContact CD2-O 3.45Å; L1136-M1151 HydrophobicContact CD1-CB 4.31Å; L1136-M1151 HydrophobicContact CD1-SD 4.08Å
1137	L	78.2	Confident	84.6	Confident	25 Å²	25	48 Å²	48	13%	0.131	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-22	172.5	-79.8	174.8	0	0	0	114	P875 L879 I962 Y1133 H1135	P875-L1137 HydrophobicContact CB-CD2 3.61Å; P875-L1137 HydrophobicContact CG-CD2 4.02Å; L879-L1137 HydrophobicContact CD1-CD1 4.47Å; L879-L1137 HydrophobicContact CD2-CD1 4.44Å; L879-L1137 HydrophobicContact CD2-CD2 4.15Å; L879-L1137 HydrophobicContact CG-CD1 4.37Å; L879-L1137 HydrophobicContact CG-CD2 4.17Å; I962-L1137 HydrophobicContact CG2-CD1 3.56Å; Y1133-L1137 HydrophobicContact CD1-CD1 3.85Å; Y1133-L1137 HydrophobicContact CD1-CG 3.88Å; Y1133-L1137 HydrophobicContact CE1-CD1 3.79Å; Y1133-L1137 HydrophobicContact CE1-CD2 3.9Å; Y1133-L1137 HydrophobicContact CE1-CG 3.7Å; Y1133-L1137 PolarHBondContact O-N 2.75Å; H1135-L1137 PolarHBondContact O-N 3.36Å
1138	N	74.4	Confident	84.3	Confident	74 Å²	74	53.1 Å²	53.1	40%	0.396	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.4	-38.1	179.3	-62.2	-41.9	0	0	0	112	S883 N887 R966 H1135 L1136	S883-N1138 PolarHBondContact OG-OD1 3.45Å; N887-N1138 PolarHBondContact ND2-OD1 3.22Å; R966-N1138 PolarHBondContact NH2-ND2 2.92Å; H1135-N1138 PolarHBondContact O-N 3.1Å; L1136-N1138 PolarHBondContact O-N 2.55Å
1139	D	77.4	Confident	84	Confident	76 Å²	76	53.1 Å²	53.1	41%	0.406	27%	0.268	S	S	.	.			trans	-140.2	115.7	-175.8	-172.3	-17	0	0	0	109.6	H1135 L1136 T1141	H1135-D1139 CarbonylContact C-O 3.59Å; H1135-D1139 PolarHBondContact O-N 3.04Å; L1136-D1139 VanDerWaalsContact CA-O 3.29Å; L1136-D1139 WeakPolarHBondContact CA-O 3.43Å; D1139-T1141 VanDerWaalsContact CG-OG1 3.22Å; D1139-T1141 PolarHBondContact O-N 3.03Å; D1139-T1141 WeakPolarHBondContact OD1-CG2 3.1Å; D1139-T1141 PolarHBondContact OD1-N 3.35Å; D1139-T1141 PolarHBondContact OD1-OG1 3.31Å; D1139-T1141 PolarHBondContact OD2-OG1 2.82Å
1140	S	82.9	Confident	83.7	Confident	82 Å²	82	52.6 Å²	52.6	57%	0.573	27%	0.272	S	S	*	.			trans	-78.5	39.1	-174.8	-41.7	0	0	0	0	113.3	P1148 L1149	S1140-P1148 WeakPolarHBondContact O-CA 3.17Å; S1140-L1149 PolarHBondContact O-N 3.16Å
1141	T	84.6	Confident	83.5	Confident	30 Å²	30	51.6 Å²	51.6	18%	0.184	27%	0.268	C	S	.	.	B	Isolated β-bridge	trans	-125.8	165.2	-178.4	60.4	0	0	0	0	111.9	H1135 L1136 D1139 Q1147	H1135-T1141 PolarHBondContact CD2-O 3.05Å; H1135-T1141 PolarHBondContact NE2-O 2.8Å; L1136-T1141 WeakPolarHBondContact CD2-O 3.38Å; D1139-T1141 VanDerWaalsContact CG-OG1 3.22Å; D1139-T1141 PolarHBondContact O-N 3.03Å; D1139-T1141 WeakPolarHBondContact OD1-CG2 3.1Å; D1139-T1141 PolarHBondContact OD1-N 3.35Å; D1139-T1141 PolarHBondContact OD1-OG1 3.31Å; D1139-T1141 PolarHBondContact OD2-OG1 2.82Å; T1141-Q1147 CarbonylContact C-O 3.45Å; T1141-Q1147 VanDerWaalsContact CA-O 3.25Å; T1141-Q1147 WeakPolarHBondContact CA-O 3.32Å
1142	D	86.5	Confident	83.3	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	29%	0.294	C	S	.	.			trans	-78.6	126	168.8	175.4	-42	0	0	0	108.7	T1122 S1123 F1144 S1145 R1146 Q1147 L1149	T1122-D1142 WeakPolarHBondContact OG1-CB 3.4Å; T1122-D1142 PolarHBondContact OG1-OD2 3.44Å; S1123-D1142 WeakPolarHBondContact CB-OD2 3.44Å; S1123-D1142 PolarHBondContact N-OD2 3.32Å; S1123-D1142 VanDerWaalsContact N-OD2 3.11Å; S1123-D1142 PolarHBondContact OG-OD1 3.27Å; S1123-D1142 PolarHBondContact OG-OD2 3.34Å; D1142-F1144 PolarHBondContact O-N 2.96Å; D1142-F1144 VanDerWaalsContact O-N 3.12Å; D1142-F1144 WeakPolarHBondContact OD1-CA 3.48Å; D1142-F1144 WeakPolarHBondContact OD1-CB 3.39Å; D1142-F1144 PolarHBondContact OD1-N 2.88Å; D1142-S1145 VanDerWaalsContact CB-OG 3.29Å; D1142-S1145 WeakPolarHBondContact CB-OG 3.29Å; D1142-S1145 VanDerWaalsContact CG-OG 3.25Å; D1142-S1145 PolarHBondContact O-N 2.79Å; D1142-S1145 PolarHBondContact OD1-N 3.04Å; D1142-S1145 VanDerWaalsContact OD1-N 3.12Å; D1142-S1145 PolarHBondContact OD2-OG 3.22Å; D1142-R1146 WeakPolarHBondContact O-CA 3.48Å; D1142-R1146 PolarHBondContact O-N 2.77Å; D1142-Q1147 PolarHBondContact N-O 3.21Å; D1142-L1149 HydrophobicContact CB-CB 4.23Å; D1142-L1149 HydrophobicContact CB-CD2 4.13Å
1143	P	86.8	Confident	83.1	Confident	45 Å²	45	59.6 Å²	59.6	29%	0.292	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-20.5	-173.5	23.6	-31.8	0	0	0	113.9	I1109 I1132	I1109-P1143 HydrophobicContact CD1-CB 4.36Å; I1109-P1143 HydrophobicContact CD1-CG 3.81Å; I1132-P1143 HydrophobicContact CD1-CG 4.02Å
1144	F	88.5	Confident	83.2	Confident	79 Å²	79	59.6 Å²	59.6	35%	0.346	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.6	-37.7	-179.1	-54.3	-80.3	0	0	0	112.6	P1108 I1109 L1120 H1125 V1127 D1142	P1108-F1144 HydrophobicContact CB-CZ 4.48Å; P1108-F1144 HydrophobicContact CG-CZ 4.06Å; I1109-F1144 HydrophobicContact CD1-CE2 4.04Å; I1109-F1144 HydrophobicContact CD1-CZ 3.84Å; I1109-F1144 HydrophobicContact CG1-CE1 4.35Å; I1109-F1144 HydrophobicContact CG1-CE2 4.31Å; I1109-F1144 HydrophobicContact CG1-CZ 3.61Å; L1120-F1144 HydrophobicContact CD1-CD2 3.77Å; L1120-F1144 HydrophobicContact CD1-CE2 3.82Å; H1125-F1144 HydrophobicContact CB-CD2 3.98Å; H1125-F1144 HydrophobicContact CB-CE2 3.85Å; H1125-F1144 HydrophobicContact CB-CZ 4.37Å; H1125-F1144 AromaticContact CD2-CD2 3.99Å; H1125-F1144 AromaticContact CD2-CG 3.76Å; V1127-F1144 HydrophobicContact CG1-CE2 3.85Å; V1127-F1144 HydrophobicContact CG1-CZ 4.11Å; D1142-F1144 PolarHBondContact O-N 2.96Å; D1142-F1144 VanDerWaalsContact O-N 3.12Å; D1142-F1144 WeakPolarHBondContact OD1-CA 3.48Å; D1142-F1144 WeakPolarHBondContact OD1-CB 3.39Å; D1142-F1144 PolarHBondContact OD1-N 2.88Å
1145	S	86.2	Confident	83.7	Confident	41 Å²	41	62 Å²	62	29%	0.287	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.4	-14.8	-176.9	67.8	0	0	0	0	114.6	D1142 Q1147	D1142-S1145 VanDerWaalsContact CB-OG 3.29Å; D1142-S1145 WeakPolarHBondContact CB-OG 3.29Å; D1142-S1145 VanDerWaalsContact CG-OG 3.25Å; D1142-S1145 PolarHBondContact O-N 2.79Å; D1142-S1145 PolarHBondContact OD1-N 3.04Å; D1142-S1145 VanDerWaalsContact OD1-N 3.12Å; D1142-S1145 PolarHBondContact OD2-OG 3.22Å; S1145-Q1147 PolarHBondContact O-N 3.38Å; S1145-Q1147 VanDerWaalsContact O-N 3.16Å; S1145-Q1147 PolarHBondContact OG-N 2.83Å
1146	R	84.1	Confident	84	Confident	211 Å²	211	63.4 Å²	63.4	80%	0.796	34%	0.341	S	S	*	.			trans	56	18.3	-171.3	-58.4	-176.6	178.3	170.9	-1.4	114.3	D1142	D1142-R1146 WeakPolarHBondContact O-CA 3.48Å; D1142-R1146 PolarHBondContact O-N 2.77Å
1147	Q	84.4	Confident	84.4	Confident	105 Å²	105	64.5 Å²	64.5	49%	0.491	35%	0.346	S	S	.	.			trans	-82.8	149.1	173.8	-67.1	-170.3	-7.5	0	0	110.4	T1122 T1141 D1142 S1145 L1149	T1122-Q1147 HydrophobicContact CG2-CB 3.95Å; T1141-Q1147 CarbonylContact C-O 3.45Å; T1141-Q1147 VanDerWaalsContact CA-O 3.25Å; T1141-Q1147 WeakPolarHBondContact CA-O 3.32Å; D1142-Q1147 PolarHBondContact N-O 3.21Å; S1145-Q1147 PolarHBondContact O-N 3.38Å; S1145-Q1147 VanDerWaalsContact O-N 3.16Å; S1145-Q1147 PolarHBondContact OG-N 2.83Å; Q1147-L1149 PolarHBondContact O-N 3Å
1148	P	85	Confident	84.9	Confident	108 Å²	108	67.9 Å²	67.9	70%	0.701	36%	0.361	S	S	*	.	B	Isolated β-bridge	trans	-56.8	129.6	176.9	-23.5	33.4	0	0	0	111.7	S1140	S1140-P1148 WeakPolarHBondContact O-CA 3.17Å
1149	L	84.6	Confident	85.6	Confident	3 Å²	3	71.3 Å²	71.3	2%	0.016	38%	0.379	C	S	.	.			trans	-135.8	141.6	-177.8	-178.6	70.8	0	0	0	109.8	L1120 P1121 I1132 L1136 S1140 D1142 Q1147 Q1153 V1154	L1120-L1149 HydrophobicContact CD2-CD2 3.91Å; P1121-L1149 HydrophobicContact CG-CD1 3.85Å; I1132-L1149 HydrophobicContact CD1-CD2 4Å; I1132-L1149 HydrophobicContact CG1-CD2 4.14Å; L1136-L1149 HydrophobicContact CD2-CB 4.17Å; L1136-L1149 HydrophobicContact CD2-CD2 4.35Å; L1136-L1149 HydrophobicContact CD2-CG 4.36Å; L1136-L1149 WeakPolarHBondContact CD2-O 3.45Å; S1140-L1149 PolarHBondContact O-N 3.16Å; D1142-L1149 HydrophobicContact CB-CB 4.23Å; D1142-L1149 HydrophobicContact CB-CD2 4.13Å; Q1147-L1149 PolarHBondContact O-N 3Å; L1149-Q1153 HydrophobicContact CD1-CB 4.07Å; L1149-V1154 HydrophobicContact CD2-CG1 4.39Å
1150	T	81.9	Confident	86.1	Confident	51 Å²	51	69.1 Å²	69.1	31%	0.313	37%	0.367	S	S	.	.			trans	-122.6	157.2	171.8	63.5	0	0	0	0	111.1	S1152 Q1153	T1150-S1152 PolarHBondContact O-N 3.41Å; T1150-S1152 PolarHBondContact OG1-OG 3.47Å; T1150-S1152 VanDerWaalsContact OG1-OG 3.08Å; T1150-Q1153 VanDerWaalsContact N-OE1 3.14Å; T1150-Q1153 WeakPolarHBondContact O-CB 3.33Å; T1150-Q1153 PolarHBondContact O-N 3.18Å; T1150-Q1153 WeakPolarHBondContact OG1-CG 3.35Å
1151	M	82.4	Confident	86.4	Confident	19 Å²	19	68 Å²	68	9%	0.094	35%	0.351	C	S	.	.	G	3₁₀ helix	trans	-62.8	-27.3	-177.2	-162	62.5	-164.6	0	0	113.1	R1129 I1132 Y1133 L1136 Q1153 V1154	R1129-M1151 HydrophobicContact CG-CE 3.34Å; I1132-M1151 HydrophobicContact CG2-CE 4.17Å; I1132-M1151 HydrophobicContact CG2-SD 4.22Å; Y1133-M1151 HydrophobicContact CD2-CE 3.96Å; Y1133-M1151 HydrophobicContact CD2-CG 3.67Å; Y1133-M1151 HydrophobicContact CD2-SD 3.68Å; Y1133-M1151 HydrophobicContact CE2-CG 3.97Å; Y1133-M1151 HydrophobicContact CG-SD 4.27Å; L1136-M1151 HydrophobicContact CD1-CB 4.31Å; L1136-M1151 HydrophobicContact CD1-SD 4.08Å; M1151-Q1153 PolarHBondContact O-N 2.98Å; M1151-V1154 HydrophobicContact CE-CG2 3.54Å; M1151-V1154 HydrophobicContact CG-CG2 4.47Å; M1151-V1154 WeakPolarHBondContact O-CG2 3.5Å; M1151-V1154 PolarHBondContact O-N 3.06Å; M1151-V1154 HydrophobicContact SD-CG2 3.88Å
1152	S	82.5	Confident	86.6	Confident	81 Å²	81	69.6 Å²	69.6	57%	0.566	36%	0.363	S	S	*	.	G	3₁₀ helix	trans	-66.4	-20	175.5	68	0	0	0	0	114.3	T1150	T1150-S1152 PolarHBondContact O-N 3.41Å; T1150-S1152 PolarHBondContact OG1-OG 3.47Å; T1150-S1152 VanDerWaalsContact OG1-OG 3.08Å
1153	Q	84.1	Confident	86.7	Confident	90 Å²	90	71.5 Å²	71.5	42%	0.421	38%	0.378	S	S	.	.	G	3₁₀ helix	trans	-89.9	-11.3	-176.3	-66.2	169.6	-14.2	0	0	112.7	P1121 L1149 T1150 M1151	P1121-Q1153 WeakPolarHBondContact CD-O 3.49Å; P1121-Q1153 HydrophobicContact CG-CB 4.05Å; P1121-Q1153 WeakPolarHBondContact CG-O 3.35Å; L1149-Q1153 HydrophobicContact CD1-CB 4.07Å; T1150-Q1153 VanDerWaalsContact N-OE1 3.14Å; T1150-Q1153 WeakPolarHBondContact O-CB 3.33Å; T1150-Q1153 PolarHBondContact O-N 3.18Å; T1150-Q1153 WeakPolarHBondContact OG1-CG 3.35Å; M1151-Q1153 PolarHBondContact O-N 2.98Å
1154	V	86.2	Confident	86.6	Confident	11 Å²	11	69.5 Å²	69.5	7%	0.067	37%	0.366	C	S	.	.	P	Polyproline II helix	trans	-77.7	134.9	-179	-61.4	0	0	0	0	111.5	V1118 L1120 I1132 L1149 M1151	V1118-V1154 HydrophobicContact CB-CB 4.27Å; V1118-V1154 HydrophobicContact CB-CG2 4.39Å; V1118-V1154 HydrophobicContact CG2-CB 4.36Å; V1118-V1154 HydrophobicContact CG2-CG2 4.48Å; L1120-V1154 HydrophobicContact CD2-CG1 3.87Å; I1132-V1154 HydrophobicContact CG2-CG1 4.49Å; L1149-V1154 HydrophobicContact CD2-CG1 4.39Å; M1151-V1154 HydrophobicContact CE-CG2 3.54Å; M1151-V1154 HydrophobicContact CG-CG2 4.47Å; M1151-V1154 WeakPolarHBondContact O-CG2 3.5Å; M1151-V1154 PolarHBondContact O-N 3.06Å; M1151-V1154 HydrophobicContact SD-CG2 3.88Å
1155	E	89.7	Confident	86.5	Confident	99 Å²	99	71.7 Å²	71.7	46%	0.463	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	116.4	-174.8	-66.5	179.5	173.5	0	0	111.3	V1118 K1119 Q1157	V1118-E1155 CarbonylContact C-O 3.58Å; V1118-E1155 WeakPolarHBondContact CA-O 3.34Å; K1119-E1155 HydrophobicContact CB-CB 4.3Å; K1119-E1155 PolarHBondContact N-O 3.48Å; K1119-E1155 PolarHBondContact O-N 3.39Å; E1155-Q1157 PolarHBondContact O-N 2.92Å; E1155-Q1157 PolarHBondContact O-NE2 3.32Å
1156	P	90.6	Very high	86.5	Confident	76 Å²	76	76.2 Å²	76.2	49%	0.494	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.9	134.8	178	-17	27.7	0	0	0	112.7
1157	Q	91.7	Very high	86.6	Confident	49 Å²	49	67.7 Å²	67.7	23%	0.229	35%	0.354	C	S	.	.			trans	-104.1	70.1	178.4	-60.3	-58.9	-56.6	0	0	111.3	P1117 K1119 I1126 E1155 N1159 L1160 R1161	P1117-Q1157 HydrophobicContact CB-CB 4.2Å; P1117-Q1157 HydrophobicContact CG-CB 4.3Å; P1117-Q1157 WeakPolarHBondContact O-CB 3.04Å; P1117-Q1157 PolarHBondContact O-N 3.42Å; K1119-Q1157 HydrophobicContact CB-CG 4Å; K1119-Q1157 VanDerWaalsContact CB-NE2 3.34Å; I1126-Q1157 HydrophobicContact CD1-CG 4.23Å; I1126-Q1157 HydrophobicContact CG1-CG 4.39Å; I1126-Q1157 HydrophobicContact CG2-CG 4.18Å; E1155-Q1157 PolarHBondContact O-N 2.92Å; E1155-Q1157 PolarHBondContact O-NE2 3.32Å; Q1157-N1159 PolarHBondContact O-N 2.84Å; Q1157-L1160 HydrophobicContact CB-CB 4.08Å; Q1157-L1160 PolarHBondContact O-N 3.05Å; Q1157-L1160 VanDerWaalsContact O-N 3.08Å; Q1157-R1161 PolarHBondContact O-N 2.96Å
1158	E	89	Confident	86.4	Confident	96 Å²	96	64.5 Å²	64.5	45%	0.449	34%	0.34	S	S	.	.	H	α-helix	trans	-61.6	-30.9	-173.9	-162.4	61.4	-152.9	0	0	113.5	R1161 S1162	E1158-R1161 IonicContact OE2-NH1 2.72Å; E1158-S1162 WeakPolarHBondContact O-CB 3.31Å; E1158-S1162 PolarHBondContact O-N 2.96Å; E1158-S1162 PolarHBondContact O-OG 2.85Å
1159	N	88.2	Confident	86.3	Confident	145 Å²	145	64 Å²	64	78%	0.775	33%	0.331	S	S	*	.	H	α-helix	trans	-64.7	-45.4	175.2	-70.2	-27.4	0	0	0	111.5	Q1157 S1162 A1163	Q1157-N1159 PolarHBondContact O-N 2.84Å; N1159-S1162 PolarHBondContact O-N 3.08Å; N1159-A1163 PolarHBondContact O-N 3.48Å
1160	L	88.8	Confident	86.2	Confident	30 Å²	30	68.4 Å²	68.4	16%	0.157	35%	0.352	C	S	.	.	H	α-helix	trans	-67.9	-42.7	178.4	-172.7	61.3	0	0	0	110.1	F1105 M1114 P1117 I1126 Q1157 S1162 A1163 V1164	F1105-L1160 HydrophobicContact CD1-CD1 3.8Å; F1105-L1160 HydrophobicContact CE1-CD1 3.85Å; M1114-L1160 HydrophobicContact CE-CD2 3.88Å; P1117-L1160 HydrophobicContact CB-CB 4.45Å; P1117-L1160 HydrophobicContact CB-CD2 3.83Å; P1117-L1160 HydrophobicContact CB-CG 4.31Å; P1117-L1160 HydrophobicContact CG-CB 3.96Å; P1117-L1160 HydrophobicContact CG-CD2 4.14Å; P1117-L1160 HydrophobicContact CG-CG 4.06Å; I1126-L1160 HydrophobicContact CD1-CD2 4.18Å; I1126-L1160 HydrophobicContact CG2-CD2 3.9Å; Q1157-L1160 HydrophobicContact CB-CB 4.08Å; Q1157-L1160 PolarHBondContact O-N 3.05Å; Q1157-L1160 VanDerWaalsContact O-N 3.08Å; L1160-S1162 VanDerWaalsContact C-N 3.29Å; L1160-S1162 PolarHBondContact O-N 2.76Å; L1160-A1163 WeakPolarHBondContact O-CB 3.47Å; L1160-A1163 PolarHBondContact O-N 3Å; L1160-A1163 VanDerWaalsContact O-N 3.09Å; L1160-V1164 HydrophobicContact CG-CG2 4.46Å; L1160-V1164 WeakPolarHBondContact O-CG2 3.35Å; L1160-V1164 PolarHBondContact O-N 3.24Å
1161	R	88.5	Confident	86.1	Confident	60 Å²	60	69.3 Å²	69.3	23%	0.226	35%	0.349	C	S	.	.	H	α-helix	trans	-54.5	-45.3	174.1	-168	-179	-169.4	-177.9	8.8	112.4	E1115 D1116 P1117 Q1157 E1158 V1164 R1165	E1115-R1161 PolarHBondContact O-NE 3.18Å; D1116-R1161 IonicContact OD1-CZ 3.21Å; D1116-R1161 IonicContact OD1-NE 3.2Å; D1116-R1161 PolarHBondContact OD1-NE 2.82Å; D1116-R1161 IonicContact OD1-NH1 3.73Å; D1116-R1161 PolarHBondContact OD1-NH1 3.39Å; D1116-R1161 IonicContact OD1-NH2 2.65Å; P1117-R1161 HydrophobicContact CG-CB 3.94Å; Q1157-R1161 PolarHBondContact O-N 2.96Å; E1158-R1161 IonicContact OE2-NH1 2.72Å; R1161-V1164 PolarHBondContact O-N 3.49Å; R1161-R1165 WeakPolarHBondContact O-CG 3.35Å; R1161-R1165 PolarHBondContact O-N 2.96Å
1162	S	88.8	Confident	85.7	Confident	62 Å²	62	74 Å²	74	43%	0.434	37%	0.366	S	S	.	.	H	α-helix	trans	-66.1	-38.7	177.6	-62.1	0	0	0	0	112.1	E1158 N1159 L1160 K1166	E1158-S1162 WeakPolarHBondContact O-CB 3.31Å; E1158-S1162 PolarHBondContact O-N 2.96Å; E1158-S1162 PolarHBondContact O-OG 2.85Å; N1159-S1162 PolarHBondContact O-N 3.08Å; L1160-S1162 VanDerWaalsContact C-N 3.29Å; L1160-S1162 PolarHBondContact O-N 2.76Å; S1162-K1166 VanDerWaalsContact O-CB 3.32Å; S1162-K1166 WeakPolarHBondContact O-CB 3.42Å; S1162-K1166 PolarHBondContact O-N 2.99Å
1163	A	88.5	Confident	85.5	Confident	40 Å²	40	73 Å²	73	33%	0.331	36%	0.362	S	S	.	.	H	α-helix	trans	-64.6	-45.8	175.9	0	0	0	0	0	111.8	F1105 N1159 L1160 K1166 W1167	F1105-A1163 HydrophobicContact CE1-CB 4.31Å; F1105-A1163 HydrophobicContact CZ-CB 4.36Å; N1159-A1163 PolarHBondContact O-N 3.48Å; L1160-A1163 WeakPolarHBondContact O-CB 3.47Å; L1160-A1163 PolarHBondContact O-N 3Å; L1160-A1163 VanDerWaalsContact O-N 3.09Å; A1163-K1166 PolarHBondContact O-N 3.46Å; A1163-W1167 WeakPolarHBondContact O-CB 3.44Å; A1163-W1167 PolarHBondContact O-N 2.86Å
1164	V	85.6	Confident	85.1	Confident	4 Å²	4	73.9 Å²	73.9	2%	0.024	37%	0.366	C	S	.	.	H	α-helix	trans	-59.9	-50.1	176.3	176	0	0	0	0	110.6	F1105 L1113 M1114 L1160 R1161 K1166 W1167 I1168	F1105-V1164 HydrophobicContact CB-CG2 3.86Å; F1105-V1164 HydrophobicContact CD1-CG2 3.67Å; F1105-V1164 HydrophobicContact CD2-CG2 4.29Å; F1105-V1164 HydrophobicContact CE1-CG2 4.34Å; F1105-V1164 HydrophobicContact CG-CG2 3.68Å; L1113-V1164 HydrophobicContact CD1-CG1 4.35Å; L1113-V1164 HydrophobicContact CD2-CG1 3.76Å; L1113-V1164 HydrophobicContact CG-CG1 3.9Å; M1114-V1164 WeakPolarHBondContact O-CG1 3.1Å; L1160-V1164 HydrophobicContact CG-CG2 4.46Å; L1160-V1164 WeakPolarHBondContact O-CG2 3.35Å; L1160-V1164 PolarHBondContact O-N 3.24Å; R1161-V1164 PolarHBondContact O-N 3.49Å; V1164-K1166 PolarHBondContact O-N 2.76Å; V1164-W1167 WeakPolarHBondContact O-CB 3.49Å; V1164-W1167 PolarHBondContact O-N 2.89Å; V1164-I1168 HydrophobicContact CG1-CD1 3.94Å; V1164-I1168 HydrophobicContact CG1-CG1 4.42Å; V1164-I1168 VanDerWaalsContact O-CG1 3.31Å; V1164-I1168 WeakPolarHBondContact O-CG1 3.41Å; V1164-I1168 PolarHBondContact O-N 3.48Å
1165	R	85.5	Confident	84.2	Confident	125 Å²	125	76.5 Å²	76.5	47%	0.472	38%	0.375	S	S	.	.	H	α-helix	trans	-58.1	-47.1	178	-78.5	-179.4	174.7	166.6	-2	112.5	R1161 W1167 I1168 D1169	R1161-R1165 WeakPolarHBondContact O-CG 3.35Å; R1161-R1165 PolarHBondContact O-N 2.96Å; R1165-W1167 VanDerWaalsContact C-N 3.28Å; R1165-W1167 PolarHBondContact O-N 3.04Å; R1165-I1168 PolarHBondContact O-N 2.69Å; R1165-D1169 PolarHBondContact O-N 3.06Å
1166	K	86	Confident	83.3	Confident	136 Å²	136	77.1 Å²	77.1	59%	0.591	38%	0.381	S	S	*	.	H	α-helix	trans	-61.8	-39.8	179.3	-169.6	-178.4	178.2	-168.4	0	111.5	S1162 A1163 V1164 D1169 E1170	S1162-K1166 VanDerWaalsContact O-CB 3.32Å; S1162-K1166 WeakPolarHBondContact O-CB 3.42Å; S1162-K1166 PolarHBondContact O-N 2.99Å; A1163-K1166 PolarHBondContact O-N 3.46Å; V1164-K1166 PolarHBondContact O-N 2.76Å; K1166-D1169 PolarHBondContact O-N 2.83Å; K1166-E1170 VanDerWaalsContact CE-OE1 3.3Å; K1166-E1170 WeakPolarHBondContact CE-OE1 3.14Å; K1166-E1170 WeakPolarHBondContact O-CG 3.09Å; K1166-E1170 PolarHBondContact O-N 3.47Å
1167	W	86.3	Confident	82.2	Confident	31 Å²	31	76.4 Å²	76.4	12%	0.117	38%	0.378	C	S	.	.	H	α-helix	trans	-64.4	-44.9	177	-179	87.4	0	0	0	112	V1098 A1101 F1105 L1113 A1163 V1164 R1165 D1169 E1170 R1171	V1098-W1167 HydrophobicContact CB-CH2 4.01Å; V1098-W1167 HydrophobicContact CB-CZ3 3.9Å; V1098-W1167 HydrophobicContact CG1-CE3 4.48Å; V1098-W1167 HydrophobicContact CG1-CH2 4.01Å; V1098-W1167 HydrophobicContact CG1-CZ3 3.52Å; A1101-W1167 HydrophobicContact CB-CH2 3.54Å; A1101-W1167 HydrophobicContact CB-CZ2 4.21Å; A1101-W1167 HydrophobicContact CB-CZ3 3.87Å; F1105-W1167 HydrophobicContact CD2-CB 4.48Å; F1105-W1167 HydrophobicContact CD2-CD2 4.26Å; F1105-W1167 HydrophobicContact CD2-CE3 4.43Å; F1105-W1167 HydrophobicContact CD2-CG 4.26Å; F1105-W1167 HydrophobicContact CE2-CB 3.86Å; F1105-W1167 HydrophobicContact CE2-CD2 4.22Å; F1105-W1167 AromaticContact CE2-CG 3.76Å; F1105-W1167 HydrophobicContact CE2-CG 3.76Å; L1113-W1167 HydrophobicContact CD1-CZ3 4.17Å; A1163-W1167 WeakPolarHBondContact O-CB 3.44Å; A1163-W1167 PolarHBondContact O-N 2.86Å; V1164-W1167 WeakPolarHBondContact O-CB 3.49Å; V1164-W1167 PolarHBondContact O-N 2.89Å; R1165-W1167 VanDerWaalsContact C-N 3.28Å; R1165-W1167 PolarHBondContact O-N 3.04Å; W1167-D1169 VanDerWaalsContact C-N 3.34Å; W1167-D1169 PolarHBondContact O-N 2.91Å; W1167-E1170 PolarHBondContact O-N 3.26Å; W1167-R1171 HydrophobicContact CD2-CG 4.44Å; W1167-R1171 HydrophobicContact CZ2-CG 4.11Å; W1167-R1171 WeakPolarHBondContact O-CG 3.47Å; W1167-R1171 PolarHBondContact O-N 2.69Å; W1167-R1171 VanDerWaalsContact O-N 3.11Å
1168	I	80.5	Confident	80.9	Confident	39 Å²	39	81.7 Å²	81.7	20%	0.2	40%	0.4	C	S	.	.	H	α-helix	trans	-57.6	-47.6	174.3	-63.8	165.6	0	0	0	110.5	V1098 L1113 V1164 R1165 E1170 R1171 R1172	V1098-I1168 HydrophobicContact CG1-CG1 4.5Å; L1113-I1168 HydrophobicContact CD2-CD1 3.5Å; L1113-I1168 HydrophobicContact CD2-CG1 3.72Å; V1164-I1168 HydrophobicContact CG1-CD1 3.94Å; V1164-I1168 HydrophobicContact CG1-CG1 4.42Å; V1164-I1168 VanDerWaalsContact O-CG1 3.31Å; V1164-I1168 WeakPolarHBondContact O-CG1 3.41Å; V1164-I1168 PolarHBondContact O-N 3.48Å; R1165-I1168 PolarHBondContact O-N 2.69Å; I1168-E1170 PolarHBondContact O-N 3.34Å; I1168-R1171 PolarHBondContact O-N 2.96Å; I1168-R1172 WeakPolarHBondContact O-CB 3.43Å; I1168-R1172 PolarHBondContact O-N 3.3Å
1169	D	82.3	Confident	79.6	Confident	96 Å²	96	81.9 Å²	81.9	51%	0.513	40%	0.404	S	S	.	.	H	α-helix	trans	-63.5	-41.6	-178.1	-72.8	-23.8	0	0	0	112.2	R1165 K1166 W1167 R1171 R1172 A1173	R1165-D1169 PolarHBondContact O-N 3.06Å; K1166-D1169 PolarHBondContact O-N 2.83Å; W1167-D1169 VanDerWaalsContact C-N 3.34Å; W1167-D1169 PolarHBondContact O-N 2.91Å; D1169-R1171 VanDerWaalsContact C-N 3.34Å; D1169-R1171 PolarHBondContact O-N 3.44Å; D1169-R1172 PolarHBondContact O-N 3.1Å; D1169-A1173 WeakPolarHBondContact O-CB 3.46Å; D1169-A1173 PolarHBondContact O-N 3.23Å
1170	E	83.7	Confident	78.2	Confident	96 Å²	96	79.1 Å²	79.1	45%	0.449	39%	0.393	S	S	.	.	H	α-helix	trans	-61.5	-40.8	176.1	-77.4	176.7	-172.5	0	0	111.8	K1166 W1167 I1168 Q1174	K1166-E1170 VanDerWaalsContact CE-OE1 3.3Å; K1166-E1170 WeakPolarHBondContact CE-OE1 3.14Å; K1166-E1170 WeakPolarHBondContact O-CG 3.09Å; K1166-E1170 PolarHBondContact O-N 3.47Å; W1167-E1170 PolarHBondContact O-N 3.26Å; I1168-E1170 PolarHBondContact O-N 3.34Å; E1170-Q1174 WeakPolarHBondContact O-CG 3.26Å; E1170-Q1174 PolarHBondContact O-N 2.79Å
1171	R	79.7	Confident	76.5	Confident	70 Å²	70	84 Å²	84	26%	0.264	41%	0.414	S	S	.	.	H	α-helix	trans	-70.4	-43.2	176.9	-68.3	-48.6	-174.7	108.2	-3.4	113	D1100 W1167 I1168 D1169 A1173 Q1174 R1175	D1100-R1171 IonicContact OD1-CZ 3.46Å; D1100-R1171 IonicContact OD1-NH1 2.67Å; D1100-R1171 PolarHBondContact OD1-NH1 2.78Å; D1100-R1171 IonicContact OD1-NH2 3.71Å; D1100-R1171 IonicContact OD2-CZ 3.09Å; D1100-R1171 IonicContact OD2-NH1 3.83Å; D1100-R1171 PolarHBondContact OD2-NH1 3.43Å; D1100-R1171 IonicContact OD2-NH2 2.71Å; D1100-R1171 PolarHBondContact OD2-NH2 3.23Å; W1167-R1171 HydrophobicContact CD2-CG 4.44Å; W1167-R1171 HydrophobicContact CZ2-CG 4.11Å; W1167-R1171 WeakPolarHBondContact O-CG 3.47Å; W1167-R1171 PolarHBondContact O-N 2.69Å; W1167-R1171 VanDerWaalsContact O-N 3.11Å; I1168-R1171 PolarHBondContact O-N 2.96Å; D1169-R1171 VanDerWaalsContact C-N 3.34Å; D1169-R1171 PolarHBondContact O-N 3.44Å; R1171-A1173 VanDerWaalsContact C-N 3.26Å; R1171-A1173 PolarHBondContact O-N 2.96Å; R1171-Q1174 PolarHBondContact O-N 2.95Å; R1171-Q1174 VanDerWaalsContact O-N 3.17Å; R1171-R1175 PolarHBondContact O-N 3.26Å
1172	R	73.8	Confident	74.8	Confident	119 Å²	119	82.7 Å²	82.7	45%	0.449	42%	0.42	S	S	.	.	H	α-helix	trans	-59.5	-40.7	176.2	-153.6	-178.5	-79.4	174.8	-9.2	110.7	I1168 D1169 L1176	I1168-R1172 WeakPolarHBondContact O-CB 3.43Å; I1168-R1172 PolarHBondContact O-N 3.3Å; D1169-R1172 PolarHBondContact O-N 3.1Å; R1172-L1176 PolarHBondContact O-N 3.23Å; R1172-L1176 VanDerWaalsContact O-N 3.12Å
1173	A	77.9	Confident	73	Confident	58 Å²	58	85.6 Å²	85.6	48%	0.479	43%	0.431	S	S	.	.	H	α-helix	trans	-65.9	-43.6	174.6	0	0	0	0	0	113.2	D1169 R1171 R1175 L1176 S1177	D1169-A1173 WeakPolarHBondContact O-CB 3.46Å; D1169-A1173 PolarHBondContact O-N 3.23Å; R1171-A1173 VanDerWaalsContact C-N 3.26Å; R1171-A1173 PolarHBondContact O-N 2.96Å; A1173-R1175 VanDerWaalsContact C-N 3.33Å; A1173-R1175 PolarHBondContact O-N 3.11Å; A1173-L1176 PolarHBondContact O-N 3.3Å; A1173-S1177 PolarHBondContact O-N 2.91Å; A1173-S1177 VanDerWaalsContact O-N 3.1Å
1174	Q	76	Confident	71.2	Confident	109 Å²	109	90 Å²	90	51%	0.509	44%	0.444	S	S	.	.	H	α-helix	trans	-60.2	-41.9	176.5	-77.8	179.8	22.2	0	0	111.9	E1170 R1171 S1177 K1178	E1170-Q1174 WeakPolarHBondContact O-CG 3.26Å; E1170-Q1174 PolarHBondContact O-N 2.79Å; R1171-Q1174 PolarHBondContact O-N 2.95Å; R1171-Q1174 VanDerWaalsContact O-N 3.17Å; Q1174-S1177 PolarHBondContact O-N 3.18Å; Q1174-S1177 PolarHBondContact O-OG 3.45Å; Q1174-K1178 PolarHBondContact O-N 3.01Å; Q1174-K1178 VanDerWaalsContact O-N 3.09Å
1175	R	67.9	Low	69.4	Low	66 Å²	66	97.2 Å²	97.2	25%	0.249	48%	0.478	C	S	.	.	H	α-helix	trans	-65	-47.4	176.2	173.6	173.3	164.2	178.8	8.7	112.8	N1093 D1097 R1171 A1173 S1177 K1178 N1179	N1093-R1175 PolarHBondContact O-NH1 3.28Å; N1093-R1175 PolarHBondContact OD1-NH2 2.84Å; D1097-R1175 WeakPolarHBondContact OD1-CD 3.48Å; D1097-R1175 IonicContact OD1-CZ 3.93Å; D1097-R1175 IonicContact OD1-NE 3.56Å; D1097-R1175 IonicContact OD1-NH1 3.01Å; D1097-R1175 PolarHBondContact OD1-NH1 2.9Å; D1097-R1175 IonicContact OD2-CZ 2.69Å; D1097-R1175 IonicContact OD2-NH1 2.81Å; D1097-R1175 PolarHBondContact OD2-NH1 3.47Å; R1171-R1175 PolarHBondContact O-N 3.26Å; A1173-R1175 VanDerWaalsContact C-N 3.33Å; A1173-R1175 PolarHBondContact O-N 3.11Å; R1175-S1177 PolarHBondContact O-N 2.85Å; R1175-K1178 PolarHBondContact O-N 3.46Å; R1175-N1179 PolarHBondContact O-N 2.85Å
1176	L	70.4	Confident	67.6	Low	112 Å²	112	100.1 Å²	100.1	59%	0.586	49%	0.494	S	S	*	.	H	α-helix	trans	-55.3	-40.6	178.7	-81.1	158.3	0	0	0	110.7	R1172 A1173 N1179 T1180	R1172-L1176 PolarHBondContact O-N 3.23Å; R1172-L1176 VanDerWaalsContact O-N 3.12Å; A1173-L1176 PolarHBondContact O-N 3.3Å; L1176-N1179 PolarHBondContact O-N 3.12Å; L1176-T1180 PolarHBondContact O-N 2.77Å; L1176-T1180 PolarHBondContact O-OG1 3.11Å
1177	S	68.2	Low	65.7	Low	62 Å²	62	98.6 Å²	98.6	43%	0.434	50%	0.501	S	S	.	.	H	α-helix	trans	-64.2	-42.5	174.8	79.4	0	0	0	0	113.4	A1173 Q1174 R1175 T1180 Q1181	A1173-S1177 PolarHBondContact O-N 2.91Å; A1173-S1177 VanDerWaalsContact O-N 3.1Å; Q1174-S1177 PolarHBondContact O-N 3.18Å; Q1174-S1177 PolarHBondContact O-OG 3.45Å; R1175-S1177 PolarHBondContact O-N 2.85Å; S1177-T1180 PolarHBondContact O-N 3.03Å; S1177-Q1181 PolarHBondContact O-N 3.43Å
1178	K	64.3	Low	63.3	Low	160 Å²	160	103.9 Å²	103.9	70%	0.696	54%	0.542	S	S	*	.	H	α-helix	trans	-65.4	-40.5	175.4	-92.2	-179.1	175.7	173.7	0	112.8	Q1174 R1175 T1180 Q1181 G1182	Q1174-K1178 PolarHBondContact O-N 3.01Å; Q1174-K1178 VanDerWaalsContact O-N 3.09Å; R1175-K1178 PolarHBondContact O-N 3.46Å; K1178-T1180 VanDerWaalsContact C-N 3.32Å; K1178-T1180 PolarHBondContact O-N 3.21Å; K1178-Q1181 PolarHBondContact O-N 2.99Å; K1178-G1182 PolarHBondContact O-N 2.84Å
1179	N	60.4	Low	62.4	Low	100 Å²	100	107.1 Å²	107.1	54%	0.535	56%	0.559	S	S	.	*	H	α-helix	trans	-68.5	-32.3	178.6	-105.5	2.4	0	0	0	112.3	R1175 L1176 N1183	R1175-N1179 PolarHBondContact O-N 2.85Å; L1176-N1179 PolarHBondContact O-N 3.12Å; N1179-N1183 PolarHBondContact O-N 2.9Å
1180	T	59.1	Low	61.4	Low	87 Å²	87	107.7 Å²	107.7	53%	0.534	56%	0.562	S	S	.	*	H	α-helix	trans	-70.6	-41.2	176.6	-45.1	0	0	0	0	110.5	L1176 S1177 K1178 G1182 E1184	L1176-T1180 PolarHBondContact O-N 2.77Å; L1176-T1180 PolarHBondContact O-OG1 3.11Å; S1177-T1180 PolarHBondContact O-N 3.03Å; K1178-T1180 VanDerWaalsContact C-N 3.32Å; K1178-T1180 PolarHBondContact O-N 3.21Å; T1180-G1182 PolarHBondContact O-N 3.13Å; T1180-E1184 PolarHBondContact O-N 3.5Å
1181	Q	54.2	Low	60.1	Low	131 Å²	131	108.3 Å²	108.3	61%	0.612	57%	0.568	S	S	*	*	H	α-helix	trans	-67.1	-34.1	174.6	-72.5	-177.9	-7.8	0	0	113.6	S1177 K1178 Q1185	S1177-Q1181 PolarHBondContact O-N 3.43Å; K1178-Q1181 PolarHBondContact O-N 2.99Å; Q1181-Q1185 PolarHBondContact O-N 2.95Å
1182	G	52.4	Low	59	Low	34 Å²	34	110.6 Å²	110.6	35%	0.351	59%	0.586	S	S	.	*	H	α-helix	trans	-73.4	-29.4	178.3	0	0	0	0	0	114.7	K1178 T1180 K1186	K1178-G1182 PolarHBondContact O-N 2.84Å; T1180-G1182 PolarHBondContact O-N 3.13Å; G1182-K1186 PolarHBondContact O-N 2.98Å
1183	N	51.1	Low	58	Low	122 Å²	122	110.1 Å²	110.1	65%	0.652	60%	0.595	S	S	*	*	H	α-helix	trans	-78.4	-32	175.8	-100	-5.4	0	0	0	112.6	N1179 Q1185 K1186 S1187	N1179-N1183 PolarHBondContact O-N 2.9Å; N1183-Q1185 VanDerWaalsContact C-N 3.34Å; N1183-Q1185 PolarHBondContact O-N 3.21Å; N1183-K1186 PolarHBondContact O-N 3.36Å; N1183-S1187 PolarHBondContact O-N 3.33Å
1184	E	50.1	Low	56.7	Low	132 Å²	132	113.5 Å²	113.5	62%	0.617	60%	0.602	S	S	*	*	H	α-helix	trans	-63.5	-40.3	173.2	-73.5	-177.7	164.1	0	0	111.3	T1180 K1186 S1187 S1188	T1180-E1184 PolarHBondContact O-N 3.5Å; E1184-K1186 VanDerWaalsContact C-N 3.34Å; E1184-K1186 PolarHBondContact O-N 3.28Å; E1184-S1187 PolarHBondContact O-N 3Å; E1184-S1187 PolarHBondContact O-OG 3.07Å; E1184-S1188 PolarHBondContact O-N 3.09Å; E1184-S1188 PolarHBondContact O-OG 3.36Å
1185	Q	47.3	Very low	55.3	Low	157 Å²	157	113.9 Å²	113.9	73%	0.734	61%	0.609	S	S	*	*	H	α-helix	trans	-71.9	-16.6	176.9	-79.2	-178.7	-14.7	0	0	115.7	Q1181 N1183 S1188	Q1181-Q1185 PolarHBondContact O-N 2.95Å; N1183-Q1185 VanDerWaalsContact C-N 3.34Å; N1183-Q1185 PolarHBondContact O-N 3.21Å; Q1185-S1188 PolarHBondContact O-OG 2.71Å
1186	K	49	Very low	54.4	Low	185 Å²	185	117.5 Å²	117.5	80%	0.804	64%	0.636	S	S	*	*	H	α-helix	trans	-92.8	-14.5	173.1	-89.3	-178.3	177.1	175.4	0	113.4	G1182 N1183 E1184	G1182-K1186 PolarHBondContact O-N 2.98Å; N1183-K1186 PolarHBondContact O-N 3.36Å; E1184-K1186 VanDerWaalsContact C-N 3.34Å; E1184-K1186 PolarHBondContact O-N 3.28Å
1187	S	46	Very low	53	Low	105 Å²	105	118 Å²	118	73%	0.734	64%	0.641	S	S	*	*	H	α-helix	trans	-94.8	-14.9	178.1	74	0	0	0	0	113.9	N1183 E1184	N1183-S1187 PolarHBondContact O-N 3.33Å; E1184-S1187 PolarHBondContact O-N 3Å; E1184-S1187 PolarHBondContact O-OG 3.07Å
1188	S	34.2	Very low	51.7	Low	141 Å²	141	123.1 Å²	123.1	99%	0.986	66%	0.659	S	S	*	*			trans	-92.3	0	168.2	61	0	0	0	0	111.2	E1184 Q1185	E1184-S1188 PolarHBondContact O-N 3.09Å; E1184-S1188 PolarHBondContact O-OG 3.36Å; Q1185-S1188 PolarHBondContact O-OG 2.71Å

Retrieved 1,188 of 1,188 residues in 1319 ms (Link to these results)

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