A0A077ZDK4_TRITR Loading...

Glutamate receptor, metabotropic 5

AlphaFold DB , UniProt , Accession A0A077ZDK4, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 1,176 aa.

						>A0A077ZDK4_TRITR|A0A077ZDK4
MGCHCKISFLFFFIIFVYLMVALRFVVSDKYLQSLLNSTAPPTHMRVATIPGDLQIGVLFPIHRKIAGTERCGKIWEQYGIQRTEIAMQTVDAINNDRTILPNVQLGISIRDDCWTERIAMEQTIELIRDVVGGRSLHKVSYCSAGSRQTESDQEQTNSPEMSNIVAVIGPGSSDVSIAVQNLLQVFHIPQVGYSATTKALSDKTEFKYYMRVVPSDSWQAKAMVDIVRYFNWSYVAVIYTDGNYGEKGFEELQRNFEEEEGLCIGVSEKIKSLAPPEEYDRLIDSLMSYRPKITVAICFCEGDTIKKIFEATKRVRQKLKVRSRQAQDSLQWIGSLLFIQYFVFDVCIFSESWSDRKDVVTGVEDVATGAYSFRIYSPPVPHFEKYYFSLTPENNKRNPWFIDFWEEKFNCSYRKLTRLLYQRRCKGSENVTFGYKPDPKLSQVVTSIYTVAYALDSMYKDVCTGYIAKGVCPAMVPVDGSKLFQYMLKTEFSDLSGQSIYFDKNGDPPARYDILNYQGKQAGYVTVGTWGHVWRDVEPFNRTSHPVVKYGSKLRIDRRKILWHNRKSGSSYTPVAKCSYECGIGEIKKIQAMKCCWTCVPCFENEYLLNEYKCKECSVGSWPIENRTGKLDMPLIDHVASIVHALMSSLLVFHLLDAACYKLDVEYMRWGDAEAIVCVVFACAGILATLFTTTIFVMKNTTPVVKATTRELSYMILGGLLLCYVTTFIIVTPPCTVTCVLLRVVPCLAFAMIYGALFTKTNRIARILAASKKIITKRRRFLSTGAQVVITCILIGVELVITVVFLILEPPAAEFDHSIPRRVLLVCRFSKMGFFAPFGFDLFLVSMCTLYAIKTRNLPENFNEAKFIGFTMYTTCIVWLAFLAIYFGSNKKDTTMCICFSLSASVALVLLFFPKLYVILWRPEKNVRSYFKTTTTIRCHFGANQVPGSGTQSRVSSISGSQKKRNRTGALRIRSKPGQLLGSGDSYSSYSTQSSPNLSRCGSKTSHVTAALGDLSRKESSAPDQEGRTTDTDVDRKSSIATELATMKDKMTGLTKIQEIPSPSTSPVSMRRSRSLWRKFDPLLRNPELSQRWKSFRSRPETVRGKATPTLLLRVAAERLDAVRQFLDERSKQCAEDSAHTPSPPPADEPTSCEAAADTVSGRVRKGPYFTLYIF
					

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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	38.3	Very low	54.2	Low	254 Å²	254	137.1 Å²	137.1	100%	1.251	74%	0.739	S	S	*	*				0	110.7	0	-70.7	153.2	90.2	0	0	107.2
2	G	47.3	Very low	56.1	Low	76 Å²	76	138.3 Å²	138.3	78%	0.784	73%	0.733	S	S	*	*			trans	153.7	-17.1	-171.7	0	0	0	0	0	115.6
3	C	42.4	Very low	57.7	Low	111 Å²	111	138 Å²	138	75%	0.75	72%	0.722	S	S	*	*	S	Bend	trans	-92.1	-9.9	-178.2	-86	0	0	0	0	116
4	H	46.2	Very low	59	Low	173 Å²	173	135 Å²	135	80%	0.801	71%	0.705	S	S	*	*	S	Bend	trans	-84.1	-11.9	-171.7	-96.8	-88	0	0	0	115.9
5	C	48	Very low	60.6	Low	108 Å²	108	131.1 Å²	131.1	73%	0.73	69%	0.685	S	S	*	*	H	α-helix	trans	-88.5	-21.5	-174.5	-141.8	0	0	0	0	114
6	K	48.9	Very low	61.8	Low	180 Å²	180	130.6 Å²	130.6	78%	0.783	68%	0.676	S	S	*	*	H	α-helix	trans	-79.1	-23.2	-178.3	-75.3	-173.7	175.1	-177.5	0	114.5	L10	K6-L10 PolarHBondContact O-N 3.47Å
7	I	57.4	Low	62.7	Low	118 Å²	118	126.9 Å²	126.9	61%	0.605	66%	0.66	S	S	*	*	H	α-helix	trans	-75.8	-35.8	-179.9	-68.6	167.9	0	0	0	111.1	F9 L10 F11	I7-F9 PolarHBondContact O-N 3.28Å; I7-L10 PolarHBondContact O-N 3.19Å; I7-F11 WeakPolarHBondContact O-CB 3.47Å; I7-F11 PolarHBondContact O-N 3.46Å
8	S	61.5	Low	63.3	Low	71 Å²	71	130 Å²	130	50%	0.497	66%	0.663	S	S	.	*	H	α-helix	trans	-68.7	-35.8	179.9	-156.6	0	0	0	0	112.1	F11 F12	S8-F11 PolarHBondContact O-N 3.14Å; S8-F12 PolarHBondContact O-N 3.24Å
9	F	65.7	Low	64.1	Low	164 Å²	164	128.1 Å²	128.1	72%	0.719	65%	0.654	S	S	*	*	H	α-helix	trans	-69.3	-37.6	175.5	-131	-88.5	0	0	0	112.5	I7 F13	I7-F9 PolarHBondContact O-N 3.28Å; F9-F13 WeakPolarHBondContact O-CB 3.46Å; F9-F13 PolarHBondContact O-N 3.36Å
10	L	66.9	Low	64.6	Low	117 Å²	117	126.5 Å²	126.5	61%	0.613	65%	0.645	S	S	*	*	H	α-helix	trans	-68.9	-37.2	176	-143.1	85.1	0	0	0	111.6	K6 I7 F13 I14	K6-L10 PolarHBondContact O-N 3.47Å; I7-L10 PolarHBondContact O-N 3.19Å; L10-F13 PolarHBondContact O-N 3.21Å; L10-I14 HydrophobicContact CD2-CD1 4.43Å; L10-I14 WeakPolarHBondContact O-CB 3.28Å; L10-I14 VanDerWaalsContact O-CG1 3.25Å; L10-I14 WeakPolarHBondContact O-CG1 3.37Å; L10-I14 PolarHBondContact O-N 3.45Å
11	F	73.6	Confident	64.9	Low	136 Å²	136	124 Å²	124	60%	0.596	64%	0.635	S	S	*	*	H	α-helix	trans	-67.1	-43.8	177.6	-148.3	-95.9	0	0	0	111.6	I7 S8 I14 I15	I7-F11 WeakPolarHBondContact O-CB 3.47Å; I7-F11 PolarHBondContact O-N 3.46Å; S8-F11 PolarHBondContact O-N 3.14Å; F11-I14 PolarHBondContact O-N 3.03Å; F11-I15 HydrophobicContact CD1-CD1 3.61Å; F11-I15 HydrophobicContact CD1-CG1 4.36Å; F11-I15 HydrophobicContact CE1-CD1 3.7Å; F11-I15 HydrophobicContact CE1-CG1 4.48Å; F11-I15 WeakPolarHBondContact O-CB 3.16Å; F11-I15 WeakPolarHBondContact O-CG1 3.23Å; F11-I15 PolarHBondContact O-N 3.42Å
12	F	77.5	Confident	66.5	Low	151 Å²	151	114 Å²	114	66%	0.662	59%	0.594	S	S	*	*	H	α-helix	trans	-64.8	-37.4	173.1	-99.2	-84	0	0	0	112.5	S8 F16	S8-F12 PolarHBondContact O-N 3.24Å; F12-F16 VanDerWaalsContact O-CB 3.22Å; F12-F16 WeakPolarHBondContact O-CB 3.37Å; F12-F16 PolarHBondContact O-N 3.16Å
13	F	76.8	Confident	67.2	Low	135 Å²	135	114.6 Å²	114.6	59%	0.592	58%	0.578	S	S	*	*	H	α-helix	trans	-69.4	-39	177.5	-153.4	-91.5	0	0	0	112.1	F9 L10 F16 V17	F9-F13 WeakPolarHBondContact O-CB 3.46Å; F9-F13 PolarHBondContact O-N 3.36Å; L10-F13 PolarHBondContact O-N 3.21Å; F13-F16 PolarHBondContact O-N 3.07Å; F13-V17 HydrophobicContact CD1-CG2 3.89Å; F13-V17 HydrophobicContact CE1-CG2 3.85Å; F13-V17 WeakPolarHBondContact O-CB 3.33Å; F13-V17 VanDerWaalsContact O-CG2 3.26Å; F13-V17 WeakPolarHBondContact O-CG2 3.46Å; F13-V17 PolarHBondContact O-N 3.14Å
14	I	76.1	Confident	67.8	Low	96 Å²	96	119.4 Å²	119.4	49%	0.492	58%	0.581	S	S	.	*	H	α-helix	trans	-65.6	-45.4	174.3	-69.2	166.6	0	0	0	110.4	L10 F11 F16 V17 Y18	L10-I14 HydrophobicContact CD2-CD1 4.43Å; L10-I14 WeakPolarHBondContact O-CB 3.28Å; L10-I14 VanDerWaalsContact O-CG1 3.25Å; L10-I14 WeakPolarHBondContact O-CG1 3.37Å; L10-I14 PolarHBondContact O-N 3.45Å; F11-I14 PolarHBondContact O-N 3.03Å; I14-F16 VanDerWaalsContact C-N 3.33Å; I14-F16 PolarHBondContact O-N 3.2Å; I14-V17 PolarHBondContact O-N 2.86Å; I14-Y18 WeakPolarHBondContact O-CB 3.48Å; I14-Y18 PolarHBondContact O-N 3.47Å
15	I	82.3	Confident	68.2	Low	77 Å²	77	119.3 Å²	119.3	40%	0.395	58%	0.578	S	S	.	*	H	α-helix	trans	-61.5	-42.2	175.5	-71	172.7	0	0	0	110.7	F11 Y18 L19	F11-I15 HydrophobicContact CD1-CD1 3.61Å; F11-I15 HydrophobicContact CD1-CG1 4.36Å; F11-I15 HydrophobicContact CE1-CD1 3.7Å; F11-I15 HydrophobicContact CE1-CG1 4.48Å; F11-I15 WeakPolarHBondContact O-CB 3.16Å; F11-I15 WeakPolarHBondContact O-CG1 3.23Å; F11-I15 PolarHBondContact O-N 3.42Å; I15-Y18 PolarHBondContact O-N 2.93Å; I15-L19 HydrophobicContact CG2-CD1 3.83Å; I15-L19 WeakPolarHBondContact O-CB 3.28Å; I15-L19 PolarHBondContact O-N 3.32Å
16	F	80	Confident	68.7	Low	123 Å²	123	119.3 Å²	119.3	54%	0.539	58%	0.575	S	S	.	*	H	α-helix	trans	-67	-38.7	178.4	-168	-94.8	0	0	0	112.3	F12 F13 I14 L19 M20	F12-F16 VanDerWaalsContact O-CB 3.22Å; F12-F16 WeakPolarHBondContact O-CB 3.37Å; F12-F16 PolarHBondContact O-N 3.16Å; F13-F16 PolarHBondContact O-N 3.07Å; I14-F16 VanDerWaalsContact C-N 3.33Å; I14-F16 PolarHBondContact O-N 3.2Å; F16-L19 PolarHBondContact O-N 3.07Å; F16-M20 HydrophobicContact CD1-CG 4.03Å; F16-M20 HydrophobicContact CE1-CE 3.93Å; F16-M20 HydrophobicContact CE1-CG 3.78Å; F16-M20 HydrophobicContact CE2-CE 4.22Å; F16-M20 HydrophobicContact CZ-CE 3.55Å; F16-M20 HydrophobicContact CZ-CG 4.28Å; F16-M20 VanDerWaalsContact O-CB 3.27Å; F16-M20 WeakPolarHBondContact O-CB 3.33Å; F16-M20 VanDerWaalsContact O-CG 3.28Å; F16-M20 WeakPolarHBondContact O-CG 3.33Å; F16-M20 PolarHBondContact O-N 3.39Å
17	V	77.4	Confident	68.9	Low	67 Å²	67	116 Å²	116	41%	0.406	57%	0.569	S	S	.	*	H	α-helix	trans	-68.4	-39.9	173	172.4	0	0	0	0	110.7	F13 I14 M20 V21	F13-V17 HydrophobicContact CD1-CG2 3.89Å; F13-V17 HydrophobicContact CE1-CG2 3.85Å; F13-V17 WeakPolarHBondContact O-CB 3.33Å; F13-V17 VanDerWaalsContact O-CG2 3.26Å; F13-V17 WeakPolarHBondContact O-CG2 3.46Å; F13-V17 PolarHBondContact O-N 3.14Å; I14-V17 PolarHBondContact O-N 2.86Å; V17-M20 PolarHBondContact O-N 2.92Å; V17-V21 HydrophobicContact CG1-CG2 4.25Å; V17-V21 WeakPolarHBondContact O-CB 3.41Å; V17-V21 WeakPolarHBondContact O-CG2 3.22Å; V17-V21 PolarHBondContact O-N 3.26Å
18	Y	73.4	Confident	68.3	Low	183 Å²	183	113.6 Å²	113.6	72%	0.718	56%	0.563	S	S	*	*	H	α-helix	trans	-65	-40.7	174.8	-124.7	-89.5	0	0	0	111.7	I14 I15 A22	I14-Y18 WeakPolarHBondContact O-CB 3.48Å; I14-Y18 PolarHBondContact O-N 3.47Å; I15-Y18 PolarHBondContact O-N 2.93Å; Y18-A22 WeakPolarHBondContact O-CB 3.47Å; Y18-A22 PolarHBondContact O-N 3.21Å
19	L	77.6	Confident	67.7	Low	94 Å²	94	114.6 Å²	114.6	49%	0.492	56%	0.563	S	S	.	*	H	α-helix	trans	-67.3	-38.5	173.6	-101.7	147.4	0	0	0	111.6	I15 F16 A22 L23	I15-L19 HydrophobicContact CG2-CD1 3.83Å; I15-L19 WeakPolarHBondContact O-CB 3.28Å; I15-L19 PolarHBondContact O-N 3.32Å; F16-L19 PolarHBondContact O-N 3.07Å; L19-A22 PolarHBondContact O-N 3.16Å; L19-L23 HydrophobicContact CD2-CD1 4.03Å; L19-L23 VanDerWaalsContact O-CB 3.22Å; L19-L23 WeakPolarHBondContact O-CB 3.46Å; L19-L23 WeakPolarHBondContact O-CD1 3.43Å; L19-L23 PolarHBondContact O-N 2.93Å
20	M	74.5	Confident	66.8	Low	96 Å²	96	115.6 Å²	115.6	47%	0.473	57%	0.567	S	S	.	*	H	α-helix	trans	-71.6	-34.8	176.1	-80.2	-74.6	162.4	0	0	112.7	F16 V17 R24	F16-M20 HydrophobicContact CD1-CG 4.03Å; F16-M20 HydrophobicContact CE1-CE 3.93Å; F16-M20 HydrophobicContact CE1-CG 3.78Å; F16-M20 HydrophobicContact CE2-CE 4.22Å; F16-M20 HydrophobicContact CZ-CE 3.55Å; F16-M20 HydrophobicContact CZ-CG 4.28Å; F16-M20 VanDerWaalsContact O-CB 3.27Å; F16-M20 WeakPolarHBondContact O-CB 3.33Å; F16-M20 VanDerWaalsContact O-CG 3.28Å; F16-M20 WeakPolarHBondContact O-CG 3.33Å; F16-M20 PolarHBondContact O-N 3.39Å; V17-M20 PolarHBondContact O-N 2.92Å; M20-R24 WeakPolarHBondContact O-CB 3.13Å; M20-R24 WeakPolarHBondContact O-CG 3.22Å; M20-R24 PolarHBondContact O-N 3.18Å
21	V	71.7	Confident	65.9	Low	73 Å²	73	117.8 Å²	117.8	44%	0.442	57%	0.568	S	S	.	*	H	α-helix	trans	-69.4	-45.4	171.4	172	0	0	0	0	109.3	V17 L23 R24 F25	V17-V21 HydrophobicContact CG1-CG2 4.25Å; V17-V21 WeakPolarHBondContact O-CB 3.41Å; V17-V21 WeakPolarHBondContact O-CG2 3.22Å; V17-V21 PolarHBondContact O-N 3.26Å; V21-L23 PolarHBondContact O-N 3.01Å; V21-R24 CarbonylContact O-C 3.6Å; V21-R24 PolarHBondContact O-N 3.46Å; V21-R24 VanDerWaalsContact O-N 3.15Å; V21-F25 HydrophobicContact CG1-CD2 3.84Å; V21-F25 HydrophobicContact CG1-CE2 3.86Å; V21-F25 VanDerWaalsContact O-CD2 3.25Å; V21-F25 WeakPolarHBondContact O-CD2 3.45Å; V21-F25 PolarHBondContact O-N 2.71Å
22	A	71.2	Confident	64.6	Low	46 Å²	46	115.8 Å²	115.8	38%	0.38	56%	0.563	S	S	.	*	H	α-helix	trans	-61.6	-40.4	174.2	0	0	0	0	0	112.1	Y18 L19 F25 V26	Y18-A22 WeakPolarHBondContact O-CB 3.47Å; Y18-A22 PolarHBondContact O-N 3.21Å; L19-A22 PolarHBondContact O-N 3.16Å; A22-F25 CarbonylContact O-C 3.52Å; A22-F25 WeakPolarHBondContact O-CA 3.32Å; A22-F25 WeakPolarHBondContact O-CB 3.47Å; A22-F25 PolarHBondContact O-N 3.38Å; A22-F25 VanDerWaalsContact O-N 3.15Å; A22-V26 VanDerWaalsContact O-CG2 3.28Å; A22-V26 WeakPolarHBondContact O-CG2 3.44Å; A22-V26 PolarHBondContact O-N 3.45Å
23	L	62.3	Low	63.2	Low	87 Å²	87	114.4 Å²	114.4	46%	0.455	56%	0.559	S	S	.	*	H	α-helix	trans	-69.4	-33.2	173.7	-97.8	125.9	0	0	0	111.9	L19 V21 F25 V26 V27	L19-L23 HydrophobicContact CD2-CD1 4.03Å; L19-L23 VanDerWaalsContact O-CB 3.22Å; L19-L23 WeakPolarHBondContact O-CB 3.46Å; L19-L23 WeakPolarHBondContact O-CD1 3.43Å; L19-L23 PolarHBondContact O-N 2.93Å; V21-L23 PolarHBondContact O-N 3.01Å; L23-F25 VanDerWaalsContact C-N 3.28Å; L23-F25 PolarHBondContact O-N 3.28Å; L23-V26 PolarHBondContact O-N 3.46Å; L23-V27 HydrophobicContact CD2-CG2 4.38Å; L23-V27 VanDerWaalsContact O-CB 3.23Å; L23-V27 WeakPolarHBondContact O-CB 3.28Å; L23-V27 WeakPolarHBondContact O-CG2 3.27Å; L23-V27 PolarHBondContact O-N 2.81Å
24	R	55.6	Low	61.7	Low	213 Å²	213	111.8 Å²	111.8	80%	0.804	56%	0.557	S	S	*	*	H	α-helix	trans	-68.5	-28.3	169.3	-83.3	-168.6	176.4	-154.9	0.5	112.6	M20 V21	M20-R24 WeakPolarHBondContact O-CB 3.13Å; M20-R24 WeakPolarHBondContact O-CG 3.22Å; M20-R24 PolarHBondContact O-N 3.18Å; V21-R24 CarbonylContact O-C 3.6Å; V21-R24 PolarHBondContact O-N 3.46Å; V21-R24 VanDerWaalsContact O-N 3.15Å
25	F	53.9	Low	60.3	Low	171 Å²	171	111.7 Å²	111.7	75%	0.75	56%	0.557	S	S	*	*	H	α-helix	trans	-75.8	-31.5	170.6	-88	-78.2	0	0	0	112.6	V21 A22 L23	V21-F25 HydrophobicContact CG1-CD2 3.84Å; V21-F25 HydrophobicContact CG1-CE2 3.86Å; V21-F25 VanDerWaalsContact O-CD2 3.25Å; V21-F25 WeakPolarHBondContact O-CD2 3.45Å; V21-F25 PolarHBondContact O-N 2.71Å; A22-F25 CarbonylContact O-C 3.52Å; A22-F25 WeakPolarHBondContact O-CA 3.32Å; A22-F25 WeakPolarHBondContact O-CB 3.47Å; A22-F25 PolarHBondContact O-N 3.38Å; A22-F25 VanDerWaalsContact O-N 3.15Å; L23-F25 VanDerWaalsContact C-N 3.28Å; L23-F25 PolarHBondContact O-N 3.28Å
26	V	58.5	Low	58.5	Low	108 Å²	108	113.1 Å²	113.1	66%	0.655	57%	0.565	S	S	*	*	H	α-helix	trans	-84.7	-24	178.2	174.1	0	0	0	0	112.9	A22 L23	A22-V26 VanDerWaalsContact O-CG2 3.28Å; A22-V26 WeakPolarHBondContact O-CG2 3.44Å; A22-V26 PolarHBondContact O-N 3.45Å; L23-V26 PolarHBondContact O-N 3.46Å
27	V	52.8	Low	56.4	Low	109 Å²	109	114.3 Å²	114.3	66%	0.661	58%	0.577	S	S	*	*	S	Bend	trans	-93.2	6.4	-179.2	179.8	0	0	0	0	113	L23 D29	L23-V27 HydrophobicContact CD2-CG2 4.38Å; L23-V27 VanDerWaalsContact O-CB 3.23Å; L23-V27 WeakPolarHBondContact O-CB 3.28Å; L23-V27 WeakPolarHBondContact O-CG2 3.27Å; L23-V27 PolarHBondContact O-N 2.81Å; V27-D29 PolarHBondContact O-N 3.15Å
28	S	45.9	Very low	54.2	Low	69 Å²	69	114.8 Å²	114.8	48%	0.483	58%	0.583	S	S	.	*	T	Hydrogen-bonded Turn	trans	-84.8	30.5	165.9	-144.6	0	0	0	0	112.9	K30 Y31 L32	S28-K30 PolarHBondContact O-N 3.5Å; S28-Y31 WeakPolarHBondContact O-CB 3.35Å; S28-Y31 PolarHBondContact O-N 3.29Å; S28-L32 PolarHBondContact O-N 2.82Å
29	D	47.8	Very low	52.2	Low	91 Å²	91	111.8 Å²	111.8	49%	0.487	58%	0.584	S	S	.	*	H	α-helix	trans	-69.3	-14.6	179.2	-152.4	6	0	0	0	112.7	V27 Y31 L32 Q33	V27-D29 PolarHBondContact O-N 3.15Å; D29-Y31 VanDerWaalsContact C-N 3.3Å; D29-L32 PolarHBondContact O-N 2.84Å; D29-Q33 PolarHBondContact O-N 2.75Å
30	K	47.6	Very low	49.9	Very low	185 Å²	185	110.8 Å²	110.8	80%	0.804	59%	0.59	S	S	*	*	H	α-helix	trans	-73.5	-20.2	166.4	-79.9	-172.6	176.7	-176.5	0	113.6	S28	S28-K30 PolarHBondContact O-N 3.5Å
31	Y	47.7	Very low	47.8	Very low	164 Å²	164	111.2 Å²	111.2	64%	0.643	60%	0.6	S	S	*	*	H	α-helix	trans	-83.7	-31.1	171.4	-143.7	-96.6	0	0	0	110.9	S28 D29 S34 L35	S28-Y31 WeakPolarHBondContact O-CB 3.35Å; S28-Y31 PolarHBondContact O-N 3.29Å; D29-Y31 VanDerWaalsContact C-N 3.3Å; Y31-S34 PolarHBondContact O-N 3.15Å; Y31-L35 HydrophobicContact CD1-CD1 3.95Å; Y31-L35 HydrophobicContact CE1-CD1 4.42Å; Y31-L35 PolarHBondContact O-N 2.82Å
32	L	46.8	Very low	46.1	Very low	94 Å²	94	113.8 Å²	113.8	49%	0.492	62%	0.618	S	S	.	*	H	α-helix	trans	-70.3	-35.4	173.8	-151	75.6	0	0	0	112.1	S28 D29 S34 L35 L36	S28-L32 PolarHBondContact O-N 2.82Å; D29-L32 PolarHBondContact O-N 2.84Å; L32-S34 VanDerWaalsContact C-N 3.32Å; L32-S34 PolarHBondContact O-N 2.97Å; L32-L35 CarbonylContact O-C 3.56Å; L32-L35 PolarHBondContact O-N 3.47Å; L32-L36 HydrophobicContact CD2-CD1 4.49Å; L32-L36 HydrophobicContact CG-CD1 4.27Å; L32-L36 WeakPolarHBondContact O-CB 3.22Å; L32-L36 WeakPolarHBondContact O-CD1 3.34Å; L32-L36 VanDerWaalsContact O-CG 3.28Å; L32-L36 WeakPolarHBondContact O-CG 3.25Å; L32-L36 PolarHBondContact O-N 3.42Å
33	Q	48.1	Very low	44.8	Very low	121 Å²	121	117.6 Å²	117.6	57%	0.565	64%	0.636	S	S	*	*	H	α-helix	trans	-69.3	-24.9	170.7	-81.1	179.8	-19.2	0	0	113.8	D29 N37	D29-Q33 PolarHBondContact O-N 2.75Å; Q33-N37 WeakPolarHBondContact O-CB 3.37Å; Q33-N37 PolarHBondContact O-N 2.94Å
34	S	44.6	Very low	44.8	Very low	81 Å²	81	121.2 Å²	121.2	57%	0.566	65%	0.651	S	S	*	*	H	α-helix	trans	-77	-28.1	169.1	-178.4	0	0	0	0	112.6	Y31 L32	Y31-S34 PolarHBondContact O-N 3.15Å; L32-S34 VanDerWaalsContact C-N 3.32Å; L32-S34 PolarHBondContact O-N 2.97Å
35	L	45.6	Very low	46	Very low	94 Å²	94	114 Å²	114	49%	0.492	63%	0.627	S	S	.	*	H	α-helix	trans	-77.5	-29.6	172.3	-87.3	149.4	0	0	0	112.1	Y31 L32	Y31-L35 HydrophobicContact CD1-CD1 3.95Å; Y31-L35 HydrophobicContact CE1-CD1 4.42Å; Y31-L35 PolarHBondContact O-N 2.82Å; L32-L35 CarbonylContact O-C 3.56Å; L32-L35 PolarHBondContact O-N 3.47Å
36	L	44.5	Very low	47.6	Very low	106 Å²	106	110.7 Å²	110.7	56%	0.555	61%	0.609	S	S	*	*	H	α-helix	trans	-82.6	-21.3	177.7	-73.9	161.8	0	0	0	113.7	L32	L32-L36 HydrophobicContact CD2-CD1 4.49Å; L32-L36 HydrophobicContact CG-CD1 4.27Å; L32-L36 WeakPolarHBondContact O-CB 3.22Å; L32-L36 WeakPolarHBondContact O-CD1 3.34Å; L32-L36 VanDerWaalsContact O-CG 3.28Å; L32-L36 WeakPolarHBondContact O-CG 3.25Å; L32-L36 PolarHBondContact O-N 3.42Å
37	N	36.4	Very low	49.1	Very low	149 Å²	149	107.5 Å²	107.5	80%	0.797	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91	9	176.7	-84.9	-12.6	0	0	0	114.9	Q33	Q33-N37 WeakPolarHBondContact O-CB 3.37Å; Q33-N37 PolarHBondContact O-N 2.94Å
38	S	32.7	Very low	51	Low	77 Å²	77	102.3 Å²	102.3	54%	0.538	56%	0.559	S	S	.	*	T	Hydrogen-bonded Turn	trans	-106.2	35	167.5	-170.1	0	0	0	0	112.1	A40	S38-A40 PolarHBondContact O-N 3.34Å; S38-A40 VanDerWaalsContact O-N 3.07Å
39	T	31	Very low	53.2	Low	119 Å²	119	102.4 Å²	102.4	73%	0.73	56%	0.556	S	S	*	*			trans	-79.8	70.9	159.6	54.8	0	0	0	0	108.9
40	A	29.4	Very low	55.3	Low	74 Å²	74	99.1 Å²	99.1	61%	0.612	54%	0.539	S	S	*	.			trans	-64	135	150.5	0	0	0	0	0	106.1	S38	S38-A40 PolarHBondContact O-N 3.34Å; S38-A40 VanDerWaalsContact O-N 3.07Å
41	P	29.4	Very low	57.4	Low	105 Å²	105	94.1 Å²	94.1	68%	0.682	53%	0.525	S	S	*	.			trans	-52.2	144.2	173.7	23.9	-32.1	0	0	0	108.2	T43	P41-T43 PolarHBondContact O-N 3.31Å
42	P	35.6	Very low	59.4	Low	127 Å²	127	87.4 Å²	87.4	83%	0.825	51%	0.505	S	S	*	.			trans	-58.1	104	-176.9	24.9	-31.8	0	0	0	107.2	H44	P42-H44 PolarHBondContact O-N 3.47Å
43	T	45.6	Very low	61.3	Low	125 Å²	125	86.9 Å²	86.9	77%	0.767	50%	0.503	S	S	*	.			trans	-62.5	109	168.5	47.4	0	0	0	0	104.4	P41 M45	P41-T43 PolarHBondContact O-N 3.31Å; T43-M45 PolarHBondContact O-N 2.92Å
44	H	61.8	Low	63.4	Low	164 Å²	164	81.2 Å²	81.2	76%	0.759	48%	0.477	S	S	*	.			trans	-44.6	113.2	-177.5	-139	-83	0	0	0	108.7	P42 R46	P42-H44 PolarHBondContact O-N 3.47Å; H44-R46 PolarHBondContact O-N 3.2Å
45	M	80.9	Confident	65.6	Low	60 Å²	60	78 Å²	78	30%	0.296	45%	0.453	S	S	.	.			trans	-60.7	140.4	178	-78.4	-165.9	-119.4	0	0	108.4	T43 I119 Q123	T43-M45 PolarHBondContact O-N 2.92Å; M45-I119 HydrophobicContact CE-CG2 3.97Å; M45-I119 HydrophobicContact SD-CG2 4.08Å; M45-Q123 HydrophobicContact CE-CG 4.33Å; M45-Q123 HydrophobicContact SD-CG 4.13Å; M45-Q123 PolarHBondContact SD-NE2 3.04Å
46	R	87.3	Confident	67.9	Low	102 Å²	102	73.6 Å²	73.6	39%	0.385	43%	0.43	S	S	.	.			trans	-68.3	149.5	179.3	-58.3	-169.6	-166.3	155.5	15.3	109.3	H44 P400 W401 D404	H44-R46 PolarHBondContact O-N 3.2Å; R46-P400 HydrophobicContact CB-CB 4.04Å; R46-P400 HydrophobicContact CB-CG 4.02Å; R46-P400 PolarHBondContact NH1-O 3.37Å; R46-W401 HydrophobicContact CB-CZ2 4.06Å; R46-W401 WeakPolarHBondContact O-CH2 3.48Å; R46-W401 WeakPolarHBondContact O-CZ2 3.37Å; R46-D404 IonicContact CZ-OD2 3.55Å; R46-D404 VanDerWaalsContact CZ-OD2 3.3Å; R46-D404 VanDerWaalsContact NH1-CG 3.32Å; R46-D404 IonicContact NH1-OD1 2.78Å; R46-D404 PolarHBondContact NH1-OD1 3.13Å; R46-D404 IonicContact NH1-OD2 2.75Å; R46-D404 PolarHBondContact NH1-OD2 2.82Å; R46-D404 IonicContact NH2-OD1 3.88Å; R46-D404 IonicContact NH2-OD2 3.27Å; R46-D404 PolarHBondContact NH2-OD2 3.01Å
47	V	90.3	Very high	70.3	Confident	42 Å²	42	68.5 Å²	68.5	26%	0.255	40%	0.403	S	S	.	.			trans	-133.5	137.9	180	-167.7	0	0	0	0	107.7	S109 I110 R111	V47-S109 WeakPolarHBondContact CG1-OG 3.08Å; V47-I110 WeakPolarHBondContact CG1-O 3.45Å; V47-R111 HydrophobicContact CG1-CG 3.87Å; V47-R111 HydrophobicContact CG2-CG 4.32Å
48	A	92.6	Very high	73.2	Confident	0 Å²	0	61.5 Å²	61.5	0%	0	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	115.9	173.7	0	0	0	0	0	108.6	T84 M88 I110 P400 W401	A48-T84 HydrophobicContact CB-CG2 4.46Å; A48-M88 HydrophobicContact CB-CE 3.32Å; A48-I110 HydrophobicContact CB-CB 4.26Å; A48-I110 PolarHBondContact N-O 2.84Å; A48-I110 PolarHBondContact O-N 3.23Å; A48-P400 HydrophobicContact CB-CG 4.04Å; A48-W401 HydrophobicContact CB-CE3 4.36Å; A48-W401 HydrophobicContact CB-CH2 4.41Å; A48-W401 HydrophobicContact CB-CZ3 3.64Å
49	T	91.5	Very high	76.3	Confident	71 Å²	71	57.8 Å²	57.8	44%	0.436	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	137	-169.5	-54.4	0	0	0	0	111.2	I108	T49-I108 CarbonylContact C-O 3.59Å; T49-I108 VanDerWaalsContact CA-O 3.25Å; T49-I108 WeakPolarHBondContact CA-O 3.47Å
50	I	92.7	Very high	79.4	Confident	22 Å²	22	52.2 Å²	52.2	11%	0.113	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	120.4	160.1	-53.7	172.7	0	0	0	106.4	Q55 M88 V91 G107 I108	I50-Q55 PolarHBondContact O-NE2 3.02Å; I50-Q55 VanDerWaalsContact O-NE2 3.11Å; I50-M88 HydrophobicContact CD1-CB 4.42Å; I50-M88 HydrophobicContact CD1-CG 4.16Å; I50-V91 HydrophobicContact CD1-CB 4.22Å; I50-V91 HydrophobicContact CD1-CG1 4.13Å; I50-G107 CarbonylContact O-C 3.51Å; I50-G107 WeakPolarHBondContact O-CA 3.34Å; I50-I108 HydrophobicContact CB-CG2 3.96Å; I50-I108 HydrophobicContact CD1-CG2 3.6Å; I50-I108 HydrophobicContact CG1-CG2 3.71Å; I50-I108 PolarHBondContact N-O 2.78Å; I50-I108 PolarHBondContact O-N 3.09Å
51	P	91	Very high	82.5	Confident	79 Å²	79	48.7 Å²	48.7	51%	0.513	28%	0.276	S	S	.	.			trans	-65.7	154.5	176.1	29.4	-34.2	0	0	0	110.6
52	G	88.7	Confident	85.6	Confident	23 Å²	23	43.7 Å²	43.7	24%	0.237	24%	0.244	C	C	.	.			trans	177.4	159.5	-177.6	0	0	0	0	0	110.6	L54 Q55 Q105	G52-L54 VanDerWaalsContact C-N 3.3Å; G52-L54 PolarHBondContact O-N 3.12Å; G52-Q55 VanDerWaalsContact N-NE2 3.14Å; G52-Q55 PolarHBondContact O-NE2 3.43Å; G52-Q105 CarbonylContact C-O 3.6Å; G52-Q105 WeakPolarHBondContact CA-O 3.43Å
53	D	88.2	Confident	88.3	Confident	83 Å²	83	39 Å²	39	44%	0.444	21%	0.211	S	C	.	.	S	Bend	trans	-65.2	-34.5	-176.2	-54.9	-52.6	0	0	0	112.3	V104 Q105 V472	D53-V104 HydrophobicContact CB-CG1 4.19Å; D53-Q105 PolarHBondContact N-O 3.04Å; D53-Q105 PolarHBondContact OD2-N 3.24Å; D53-V472 HydrophobicContact CB-CG2 3.66Å
54	L	90.5	Very high	90.3	Very high	2 Å²	2	37.4 Å²	37.4	1%	0.01	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	128.9	174.5	-58.1	178	0	0	0	108.8	G52 V104 Q105 L106 G107 V166 L456 V472 M476 V479	G52-L54 VanDerWaalsContact C-N 3.3Å; G52-L54 PolarHBondContact O-N 3.12Å; L54-V104 HydrophobicContact CD1-CG1 4.07Å; L54-V104 HydrophobicContact CG-CG1 4.22Å; L54-Q105 PolarHBondContact N-O 3.02Å; L54-L106 HydrophobicContact CB-CD1 4.27Å; L54-G107 PolarHBondContact O-N 3.21Å; L54-V166 HydrophobicContact CB-CG1 4.16Å; L54-V166 HydrophobicContact CD2-CG1 4.07Å; L54-L456 HydrophobicContact CD1-CD1 4.28Å; L54-L456 HydrophobicContact CD1-CD2 4.19Å; L54-V472 HydrophobicContact CD2-CG1 4.4Å; L54-V472 HydrophobicContact CG-CG2 4.42Å; L54-M476 HydrophobicContact CD1-CE 4.02Å; L54-V479 HydrophobicContact CD2-CG2 3.97Å
55	Q	91.3	Very high	91.3	Very high	15 Å²	15	35.2 Å²	35.2	7%	0.07	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	132.1	-173.8	-73.7	-74.2	-20.6	0	0	111.9	I50 G52 G107 I108 N164 I165 V166	I50-Q55 PolarHBondContact O-NE2 3.02Å; I50-Q55 VanDerWaalsContact O-NE2 3.11Å; G52-Q55 VanDerWaalsContact N-NE2 3.14Å; G52-Q55 PolarHBondContact O-NE2 3.43Å; Q55-G107 VanDerWaalsContact OE1-C 3.3Å; Q55-I108 VanDerWaalsContact OE1-N 3.14Å; Q55-N164 PolarHBondContact N-O 3.33Å; Q55-I165 HydrophobicContact CB-CD1 3.82Å; Q55-I165 CarbonylContact O-C 3.57Å; Q55-I165 VanDerWaalsContact O-CA 3.27Å; Q55-I165 WeakPolarHBondContact O-CA 3.1Å; Q55-V166 PolarHBondContact O-N 3.45Å
56	I	94.8	Very high	91.3	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	122.3	169.4	-61.6	179	0	0	0	109.2	V58 L106 G107 I108 S109 V166 I169 V452	I56-V58 HydrophobicContact CG2-CG2 4.09Å; I56-L106 HydrophobicContact CD1-CD1 3.9Å; I56-L106 HydrophobicContact CD1-CD2 3.77Å; I56-L106 HydrophobicContact CD1-CG 4.06Å; I56-L106 HydrophobicContact CG1-CD1 3.99Å; I56-L106 HydrophobicContact CG1-CG 4.45Å; I56-G107 PolarHBondContact N-O 3.49Å; I56-I108 HydrophobicContact CB-CG1 4.39Å; I56-I108 CarbonylContact O-C 3.59Å; I56-I108 WeakPolarHBondContact O-CA 3.33Å; I56-S109 PolarHBondContact O-N 3.19Å; I56-V166 HydrophobicContact CG1-CG2 4.35Å; I56-I169 HydrophobicContact CG2-CD1 3.69Å; I56-I169 HydrophobicContact CG2-CG1 3.88Å; I56-V452 HydrophobicContact CD1-CB 3.99Å; I56-V452 HydrophobicContact CD1-CG1 3.63Å; I56-V452 HydrophobicContact CG1-CG1 4.08Å
57	G	95.1	Very high	90.4	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	142	170.6	0	0	0	0	0	110.8	S109 A167 V168 I169	G57-S109 CarbonylContact C-O 3.53Å; G57-A167 PolarHBondContact N-O 3.28Å; G57-V168 CarbonylContact O-C 3.56Å; G57-V168 VanDerWaalsContact O-CA 3.25Å; G57-V168 WeakPolarHBondContact O-CA 3.25Å; G57-I169 PolarHBondContact O-N 3.4Å
58	V	96.9	Very high	89.4	Confident	1 Å²	1	36 Å²	36	1%	0.006	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	134.5	179.5	-173.9	0	0	0	0	111.2	I56 F60 I108 S109 I110 R111 I169	I56-V58 HydrophobicContact CG2-CG2 4.09Å; V58-F60 HydrophobicContact CG1-CD1 3.84Å; V58-F60 HydrophobicContact CG1-CD2 3.82Å; V58-F60 HydrophobicContact CG1-CE1 3.47Å; V58-F60 VanDerWaalsContact CG1-CE1 3.47Å; V58-F60 HydrophobicContact CG1-CE2 3.43Å; V58-F60 VanDerWaalsContact CG1-CE2 3.43Å; V58-F60 HydrophobicContact CG1-CG 4Å; V58-F60 HydrophobicContact CG1-CZ 3.25Å; V58-I108 HydrophobicContact CG2-CD1 3.62Å; V58-I108 HydrophobicContact CG2-CG1 3.51Å; V58-S109 PolarHBondContact N-O 3.27Å; V58-I110 HydrophobicContact CB-CB 4.45Å; V58-I110 HydrophobicContact CB-CG1 4.06Å; V58-I110 HydrophobicContact CB-CG2 4.5Å; V58-I110 HydrophobicContact CG2-CG1 4.36Å; V58-R111 PolarHBondContact O-N 2.77Å; V58-I169 WeakPolarHBondContact CA-O 3.27Å; V58-I169 HydrophobicContact CG1-CB 4.43Å; V58-I169 HydrophobicContact CG2-CB 4.22Å
59	L	97.2	Very high	88.6	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	114	175	-64	174.3	0	0	0	109.9	R111 D113 Q123 L127 V168 I169 P171 V180 Y194	L59-R111 HydrophobicContact CD2-CB 4.12Å; L59-D113 HydrophobicContact CB-CB 4.33Å; L59-Q123 HydrophobicContact CD2-CB 3.91Å; L59-L127 HydrophobicContact CD2-CD1 4.22Å; L59-L127 HydrophobicContact CG-CD1 4.49Å; L59-V168 HydrophobicContact CD1-CG1 4.42Å; L59-I169 PolarHBondContact N-O 3.39Å; L59-P171 HydrophobicContact CB-CB 4.12Å; L59-V180 HydrophobicContact CD1-CG1 4.05Å; L59-V180 HydrophobicContact CD1-CG2 3.87Å; L59-Y194 PolarHBondContact O-OH 3.35Å
60	F	96.8	Very high	87.5	Confident	1 Å²	1	41.5 Å²	41.5	0%	0.004	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	148	175	-67.2	-35	0	0	0	111.5	V58 I62 R83 A87 I110 R111 D112 D113 Y194 V445	V58-F60 HydrophobicContact CG1-CD1 3.84Å; V58-F60 HydrophobicContact CG1-CD2 3.82Å; V58-F60 HydrophobicContact CG1-CE1 3.47Å; V58-F60 VanDerWaalsContact CG1-CE1 3.47Å; V58-F60 HydrophobicContact CG1-CE2 3.43Å; V58-F60 VanDerWaalsContact CG1-CE2 3.43Å; V58-F60 HydrophobicContact CG1-CG 4Å; V58-F60 HydrophobicContact CG1-CZ 3.25Å; F60-I62 VanDerWaalsContact C-N 3.33Å; F60-I62 HydrophobicContact CB-CG1 4.28Å; F60-I62 PolarHBondContact O-N 3.48Å; F60-R83 HydrophobicContact CD1-CB 4.1Å; F60-R83 HydrophobicContact CD2-CB 3.9Å; F60-R83 HydrophobicContact CE1-CB 4.07Å; F60-R83 VanDerWaalsContact CE2-C 3.49Å; F60-R83 HydrophobicContact CE2-CB 3.87Å; F60-R83 VanDerWaalsContact CE2-O 3.27Å; F60-R83 WeakPolarHBondContact CE2-O 3.42Å; F60-R83 HydrophobicContact CG-CB 4.03Å; F60-R83 HydrophobicContact CZ-CB 3.96Å; F60-A87 HydrophobicContact CE2-CB 3.77Å; F60-A87 HydrophobicContact CZ-CB 3.94Å; F60-I110 HydrophobicContact CD2-CG2 3.58Å; F60-I110 HydrophobicContact CE2-CD1 4.38Å; F60-I110 HydrophobicContact CE2-CG2 4.16Å; F60-I110 HydrophobicContact CG-CG2 4.42Å; F60-R111 PolarHBondContact N-O 2.76Å; F60-D112 WeakPolarHBondContact O-CA 3.16Å; F60-D113 PolarHBondContact O-N 2.02Å; F60-Y194 AromaticContact CD1-CE1 3.81Å; F60-Y194 HydrophobicContact CD1-CE1 3.81Å; F60-Y194 AromaticContact CD1-CZ 3.84Å; F60-Y194 HydrophobicContact CE1-CD1 4.26Å; F60-Y194 AromaticContact CE1-CE1 3.59Å; F60-Y194 HydrophobicContact CE1-CE1 3.59Å; F60-Y194 AromaticContact CE1-CZ 3.98Å; F60-V445 HydrophobicContact CE1-CG1 4.26Å; F60-V445 HydrophobicContact CE1-CG2 4.37Å; F60-V445 HydrophobicContact CZ-CG1 3.69Å
61	P	93.7	Very high	87.1	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	27%	0.273	C	S	.	.			trans	-82.8	79.2	174.5	35.2	-39.1	0	0	0	110.8	H63 W76 G80 D113 W115	P61-H63 VanDerWaalsContact C-N 3.27Å; P61-H63 PolarHBondContact O-N 2.78Å; P61-W76 HydrophobicContact CB-CE3 4.4Å; P61-G80 WeakPolarHBondContact O-CA 3.45Å; P61-D113 WeakPolarHBondContact CA-OD1 3.19Å; P61-D113 WeakPolarHBondContact CB-OD1 3.49Å; P61-W115 HydrophobicContact CB-CB 4.37Å; P61-W115 HydrophobicContact CB-CE3 3.53Å; P61-W115 HydrophobicContact CB-CZ3 4.24Å; P61-W115 HydrophobicContact CG-CE3 3.58Å; P61-W115 HydrophobicContact CG-CZ3 3.75Å
62	I	95	Very high	86.9	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	26%	0.263	C	S	.	.			trans	-68.4	-36.6	-177.8	-52.6	-177.1	0	0	0	109.8	F60 I75 W76 I81 D112 W401	F60-I62 VanDerWaalsContact C-N 3.33Å; F60-I62 HydrophobicContact CB-CG1 4.28Å; F60-I62 PolarHBondContact O-N 3.48Å; I62-I75 CarbonylContact O-C 3.53Å; I62-I75 WeakPolarHBondContact O-CA 3.46Å; I62-W76 PolarHBondContact O-N 2.81Å; I62-I81 HydrophobicContact CG2-CD1 4.23Å; I62-D112 HydrophobicContact CB-CB 4.19Å; I62-D112 WeakPolarHBondContact CB-OD1 3.46Å; I62-D112 HydrophobicContact CD1-CB 4.06Å; I62-D112 HydrophobicContact CG1-CB 4.15Å; I62-D112 PolarHBondContact N-OD1 3.27Å; I62-W401 HydrophobicContact CD1-CD2 3.56Å; I62-W401 HydrophobicContact CD1-CE3 3.3Å; I62-W401 HydrophobicContact CD1-CG 4.46Å; I62-W401 HydrophobicContact CD1-CH2 3.26Å; I62-W401 HydrophobicContact CD1-CZ2 3.5Å; I62-W401 VanDerWaalsContact CD1-CZ2 3.5Å; I62-W401 HydrophobicContact CD1-CZ3 3.13Å; I62-W401 HydrophobicContact CG2-CB 4.02Å; I62-W401 HydrophobicContact CG2-CD2 3.91Å; I62-W401 HydrophobicContact CG2-CE3 4.4Å; I62-W401 HydrophobicContact CG2-CG 3.71Å
63	H	92.5	Very high	86.9	Confident	30 Å²	30	47.3 Å²	47.3	14%	0.139	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	155.7	171.7	-59.8	92.4	0	0	0	112.5	P61 C72 G73 K74 I75 D112 C114 W401	P61-H63 VanDerWaalsContact C-N 3.27Å; P61-H63 PolarHBondContact O-N 2.78Å; H63-C72 HydrophobicContact CB-CB 3.7Å; H63-G73 PolarHBondContact CD2-O 3.37Å; H63-K74 CarbonylContact C-O 3.22Å; H63-K74 WeakPolarHBondContact CA-O 3.27Å; H63-I75 WeakPolarHBondContact NE2-CG1 3.14Å; H63-D112 IonicContact CE1-OD2 2.73Å; H63-D112 IonicContact CG-OD2 2.99Å; H63-D112 PolarHBondContact N-OD1 3.41Å; H63-D112 IonicContact ND1-OD2 2.86Å; H63-D112 PolarHBondContact ND1-OD2 3.31Å; H63-C114 WeakPolarHBondContact O-CA 3.08Å; H63-W401 AromaticContact CE1-CD1 3.73Å; H63-W401 AromaticContact CE1-NE1 3.89Å
64	R	87	Confident	87	Confident	91 Å²	91	50.2 Å²	50.2	34%	0.343	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	148.1	173.4	-67.1	-179.2	175.2	-100.4	-1.7	111.5	G73 K74 W76	R64-G73 VanDerWaalsContact O-CA 3.23Å; R64-G73 WeakPolarHBondContact O-CA 3.45Å; R64-G73 PolarHBondContact O-N 3.39Å; R64-K74 PolarHBondContact N-O 2.84Å; R64-W76 HydrophobicContact CG-CB 4.19Å; R64-W76 HydrophobicContact CG-CD2 4.15Å; R64-W76 HydrophobicContact CG-CE3 4.08Å; R64-W76 HydrophobicContact CG-CG 4.24Å
65	K	83.1	Confident	87	Confident	117 Å²	117	51 Å²	51	51%	0.509	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.3	139	167.9	-179.5	175.6	-177.2	176	0	111.1	C114 W115 T116	K65-C114 PolarHBondContact N-O 2.86Å; K65-W115 HydrophobicContact CB-CB 4.33Å; K65-T116 HydrophobicContact CB-CG2 4.25Å; K65-T116 HydrophobicContact CD-CG2 3.9Å; K65-T116 HydrophobicContact CG-CG2 3.74Å
66	I	80.8	Confident	87	Confident	69 Å²	69	51.4 Å²	51.4	35%	0.354	27%	0.274	S	S	.	.			trans	-106.4	129.1	168.4	-62.7	167	0	0	0	108.5	G68 T69	I66-G68 PolarHBondContact O-N 2.97Å; I66-T69 VanDerWaalsContact CB-OG1 3.23Å; I66-T69 WeakPolarHBondContact CB-OG1 3.45Å; I66-T69 HydrophobicContact CG2-CG2 3.8Å; I66-T69 VanDerWaalsContact CG2-OG1 3.24Å; I66-T69 WeakPolarHBondContact CG2-OG1 3.41Å
67	A	69.6	Low	86.8	Confident	63 Å²	63	53.1 Å²	53.1	52%	0.521	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.7	132.8	176.5	0	0	0	0	0	111.4	T69 L274	A67-T69 PolarHBondContact O-N 2.69Å; A67-L274 HydrophobicContact CB-CD2 3.88Å
68	G	68.9	Low	86.5	Confident	89 Å²	89	54.8 Å²	54.8	92%	0.918	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.1	3.3	175.7	0	0	0	0	0	115.5	I66	I66-G68 PolarHBondContact O-N 2.97Å
69	T	74.6	Confident	86.1	Confident	67 Å²	67	55.5 Å²	55.5	41%	0.411	29%	0.292	S	S	.	.			trans	-127.2	149.3	176.2	77.8	0	0	0	0	110.9	I66 A67 R71	I66-T69 VanDerWaalsContact CB-OG1 3.23Å; I66-T69 WeakPolarHBondContact CB-OG1 3.45Å; I66-T69 HydrophobicContact CG2-CG2 3.8Å; I66-T69 VanDerWaalsContact CG2-OG1 3.24Å; I66-T69 WeakPolarHBondContact CG2-OG1 3.41Å; A67-T69 PolarHBondContact O-N 2.69Å; T69-R71 PolarHBondContact O-N 3.49Å
70	E	70.1	Confident	85.9	Confident	119 Å²	119	55.5 Å²	55.5	56%	0.556	29%	0.292	S	S	*	.	S	Bend	trans	-86.6	9.2	175.4	-52.2	-171.9	141.6	0	0	112.6	R118	E70-R118 IonicContact OE1-CZ 3.89Å; E70-R118 IonicContact OE1-NH1 3.92Å; E70-R118 PolarHBondContact OE1-NH1 3.12Å; E70-R118 IonicContact OE2-CZ 3.77Å; E70-R118 IonicContact OE2-NH1 3.28Å; E70-R118 PolarHBondContact OE2-NH1 2.96Å; E70-R118 IonicContact OE2-NH2 2.91Å
71	R	82.3	Confident	85.8	Confident	186 Å²	186	55.4 Å²	55.4	70%	0.702	29%	0.292	S	S	*	.	S	Bend	trans	-98.5	146.4	-177.9	-63.7	-175.2	-178.5	179.5	0.9	110.8	T69	T69-R71 PolarHBondContact O-N 3.49Å
72	C	88	Confident	85.9	Confident	43 Å²	43	55.4 Å²	55.4	29%	0.291	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	141.2	167.9	-58.4	0	0	0	0	110.6	H63 C114 I119	H63-C72 HydrophobicContact CB-CB 3.7Å; C72-C114 HydrophobicContact CB-CB 3.97Å; C72-C114 WeakPolarHBondContact CB-SG 3.39Å; C72-C114 WeakPolarHBondContact SG-CB 3.47Å; C72-C114 CovalentContact SG-SG 2.02Å; C72-C114 PolarHBondContact SG-SG 2.85Å; C72-I119 WeakPolarHBondContact SG-CD1 3.35Å
73	G	88.6	Confident	85.9	Confident	18 Å²	18	55.4 Å²	55.4	19%	0.186	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	-143.1	-179.6	0	0	0	0	0	114	H63 R64	H63-G73 PolarHBondContact CD2-O 3.37Å; R64-G73 VanDerWaalsContact O-CA 3.23Å; R64-G73 WeakPolarHBondContact O-CA 3.45Å; R64-G73 PolarHBondContact O-N 3.39Å
74	K	89.8	Confident	86.1	Confident	144 Å²	144	54 Å²	54	63%	0.626	29%	0.285	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.8	152.3	179.6	-74.2	-174.3	169.6	-160.2	0	112.3	H63 R64 E408	H63-K74 CarbonylContact C-O 3.22Å; H63-K74 WeakPolarHBondContact CA-O 3.27Å; R64-K74 PolarHBondContact N-O 2.84Å; K74-E408 WeakPolarHBondContact CB-OE1 3.41Å; K74-E408 VanDerWaalsContact CD-OE1 3.24Å; K74-E408 WeakPolarHBondContact CD-OE1 3.42Å; K74-E408 WeakPolarHBondContact CG-OE1 3.48Å
75	I	91.7	Very high	86.6	Confident	19 Å²	19	49.7 Å²	49.7	10%	0.097	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.2	137	177.7	-70	172.6	0	0	0	110.4	I62 H63 I81 D404 F405 E408	I62-I75 CarbonylContact O-C 3.53Å; I62-I75 WeakPolarHBondContact O-CA 3.46Å; H63-I75 WeakPolarHBondContact NE2-CG1 3.14Å; I75-I81 HydrophobicContact CG2-CD1 3.92Å; I75-I81 HydrophobicContact CG2-CG1 3.63Å; I75-D404 VanDerWaalsContact CD1-C 3.46Å; I75-D404 HydrophobicContact CD1-CB 3.5Å; I75-D404 VanDerWaalsContact CD1-CB 3.5Å; I75-F405 HydrophobicContact CD1-CB 4.2Å; I75-F405 VanDerWaalsContact CD1-N 3.26Å; I75-F405 HydrophobicContact CG2-CB 4.17Å; I75-F405 HydrophobicContact CG2-CD2 4.38Å; I75-E408 PolarHBondContact N-OE2 2.73Å
76	W	90.1	Very high	87.2	Confident	22 Å²	22	44.3 Å²	44.3	8%	0.083	25%	0.246	C	C	.	.			trans	-102	97.8	176.8	-157.9	-15.3	0	0	0	110.5	P61 I62 R64 Q78 Y79 G80 I81 W115	P61-W76 HydrophobicContact CB-CE3 4.4Å; I62-W76 PolarHBondContact O-N 2.81Å; R64-W76 HydrophobicContact CG-CB 4.19Å; R64-W76 HydrophobicContact CG-CD2 4.15Å; R64-W76 HydrophobicContact CG-CE3 4.08Å; R64-W76 HydrophobicContact CG-CG 4.24Å; W76-Q78 PolarHBondContact O-N 3.04Å; W76-Y79 HydrophobicContact CD2-CD2 4.32Å; W76-Y79 HydrophobicContact CD2-CG 4.25Å; W76-Y79 AromaticContact CE2-CD2 3.85Å; W76-Y79 AromaticContact CE2-CG 3.86Å; W76-Y79 HydrophobicContact CE3-CD2 4.32Å; W76-Y79 AromaticContact CH2-CD2 3.44Å; W76-Y79 HydrophobicContact CH2-CD2 3.44Å; W76-Y79 VanDerWaalsContact CH2-CD2 3.44Å; W76-Y79 AromaticContact CH2-CE2 3.82Å; W76-Y79 HydrophobicContact CH2-CE2 3.82Å; W76-Y79 HydrophobicContact CH2-CG 4.27Å; W76-Y79 AromaticContact CZ2-CD2 3.4Å; W76-Y79 HydrophobicContact CZ2-CD2 3.4Å; W76-Y79 VanDerWaalsContact CZ2-CD2 3.4Å; W76-Y79 AromaticContact CZ2-CE2 3.72Å; W76-Y79 HydrophobicContact CZ2-CE2 3.72Å; W76-Y79 AromaticContact CZ2-CG 3.89Å; W76-Y79 HydrophobicContact CZ2-CG 3.89Å; W76-Y79 AromaticContact CZ3-CD2 3.91Å; W76-Y79 HydrophobicContact CZ3-CD2 3.91Å; W76-G80 WeakPolarHBondContact O-CA 3.17Å; W76-G80 PolarHBondContact O-N 3.46Å; W76-I81 PolarHBondContact O-N 2.77Å; W76-W115 HydrophobicContact CZ3-CD2 4.34Å; W76-W115 AromaticContact CZ3-CE3 3.9Å; W76-W115 HydrophobicContact CZ3-CE3 3.9Å; W76-W115 HydrophobicContact CZ3-CZ3 4.28Å
77	E	91.5	Very high	88	Confident	36 Å²	36	41 Å²	41	17%	0.168	23%	0.229	C	C	.	.	I	π-helix	trans	-54.1	-50.7	-177.7	-179.6	172.9	-174.6	0	0	112.9	I81 Q82 Y388 F405 K409	E77-I81 PolarHBondContact O-N 2.86Å; E77-Q82 WeakPolarHBondContact O-CG 3.38Å; E77-Q82 PolarHBondContact O-N 3.29Å; E77-Y388 WeakPolarHBondContact CG-OH 3.44Å; E77-Y388 PolarHBondContact OE1-OH 3.32Å; E77-F405 HydrophobicContact CB-CD2 4.42Å; E77-F405 HydrophobicContact CB-CE2 3.86Å; E77-F405 VanDerWaalsContact CD-CE2 3.47Å; E77-F405 HydrophobicContact CG-CD2 4.46Å; E77-F405 HydrophobicContact CG-CE2 3.56Å; E77-F405 HydrophobicContact CG-CZ 4.02Å; E77-K409 VanDerWaalsContact CD-NZ 3.3Å; E77-K409 IonicContact OE1-NZ 3.49Å; E77-K409 PolarHBondContact OE1-NZ 3.14Å; E77-K409 IonicContact OE2-NZ 2.91Å; E77-K409 PolarHBondContact OE2-NZ 2.74Å; E77-K409 VanDerWaalsContact OE2-NZ 3.13Å
78	Q	88	Confident	89.2	Confident	36 Å²	36	38 Å²	38	17%	0.168	20%	0.204	C	C	.	.	I	π-helix	trans	-68.9	-51.7	-174.5	-63.7	-175.8	-64.9	0	0	113	W76 K437 P438 D439	W76-Q78 PolarHBondContact O-N 3.04Å; Q78-K437 WeakPolarHBondContact CG-O 3.08Å; Q78-K437 PolarHBondContact NE2-O 2.8Å; Q78-P438 PolarHBondContact NE2-O 3.33Å; Q78-D439 HydrophobicContact CB-CB 4.27Å; Q78-D439 WeakPolarHBondContact O-CB 3.39Å
79	Y	89.3	Confident	90.5	Very high	15 Å²	15	36.2 Å²	36.2	6%	0.059	17%	0.172	C	C	.	.	I	π-helix	trans	-93	-14	-171.8	-71.7	9	0	0	0	113.3	W76 R83 W115 D439	W76-Y79 HydrophobicContact CD2-CD2 4.32Å; W76-Y79 HydrophobicContact CD2-CG 4.25Å; W76-Y79 AromaticContact CE2-CD2 3.85Å; W76-Y79 AromaticContact CE2-CG 3.86Å; W76-Y79 HydrophobicContact CE3-CD2 4.32Å; W76-Y79 AromaticContact CH2-CD2 3.44Å; W76-Y79 HydrophobicContact CH2-CD2 3.44Å; W76-Y79 VanDerWaalsContact CH2-CD2 3.44Å; W76-Y79 AromaticContact CH2-CE2 3.82Å; W76-Y79 HydrophobicContact CH2-CE2 3.82Å; W76-Y79 HydrophobicContact CH2-CG 4.27Å; W76-Y79 AromaticContact CZ2-CD2 3.4Å; W76-Y79 HydrophobicContact CZ2-CD2 3.4Å; W76-Y79 VanDerWaalsContact CZ2-CD2 3.4Å; W76-Y79 AromaticContact CZ2-CE2 3.72Å; W76-Y79 HydrophobicContact CZ2-CE2 3.72Å; W76-Y79 AromaticContact CZ2-CG 3.89Å; W76-Y79 HydrophobicContact CZ2-CG 3.89Å; W76-Y79 AromaticContact CZ3-CD2 3.91Å; W76-Y79 HydrophobicContact CZ3-CD2 3.91Å; Y79-R83 WeakPolarHBondContact O-CD 3.43Å; Y79-R83 WeakPolarHBondContact O-CG 3.26Å; Y79-W115 HydrophobicContact CD2-CH2 4.37Å; Y79-W115 AromaticContact CD2-CZ3 3.96Å; Y79-W115 HydrophobicContact CD2-CZ3 3.96Å; Y79-W115 HydrophobicContact CE2-CH2 4.43Å; Y79-W115 HydrophobicContact CE2-CZ3 4.46Å; Y79-D439 HydrophobicContact CD1-CB 4.49Å; Y79-D439 WeakPolarHBondContact CE1-OD1 3.05Å
80	G	93.1	Very high	91.5	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	16%	0.155	C	C	.	.	I	π-helix	trans	-103.6	-75.4	179.4	0	0	0	0	0	112	P61 W76 R83 T84	P61-G80 WeakPolarHBondContact O-CA 3.45Å; W76-G80 WeakPolarHBondContact O-CA 3.17Å; W76-G80 PolarHBondContact O-N 3.46Å; G80-R83 PolarHBondContact O-N 2.78Å; G80-T84 WeakPolarHBondContact O-CB 3.12Å; G80-T84 PolarHBondContact O-N 3.34Å; G80-T84 PolarHBondContact O-OG1 2.73Å
81	I	95.1	Very high	92.7	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	13%	0.128	C	C	.	.	I	π-helix	trans	-65.2	-51.2	-171.1	-56.4	-62.2	0	0	0	111.4	I62 I75 W76 E77 R83 T84 E85 Y388 W401 F402 F405	I62-I81 HydrophobicContact CG2-CD1 4.23Å; I75-I81 HydrophobicContact CG2-CD1 3.92Å; I75-I81 HydrophobicContact CG2-CG1 3.63Å; W76-I81 PolarHBondContact O-N 2.77Å; E77-I81 PolarHBondContact O-N 2.86Å; I81-R83 VanDerWaalsContact C-N 3.28Å; I81-R83 PolarHBondContact O-N 3.35Å; I81-T84 WeakPolarHBondContact O-CB 3.39Å; I81-T84 PolarHBondContact O-N 3.44Å; I81-T84 VanDerWaalsContact O-N 3.16Å; I81-E85 HydrophobicContact CG2-CG 4.38Å; I81-E85 WeakPolarHBondContact O-CG 3.35Å; I81-E85 PolarHBondContact O-N 2.93Å; I81-Y388 HydrophobicContact CG2-CE2 4.2Å; I81-W401 HydrophobicContact CD1-CB 3.92Å; I81-F402 HydrophobicContact CG2-CD2 4.17Å; I81-F402 HydrophobicContact CG2-CE2 4.49Å; I81-F405 HydrophobicContact CD1-CB 3.98Å; I81-F405 HydrophobicContact CD1-CG 4.47Å; I81-F405 HydrophobicContact CG1-CB 3.97Å; I81-F405 HydrophobicContact CG1-CD2 4.07Å; I81-F405 HydrophobicContact CG1-CG 3.98Å; I81-F405 HydrophobicContact CG2-CD1 4.26Å; I81-F405 HydrophobicContact CG2-CG 4.38Å
82	Q	95	Very high	93.3	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-61	-37.5	179.9	-67.2	176	25.1	0	0	112.2	E77 E85 I86 F384 Y388 Y436 K437 L442	E77-Q82 WeakPolarHBondContact O-CG 3.38Å; E77-Q82 PolarHBondContact O-N 3.29Å; Q82-E85 PolarHBondContact O-N 3.27Å; Q82-I86 WeakPolarHBondContact O-CG2 3.04Å; Q82-I86 PolarHBondContact O-N 2.87Å; Q82-F384 HydrophobicContact CB-CE1 4.21Å; Q82-F384 HydrophobicContact CB-CZ 4.06Å; Q82-F384 HydrophobicContact CG-CE1 4.37Å; Q82-F384 HydrophobicContact CG-CZ 4.46Å; Q82-F384 WeakPolarHBondContact O-CZ 3.24Å; Q82-Y388 HydrophobicContact CG-CD2 4.46Å; Q82-Y388 HydrophobicContact CG-CE2 3.92Å; Q82-Y436 HydrophobicContact CG-CE2 4.48Å; Q82-K437 PolarHBondContact NE2-O 3.42Å; Q82-L442 HydrophobicContact CB-CD2 4.03Å
83	R	95.8	Very high	93.6	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-66.3	-41.1	175.3	-67.2	-161.2	-174.9	147.7	2.4	112.8	F60 Y79 G80 I81 I86 A87 Y194 D439 L442 V445	F60-R83 HydrophobicContact CD1-CB 4.1Å; F60-R83 HydrophobicContact CD2-CB 3.9Å; F60-R83 HydrophobicContact CE1-CB 4.07Å; F60-R83 VanDerWaalsContact CE2-C 3.49Å; F60-R83 HydrophobicContact CE2-CB 3.87Å; F60-R83 VanDerWaalsContact CE2-O 3.27Å; F60-R83 WeakPolarHBondContact CE2-O 3.42Å; F60-R83 HydrophobicContact CG-CB 4.03Å; F60-R83 HydrophobicContact CZ-CB 3.96Å; Y79-R83 WeakPolarHBondContact O-CD 3.43Å; Y79-R83 WeakPolarHBondContact O-CG 3.26Å; G80-R83 PolarHBondContact O-N 2.78Å; I81-R83 VanDerWaalsContact C-N 3.28Å; I81-R83 PolarHBondContact O-N 3.35Å; R83-I86 VanDerWaalsContact O-CG2 3.3Å; R83-I86 WeakPolarHBondContact O-CG2 3.25Å; R83-A87 WeakPolarHBondContact O-CB 3.23Å; R83-A87 PolarHBondContact O-N 3.43Å; R83-Y194 VanDerWaalsContact NH1-CE2 3.26Å; R83-D439 IonicContact CZ-OD2 2.82Å; R83-D439 IonicContact NE-OD2 3.86Å; R83-D439 PolarHBondContact NE-OD2 2.79Å; R83-D439 IonicContact NH2-OD1 3.72Å; R83-D439 IonicContact NH2-OD2 2.58Å; R83-D439 PolarHBondContact NH2-OD2 3.1Å; R83-D439 VanDerWaalsContact NH2-OD2 3.12Å; R83-L442 HydrophobicContact CG-CD2 4.43Å; R83-V445 HydrophobicContact CG-CG2 4.14Å
84	T	96.8	Very high	94	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-60.3	-48.9	175.6	-56.8	0	0	0	0	110.1	A48 G80 I81 A87 M88 I110	A48-T84 HydrophobicContact CB-CG2 4.46Å; G80-T84 WeakPolarHBondContact O-CB 3.12Å; G80-T84 PolarHBondContact O-N 3.34Å; G80-T84 PolarHBondContact O-OG1 2.73Å; I81-T84 WeakPolarHBondContact O-CB 3.39Å; I81-T84 PolarHBondContact O-N 3.44Å; I81-T84 VanDerWaalsContact O-N 3.16Å; T84-A87 PolarHBondContact O-N 3.36Å; T84-M88 HydrophobicContact CG2-CE 4.48Å; T84-M88 HydrophobicContact CG2-SD 4.3Å; T84-M88 WeakPolarHBondContact O-CB 3.48Å; T84-M88 VanDerWaalsContact O-CG 3.32Å; T84-M88 WeakPolarHBondContact O-CG 3.29Å; T84-M88 PolarHBondContact O-N 3.13Å; T84-I110 HydrophobicContact CG2-CD1 3.81Å; T84-I110 HydrophobicContact CG2-CG2 4.3Å
85	E	96.4	Very high	94.2	Very high	0 Å²	0	16.3 Å²	16.3	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-64.3	-45	-179.8	-69.7	-52.9	143.3	0	0	113.1	I81 Q82 M88 Q89 F384 Y387 Y388 L391 N396 N399	I81-E85 HydrophobicContact CG2-CG 4.38Å; I81-E85 WeakPolarHBondContact O-CG 3.35Å; I81-E85 PolarHBondContact O-N 2.93Å; Q82-E85 PolarHBondContact O-N 3.27Å; E85-M88 WeakPolarHBondContact O-CB 3.32Å; E85-Q89 WeakPolarHBondContact O-CB 3.14Å; E85-Q89 PolarHBondContact O-N 3.45Å; E85-F384 HydrophobicContact CB-CE2 4.17Å; E85-F384 HydrophobicContact CB-CZ 4.37Å; E85-Y387 HydrophobicContact CB-CE1 4.16Å; E85-Y387 PolarHBondContact OE2-OH 2.91Å; E85-Y388 HydrophobicContact CB-CD2 4.47Å; E85-Y388 HydrophobicContact CG-CD2 4.29Å; E85-Y388 HydrophobicContact CG-CE2 4.32Å; E85-L391 HydrophobicContact CG-CD1 3.81Å; E85-L391 WeakPolarHBondContact OE2-CD1 3.48Å; E85-N396 VanDerWaalsContact CD-ND2 3.35Å; E85-N396 PolarHBondContact OE1-ND2 2.53Å; E85-N399 VanDerWaalsContact OE1-CB 3.31Å; E85-N399 WeakPolarHBondContact OE1-CB 3.4Å; E85-N399 PolarHBondContact OE1-ND2 3.17Å
86	I	96	Very high	94.4	Very high	4 Å²	4	21.8 Å²	21.8	2%	0.021	12%	0.116	C	C	.	.	H	α-helix	trans	-68.1	-38.2	178.6	-171	61.1	0	0	0	111.6	Q82 R83 M88 Q89 T90 V381 F384 L442 V445 V446	Q82-I86 WeakPolarHBondContact O-CG2 3.04Å; Q82-I86 PolarHBondContact O-N 2.87Å; R83-I86 VanDerWaalsContact O-CG2 3.3Å; R83-I86 WeakPolarHBondContact O-CG2 3.25Å; I86-M88 VanDerWaalsContact C-N 3.34Å; I86-Q89 PolarHBondContact O-N 2.82Å; I86-T90 WeakPolarHBondContact O-CB 3.49Å; I86-T90 PolarHBondContact O-N 3.04Å; I86-T90 PolarHBondContact O-OG1 3.43Å; I86-V381 HydrophobicContact CD1-CG1 3.93Å; I86-F384 HydrophobicContact CB-CD2 4Å; I86-F384 HydrophobicContact CB-CE2 3.63Å; I86-F384 HydrophobicContact CB-CZ 4.21Å; I86-F384 HydrophobicContact CD1-CB 4.38Å; I86-F384 HydrophobicContact CD1-CD2 3.51Å; I86-F384 HydrophobicContact CD1-CE2 4.07Å; I86-F384 HydrophobicContact CD1-CG 4.14Å; I86-F384 HydrophobicContact CG1-CD2 4.23Å; I86-F384 HydrophobicContact CG1-CE2 4.36Å; I86-L442 HydrophobicContact CB-CD2 4.25Å; I86-L442 HydrophobicContact CG2-CD2 3.69Å; I86-V445 HydrophobicContact CG2-CB 4.24Å; I86-V445 HydrophobicContact CG2-CG1 4.05Å; I86-V446 HydrophobicContact CD1-CG2 3.88Å; I86-V446 HydrophobicContact CG1-CG2 3.47Å; I86-V446 VanDerWaalsContact CG1-CG2 3.47Å
87	A	97	Very high	94.6	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-63.6	-45.4	179.3	0	0	0	0	0	111	F60 R83 T84 T90 V91 I108 I110 V445 I449	F60-A87 HydrophobicContact CE2-CB 3.77Å; F60-A87 HydrophobicContact CZ-CB 3.94Å; R83-A87 WeakPolarHBondContact O-CB 3.23Å; R83-A87 PolarHBondContact O-N 3.43Å; T84-A87 PolarHBondContact O-N 3.36Å; A87-T90 PolarHBondContact O-N 3.17Å; A87-V91 PolarHBondContact O-N 3.44Å; A87-V91 VanDerWaalsContact O-N 3.1Å; A87-I108 HydrophobicContact CB-CD1 3.91Å; A87-I110 HydrophobicContact CB-CD1 4.17Å; A87-V445 HydrophobicContact CB-CG1 4.09Å; A87-I449 VanDerWaalsContact CA-CD1 3.5Å; A87-I449 HydrophobicContact CB-CD1 3.71Å
88	M	95.9	Very high	94.5	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-56.9	-50.5	173.6	-89.4	-167.2	170.3	0	0	112.6	A48 I50 T84 E85 I86 T90 V91 D92 I110 R398	A48-M88 HydrophobicContact CB-CE 3.32Å; I50-M88 HydrophobicContact CD1-CB 4.42Å; I50-M88 HydrophobicContact CD1-CG 4.16Å; T84-M88 HydrophobicContact CG2-CE 4.48Å; T84-M88 HydrophobicContact CG2-SD 4.3Å; T84-M88 WeakPolarHBondContact O-CB 3.48Å; T84-M88 VanDerWaalsContact O-CG 3.32Å; T84-M88 WeakPolarHBondContact O-CG 3.29Å; T84-M88 PolarHBondContact O-N 3.13Å; E85-M88 WeakPolarHBondContact O-CB 3.32Å; I86-M88 VanDerWaalsContact C-N 3.34Å; M88-T90 VanDerWaalsContact C-N 3.31Å; M88-T90 PolarHBondContact O-N 3.11Å; M88-V91 PolarHBondContact O-N 3.37Å; M88-D92 PolarHBondContact O-N 3.29Å; M88-I110 HydrophobicContact CE-CD1 4.19Å; M88-I110 HydrophobicContact CG-CD1 3.85Å; M88-R398 PolarHBondContact O-NH2 3.44Å; M88-R398 VanDerWaalsContact O-NH2 3.09Å; M88-R398 HydrophobicContact SD-CB 4.46Å; M88-R398 HydrophobicContact SD-CG 3.86Å; M88-R398 PolarHBondContact SD-NE 3.14Å
89	Q	94.7	Very high	94.7	Very high	52 Å²	52	35.2 Å²	35.2	24%	0.243	18%	0.179	C	C	.	.	H	α-helix	trans	-64.6	-35	177.7	-172.7	-178.1	25.9	0	0	112.6	E85 I86 D92 A93 Y387	E85-Q89 WeakPolarHBondContact O-CB 3.14Å; E85-Q89 PolarHBondContact O-N 3.45Å; I86-Q89 PolarHBondContact O-N 2.82Å; Q89-D92 PolarHBondContact O-N 3.31Å; Q89-A93 PolarHBondContact O-N 2.99Å; Q89-Y387 HydrophobicContact CB-CE1 4.19Å; Q89-Y387 HydrophobicContact CG-CE1 4.48Å; Q89-Y387 VanDerWaalsContact OE1-CD1 3.28Å
90	T	95.7	Very high	94.8	Very high	8 Å²	8	34.7 Å²	34.7	5%	0.049	18%	0.177	C	C	.	.	H	α-helix	trans	-66.5	-41.9	179.3	-57.4	0	0	0	0	111	I86 A87 M88 A93 I94 V446 I449 Y450	I86-T90 WeakPolarHBondContact O-CB 3.49Å; I86-T90 PolarHBondContact O-N 3.04Å; I86-T90 PolarHBondContact O-OG1 3.43Å; A87-T90 PolarHBondContact O-N 3.17Å; M88-T90 VanDerWaalsContact C-N 3.31Å; M88-T90 PolarHBondContact O-N 3.11Å; T90-A93 WeakPolarHBondContact O-CB 3.43Å; T90-A93 PolarHBondContact O-N 3.19Å; T90-I94 HydrophobicContact CG2-CD1 4.06Å; T90-I94 WeakPolarHBondContact O-CG1 3.3Å; T90-I94 PolarHBondContact O-N 3.4Å; T90-V446 HydrophobicContact CG2-CG1 4.15Å; T90-I449 HydrophobicContact CG2-CB 4Å; T90-I449 HydrophobicContact CG2-CD1 4.16Å; T90-I449 HydrophobicContact CG2-CG2 3.89Å; T90-Y450 HydrophobicContact CG2-CD2 4.08Å; T90-Y450 HydrophobicContact CG2-CE2 3.79Å
91	V	96.2	Very high	94.7	Very high	0 Å²	0	35 Å²	35	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-65	-40.3	175.4	170.6	0	0	0	0	111.5	I50 A87 M88 A93 I94 N95 L106 I108 I449	I50-V91 HydrophobicContact CD1-CB 4.22Å; I50-V91 HydrophobicContact CD1-CG1 4.13Å; A87-V91 PolarHBondContact O-N 3.44Å; A87-V91 VanDerWaalsContact O-N 3.1Å; M88-V91 PolarHBondContact O-N 3.37Å; V91-A93 VanDerWaalsContact C-N 3.3Å; V91-A93 PolarHBondContact O-N 3.08Å; V91-I94 PolarHBondContact O-N 3.21Å; V91-N95 WeakPolarHBondContact O-CB 3.15Å; V91-N95 PolarHBondContact O-N 2.8Å; V91-N95 PolarHBondContact O-ND2 3.16Å; V91-L106 HydrophobicContact CG1-CB 4.47Å; V91-L106 WeakPolarHBondContact CG1-O 3.34Å; V91-I108 HydrophobicContact CG2-CB 4.12Å; V91-I108 HydrophobicContact CG2-CD1 3.91Å; V91-I108 HydrophobicContact CG2-CG1 4.5Å; V91-I108 HydrophobicContact CG2-CG2 4.43Å; V91-I449 HydrophobicContact CG2-CG2 4.03Å
92	D	95.3	Very high	94.3	Very high	49 Å²	49	36.7 Å²	36.7	26%	0.262	19%	0.189	S	C	.	.	H	α-helix	trans	-61.5	-39.8	173.2	-61.6	-27.1	0	0	0	111.6	M88 Q89 N95 N96 R398	M88-D92 PolarHBondContact O-N 3.29Å; Q89-D92 PolarHBondContact O-N 3.31Å; D92-N95 PolarHBondContact O-N 3.2Å; D92-N96 WeakPolarHBondContact O-CB 3.32Å; D92-N96 VanDerWaalsContact O-CG 3.27Å; D92-N96 PolarHBondContact O-N 3.32Å; D92-N96 VanDerWaalsContact O-N 3.08Å; D92-N96 PolarHBondContact O-ND2 3.06Å; D92-R398 IonicContact OD1-NH2 3.87Å; D92-R398 PolarHBondContact OD1-NH2 3Å; D92-R398 IonicContact OD2-CZ 3.27Å; D92-R398 VanDerWaalsContact OD2-CZ 3.28Å; D92-R398 IonicContact OD2-NH1 3.55Å; D92-R398 PolarHBondContact OD2-NH1 3.46Å; D92-R398 IonicContact OD2-NH2 3.57Å; D92-R398 PolarHBondContact OD2-NH2 3.48Å
93	A	94.3	Very high	94	Very high	45 Å²	45	42 Å²	42	37%	0.372	22%	0.217	S	C	.	.	H	α-helix	trans	-64.6	-41.5	177	0	0	0	0	0	111.8	Q89 T90 V91 N96 D97	Q89-A93 PolarHBondContact O-N 2.99Å; T90-A93 WeakPolarHBondContact O-CB 3.43Å; T90-A93 PolarHBondContact O-N 3.19Å; V91-A93 VanDerWaalsContact C-N 3.3Å; V91-A93 PolarHBondContact O-N 3.08Å; A93-N96 PolarHBondContact O-N 3.44Å; A93-D97 PolarHBondContact O-N 3.12Å; A93-D97 VanDerWaalsContact O-N 3.13Å
94	I	95.6	Very high	93.7	Very high	2 Å²	2	42.3 Å²	42.3	1%	0.01	22%	0.22	C	C	.	.	H	α-helix	trans	-64.3	-46.9	176.2	-69.6	161.7	0	0	0	110.7	T90 V91 N96 D97 I100 L106 I449 Y450 A453	T90-I94 HydrophobicContact CG2-CD1 4.06Å; T90-I94 WeakPolarHBondContact O-CG1 3.3Å; T90-I94 PolarHBondContact O-N 3.4Å; V91-I94 PolarHBondContact O-N 3.21Å; I94-N96 PolarHBondContact O-N 3.02Å; I94-D97 PolarHBondContact O-N 2.82Å; I94-I100 HydrophobicContact CG2-CG2 4.12Å; I94-L106 HydrophobicContact CD1-CD2 4.36Å; I94-L106 HydrophobicContact CG2-CD2 4.22Å; I94-I449 HydrophobicContact CD1-CG2 3.61Å; I94-Y450 HydrophobicContact CD1-CD1 4.27Å; I94-Y450 HydrophobicContact CD1-CE1 4.24Å; I94-Y450 HydrophobicContact CG1-CD1 4.24Å; I94-Y450 HydrophobicContact CG1-CE1 3.77Å; I94-A453 HydrophobicContact CD1-CB 3.85Å; I94-A453 HydrophobicContact CG2-CB 4.23Å
95	N	95.6	Very high	93.5	Very high	55 Å²	55	48 Å²	48	29%	0.294	25%	0.246	S	C	.	.	H	α-helix	trans	-65.4	-23	179.2	-72.8	-23.7	0	0	0	113.2	V91 D92 L106	V91-N95 WeakPolarHBondContact O-CB 3.15Å; V91-N95 PolarHBondContact O-N 2.8Å; V91-N95 PolarHBondContact O-ND2 3.16Å; D92-N95 PolarHBondContact O-N 3.2Å; N95-L106 PolarHBondContact ND2-O 3Å; N95-L106 PolarHBondContact OD1-N 3.19Å
96	N	95.2	Very high	93.4	Very high	133 Å²	133	48 Å²	48	71%	0.711	25%	0.246	S	C	*	.	H	α-helix	trans	-86.2	-16.3	173.7	-73.7	-47.3	0	0	0	113.3	D92 A93 I94	D92-N96 WeakPolarHBondContact O-CB 3.32Å; D92-N96 VanDerWaalsContact O-CG 3.27Å; D92-N96 PolarHBondContact O-N 3.32Å; D92-N96 VanDerWaalsContact O-N 3.08Å; D92-N96 PolarHBondContact O-ND2 3.06Å; A93-N96 PolarHBondContact O-N 3.44Å; I94-N96 PolarHBondContact O-N 3.02Å
97	D	94.1	Very high	93.3	Very high	56 Å²	56	47.8 Å²	47.8	30%	0.299	25%	0.245	S	C	.	.			trans	-85.2	112.6	178.7	-171.4	-15.8	0	0	0	110.7	A93 I94 T99	A93-D97 PolarHBondContact O-N 3.12Å; A93-D97 VanDerWaalsContact O-N 3.13Å; I94-D97 PolarHBondContact O-N 2.82Å; D97-T99 VanDerWaalsContact CG-OG1 3.23Å; D97-T99 PolarHBondContact O-N 3.46Å; D97-T99 WeakPolarHBondContact OD1-CB 3.34Å; D97-T99 WeakPolarHBondContact OD1-CG2 3.25Å; D97-T99 PolarHBondContact OD1-N 3.26Å; D97-T99 PolarHBondContact OD1-OG1 3.44Å; D97-T99 PolarHBondContact OD2-OG1 2.92Å
98	R	90.6	Very high	93.2	Very high	229 Å²	229	47.8 Å²	47.8	86%	0.864	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.5	-7.6	-179.1	-61.1	-174.9	-178.7	-171.9	-0.4	114
99	T	91.3	Very high	93.1	Very high	92 Å²	92	48.4 Å²	48.4	56%	0.564	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.8	-20.6	-177.7	68.8	0	0	0	0	113.6	D97 K461	D97-T99 VanDerWaalsContact CG-OG1 3.23Å; D97-T99 PolarHBondContact O-N 3.46Å; D97-T99 WeakPolarHBondContact OD1-CB 3.34Å; D97-T99 WeakPolarHBondContact OD1-CG2 3.25Å; D97-T99 PolarHBondContact OD1-N 3.26Å; D97-T99 PolarHBondContact OD1-OG1 3.44Å; D97-T99 PolarHBondContact OD2-OG1 2.92Å; T99-K461 PolarHBondContact O-NZ 2.03Å
100	I	91.5	Very high	93.2	Very high	4 Å²	4	45.9 Å²	45.9	2%	0.021	24%	0.238	C	C	.	.	S	Bend	trans	-114	122.1	-176.8	-53.6	176.1	0	0	0	107.8	I94 Y450 A453 Y454 D457	I94-I100 HydrophobicContact CG2-CG2 4.12Å; I100-Y450 HydrophobicContact CD1-CD1 4.37Å; I100-Y450 HydrophobicContact CD1-CE1 4.09Å; I100-A453 HydrophobicContact CG2-CB 4.17Å; I100-Y454 HydrophobicContact CD1-CD1 4.42Å; I100-Y454 HydrophobicContact CD1-CE1 3.72Å; I100-Y454 HydrophobicContact CG1-CE1 4Å; I100-D457 HydrophobicContact CG2-CB 4.1Å
101	L	90.4	Very high	93.1	Very high	6 Å²	6	46.9 Å²	46.9	3%	0.031	24%	0.241	C	C	.	.	S	Bend	trans	52.1	56.6	177.1	-67.6	173.9	0	0	0	114.3	N103 V104 L456 D457 Y460	L101-N103 PolarHBondContact O-N 2.85Å; L101-V104 HydrophobicContact CB-CB 4.23Å; L101-V104 PolarHBondContact O-N 3.48Å; L101-V104 VanDerWaalsContact O-N 3.09Å; L101-L456 HydrophobicContact CD1-CB 4.09Å; L101-L456 HydrophobicContact CD1-CD1 4.46Å; L101-L456 HydrophobicContact CD2-CB 4.15Å; L101-D457 HydrophobicContact CD2-CB 4.28Å; L101-D457 HydrophobicContact CG-CB 4.19Å; L101-D457 PolarHBondContact N-OD1 2.94Å; L101-Y460 HydrophobicContact CD2-CD1 4.19Å; L101-Y460 HydrophobicContact CD2-CG 4.15Å
102	P	88.1	Confident	93.1	Very high	36 Å²	36	47.3 Å²	47.3	23%	0.234	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.8	130.2	-179.7	26	-34	0	0	0	111.4	V104 Y460 I468	P102-V104 VanDerWaalsContact C-N 3.29Å; P102-V104 PolarHBondContact O-N 2.92Å; P102-Y460 HydrophobicContact CG-CE1 4.16Å; P102-Y460 PolarHBondContact O-OH 3.35Å; P102-I468 HydrophobicContact CG-CG2 3.88Å
103	N	88.2	Confident	93	Very high	110 Å²	110	45 Å²	45	59%	0.588	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	66.7	17.8	-176.3	-47.7	-54.5	0	0	0	115.7	L101 I468 G471	L101-N103 PolarHBondContact O-N 2.85Å; N103-I468 PolarHBondContact ND2-O 2.99Å; N103-G471 WeakPolarHBondContact O-CA 3.47Å
104	V	89.2	Confident	92.8	Very high	8 Å²	8	42.9 Å²	42.9	5%	0.048	21%	0.213	C	C	.	.			trans	-126	126.1	174.5	175.1	0	0	0	0	108.6	D53 L54 L101 P102 Y460 V472	D53-V104 HydrophobicContact CB-CG1 4.19Å; L54-V104 HydrophobicContact CD1-CG1 4.07Å; L54-V104 HydrophobicContact CG-CG1 4.22Å; L101-V104 HydrophobicContact CB-CB 4.23Å; L101-V104 PolarHBondContact O-N 3.48Å; L101-V104 VanDerWaalsContact O-N 3.09Å; P102-V104 VanDerWaalsContact C-N 3.29Å; P102-V104 PolarHBondContact O-N 2.92Å; V104-Y460 HydrophobicContact CG2-CE1 4.45Å; V104-Y460 HydrophobicContact CG2-CE2 3.91Å; V104-V472 HydrophobicContact CB-CG2 4.29Å; V104-V472 HydrophobicContact CG1-CG2 3.61Å; V104-V472 HydrophobicContact CG2-CG2 3.75Å
105	Q	91.9	Very high	92.4	Very high	118 Å²	118	45.5 Å²	45.5	55%	0.551	22%	0.223	S	C	*	.	P	Polyproline II helix	trans	-90.3	126.4	176.4	-66.2	-170.1	8.5	0	0	110.8	G52 D53 L54	G52-Q105 CarbonylContact C-O 3.6Å; G52-Q105 WeakPolarHBondContact CA-O 3.43Å; D53-Q105 PolarHBondContact N-O 3.04Å; D53-Q105 PolarHBondContact OD2-N 3.24Å; L54-Q105 PolarHBondContact N-O 3.02Å
106	L	93.9	Very high	92.1	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	124.7	171.7	-168.3	65.8	0	0	0	109.5	L54 I56 V91 I94 N95 A453 L456	L54-L106 HydrophobicContact CB-CD1 4.27Å; I56-L106 HydrophobicContact CD1-CD1 3.9Å; I56-L106 HydrophobicContact CD1-CD2 3.77Å; I56-L106 HydrophobicContact CD1-CG 4.06Å; I56-L106 HydrophobicContact CG1-CD1 3.99Å; I56-L106 HydrophobicContact CG1-CG 4.45Å; V91-L106 HydrophobicContact CG1-CB 4.47Å; V91-L106 WeakPolarHBondContact CG1-O 3.34Å; I94-L106 HydrophobicContact CD1-CD2 4.36Å; I94-L106 HydrophobicContact CG2-CD2 4.22Å; N95-L106 PolarHBondContact ND2-O 3Å; N95-L106 PolarHBondContact OD1-N 3.19Å; L106-A453 HydrophobicContact CD2-CB 4.32Å; L106-L456 HydrophobicContact CD1-CD1 3.91Å
107	G	94.1	Very high	91.8	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	164.4	173.3	0	0	0	0	0	112.2	I50 L54 Q55 I56	I50-G107 CarbonylContact O-C 3.51Å; I50-G107 WeakPolarHBondContact O-CA 3.34Å; L54-G107 PolarHBondContact O-N 3.21Å; Q55-G107 VanDerWaalsContact OE1-C 3.3Å; I56-G107 PolarHBondContact N-O 3.49Å
108	I	95.1	Very high	91.7	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	138.5	176.9	-158	174.6	0	0	0	110.4	T49 I50 Q55 I56 V58 A87 V91 I110 I449	T49-I108 CarbonylContact C-O 3.59Å; T49-I108 VanDerWaalsContact CA-O 3.25Å; T49-I108 WeakPolarHBondContact CA-O 3.47Å; I50-I108 HydrophobicContact CB-CG2 3.96Å; I50-I108 HydrophobicContact CD1-CG2 3.6Å; I50-I108 HydrophobicContact CG1-CG2 3.71Å; I50-I108 PolarHBondContact N-O 2.78Å; I50-I108 PolarHBondContact O-N 3.09Å; Q55-I108 VanDerWaalsContact OE1-N 3.14Å; I56-I108 HydrophobicContact CB-CG1 4.39Å; I56-I108 CarbonylContact O-C 3.59Å; I56-I108 WeakPolarHBondContact O-CA 3.33Å; V58-I108 HydrophobicContact CG2-CD1 3.62Å; V58-I108 HydrophobicContact CG2-CG1 3.51Å; A87-I108 HydrophobicContact CB-CD1 3.91Å; V91-I108 HydrophobicContact CG2-CB 4.12Å; V91-I108 HydrophobicContact CG2-CD1 3.91Å; V91-I108 HydrophobicContact CG2-CG1 4.5Å; V91-I108 HydrophobicContact CG2-CG2 4.43Å; I108-I110 HydrophobicContact CD1-CD1 4.24Å; I108-I110 HydrophobicContact CD1-CG1 4.16Å; I108-I110 HydrophobicContact CG1-CG1 4.11Å; I108-I110 HydrophobicContact CG2-CD1 4.49Å; I108-I110 HydrophobicContact CG2-CG1 4.43Å; I108-I449 HydrophobicContact CD1-CD1 4.41Å
109	S	94.5	Very high	91.7	Very high	13 Å²	13	36 Å²	36	9%	0.091	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	105.4	174.8	-172.5	0	0	0	0	109.6	V47 I56 G57 V58	V47-S109 WeakPolarHBondContact CG1-OG 3.08Å; I56-S109 PolarHBondContact O-N 3.19Å; G57-S109 CarbonylContact C-O 3.53Å; V58-S109 PolarHBondContact N-O 3.27Å
110	I	95.7	Very high	91.8	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	126.3	-175.6	-52.9	174.6	0	0	0	109.6	V47 A48 V58 F60 T84 A87 M88 I108	V47-I110 WeakPolarHBondContact CG1-O 3.45Å; A48-I110 HydrophobicContact CB-CB 4.26Å; A48-I110 PolarHBondContact N-O 2.84Å; A48-I110 PolarHBondContact O-N 3.23Å; V58-I110 HydrophobicContact CB-CB 4.45Å; V58-I110 HydrophobicContact CB-CG1 4.06Å; V58-I110 HydrophobicContact CB-CG2 4.5Å; V58-I110 HydrophobicContact CG2-CG1 4.36Å; F60-I110 HydrophobicContact CD2-CG2 3.58Å; F60-I110 HydrophobicContact CE2-CD1 4.38Å; F60-I110 HydrophobicContact CE2-CG2 4.16Å; F60-I110 HydrophobicContact CG-CG2 4.42Å; T84-I110 HydrophobicContact CG2-CD1 3.81Å; T84-I110 HydrophobicContact CG2-CG2 4.3Å; A87-I110 HydrophobicContact CB-CD1 4.17Å; M88-I110 HydrophobicContact CE-CD1 4.19Å; M88-I110 HydrophobicContact CG-CD1 3.85Å; I108-I110 HydrophobicContact CD1-CD1 4.24Å; I108-I110 HydrophobicContact CD1-CG1 4.16Å; I108-I110 HydrophobicContact CG1-CG1 4.11Å; I108-I110 HydrophobicContact CG2-CD1 4.49Å; I108-I110 HydrophobicContact CG2-CG1 4.43Å
111	R	95.2	Very high	91.9	Very high	29 Å²	29	34 Å²	34	11%	0.109	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	157.7	179.9	-67.5	176.7	-179.7	-95.5	6.2	111.4	V47 V58 L59 F60 Q123 E126 L127	V47-R111 HydrophobicContact CG1-CG 3.87Å; V47-R111 HydrophobicContact CG2-CG 4.32Å; V58-R111 PolarHBondContact O-N 2.77Å; L59-R111 HydrophobicContact CD2-CB 4.12Å; F60-R111 PolarHBondContact N-O 2.76Å; R111-Q123 HydrophobicContact CB-CB 4.08Å; R111-Q123 HydrophobicContact CB-CG 4.14Å; R111-E126 PolarHBondContact NH2-O 2.99Å; R111-L127 HydrophobicContact CG-CD2 4.47Å
112	D	95	Very high	91.9	Very high	8 Å²	8	37 Å²	37	4%	0.043	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	126.2	-177	-168.3	8.2	0	0	0	112.1	F60 I62 H63 C114 I119 Q123 W401	F60-D112 WeakPolarHBondContact O-CA 3.16Å; I62-D112 HydrophobicContact CB-CB 4.19Å; I62-D112 WeakPolarHBondContact CB-OD1 3.46Å; I62-D112 HydrophobicContact CD1-CB 4.06Å; I62-D112 HydrophobicContact CG1-CB 4.15Å; I62-D112 PolarHBondContact N-OD1 3.27Å; H63-D112 IonicContact CE1-OD2 2.73Å; H63-D112 IonicContact CG-OD2 2.99Å; H63-D112 PolarHBondContact N-OD1 3.41Å; H63-D112 IonicContact ND1-OD2 2.86Å; H63-D112 PolarHBondContact ND1-OD2 3.31Å; D112-C114 PolarHBondContact OD1-N 2.63Å; D112-C114 PolarHBondContact OD1-SG 2.67Å; D112-C114 PolarHBondContact OD2-SG 3.07Å; D112-I119 WeakPolarHBondContact O-CG2 3.45Å; D112-Q123 WeakPolarHBondContact O-CG 3.31Å; D112-W401 HydrophobicContact CB-CZ2 4.27Å
113	D	93.2	Very high	92.2	Very high	1 Å²	1	35.7 Å²	35.7	1%	0.005	17%	0.166	C	C	.	.			trans	-96.4	-11.9	176.3	70.6	16.5	0	0	0	113.3	L59 F60 P61 W115 T116 A120 P171	L59-D113 HydrophobicContact CB-CB 4.33Å; F60-D113 PolarHBondContact O-N 2.02Å; P61-D113 WeakPolarHBondContact CA-OD1 3.19Å; P61-D113 WeakPolarHBondContact CB-OD1 3.49Å; D113-W115 PolarHBondContact O-N 3.19Å; D113-W115 PolarHBondContact OD1-N 2.89Å; D113-T116 PolarHBondContact O-N 3.38Å; D113-T116 PolarHBondContact O-OG1 2.89Å; D113-A120 HydrophobicContact CB-CB 3.87Å; D113-P171 HydrophobicContact CB-CB 4.44Å; D113-P171 WeakPolarHBondContact OD2-CB 3.25Å
114	C	91.2	Very high	92.4	Very high	1 Å²	1	30.4 Å²	30.4	1%	0.007	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	47.7	22	-174.7	-58.7	0	0	0	0	115.1	H63 K65 C72 D112 T116 I119	H63-C114 WeakPolarHBondContact O-CA 3.08Å; K65-C114 PolarHBondContact N-O 2.86Å; C72-C114 HydrophobicContact CB-CB 3.97Å; C72-C114 WeakPolarHBondContact CB-SG 3.39Å; C72-C114 WeakPolarHBondContact SG-CB 3.47Å; C72-C114 CovalentContact SG-SG 2.02Å; C72-C114 PolarHBondContact SG-SG 2.85Å; D112-C114 PolarHBondContact OD1-N 2.63Å; D112-C114 PolarHBondContact OD1-SG 2.67Å; D112-C114 PolarHBondContact OD2-SG 3.07Å; C114-T116 PolarHBondContact O-N 3.37Å; C114-I119 HydrophobicContact CB-CD1 3.84Å; C114-I119 HydrophobicContact CB-CG2 4.37Å
115	W	87.4	Confident	92.5	Very high	56 Å²	56	34.2 Å²	34.2	21%	0.212	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.3	32.2	-171.9	-149.9	-85.1	0	0	0	113.4	P61 K65 W76 Y79 D113	P61-W115 HydrophobicContact CB-CB 4.37Å; P61-W115 HydrophobicContact CB-CE3 3.53Å; P61-W115 HydrophobicContact CB-CZ3 4.24Å; P61-W115 HydrophobicContact CG-CE3 3.58Å; P61-W115 HydrophobicContact CG-CZ3 3.75Å; K65-W115 HydrophobicContact CB-CB 4.33Å; W76-W115 HydrophobicContact CZ3-CD2 4.34Å; W76-W115 AromaticContact CZ3-CE3 3.9Å; W76-W115 HydrophobicContact CZ3-CE3 3.9Å; W76-W115 HydrophobicContact CZ3-CZ3 4.28Å; Y79-W115 HydrophobicContact CD2-CH2 4.37Å; Y79-W115 AromaticContact CD2-CZ3 3.96Å; Y79-W115 HydrophobicContact CD2-CZ3 3.96Å; Y79-W115 HydrophobicContact CE2-CH2 4.43Å; Y79-W115 HydrophobicContact CE2-CZ3 4.46Å; D113-W115 PolarHBondContact O-N 3.19Å; D113-W115 PolarHBondContact OD1-N 2.89Å
116	T	88.4	Confident	92.3	Very high	27 Å²	27	31.5 Å²	31.5	17%	0.166	14%	0.144	C	C	.	.			trans	-129.6	136.9	179.7	61.7	0	0	0	0	112.2	K65 D113 C114 R118 I119 A120	K65-T116 HydrophobicContact CB-CG2 4.25Å; K65-T116 HydrophobicContact CD-CG2 3.9Å; K65-T116 HydrophobicContact CG-CG2 3.74Å; D113-T116 PolarHBondContact O-N 3.38Å; D113-T116 PolarHBondContact O-OG1 2.89Å; C114-T116 PolarHBondContact O-N 3.37Å; T116-R118 VanDerWaalsContact C-N 3.34Å; T116-R118 PolarHBondContact O-N 3.44Å; T116-I119 PolarHBondContact O-N 3.47Å; T116-I119 VanDerWaalsContact OG1-CB 3.29Å; T116-I119 WeakPolarHBondContact OG1-CB 3.41Å; T116-I119 VanDerWaalsContact OG1-CG1 3.32Å; T116-I119 WeakPolarHBondContact OG1-CG1 3.48Å; T116-A120 VanDerWaalsContact O-CB 3.3Å; T116-A120 WeakPolarHBondContact O-CB 3.35Å; T116-A120 PolarHBondContact O-N 3Å
117	E	89.2	Confident	92.1	Very high	105 Å²	105	31.6 Å²	31.6	49%	0.491	15%	0.145	S	C	.	.	H	α-helix	trans	-56.2	-46.3	179.4	-69.4	164.7	-155.7	0	0	112.2	A120 M121 V176 A179	E117-A120 PolarHBondContact O-N 3.38Å; E117-M121 WeakPolarHBondContact O-CB 3.27Å; E117-M121 WeakPolarHBondContact O-CG 3.4Å; E117-M121 PolarHBondContact O-N 2.92Å; E117-V176 HydrophobicContact CG-CG2 4.08Å; E117-A179 HydrophobicContact CB-CB 4.4Å; E117-A179 HydrophobicContact CG-CB 4.3Å
118	R	90.9	Very high	91.7	Very high	132 Å²	132	31.8 Å²	31.8	50%	0.498	15%	0.146	S	C	.	.	H	α-helix	trans	-59.4	-53	-178.6	179.3	179.5	166.5	176.9	-10.4	112.4	E70 T116 M121 E122	E70-R118 IonicContact OE1-CZ 3.89Å; E70-R118 IonicContact OE1-NH1 3.92Å; E70-R118 PolarHBondContact OE1-NH1 3.12Å; E70-R118 IonicContact OE2-CZ 3.77Å; E70-R118 IonicContact OE2-NH1 3.28Å; E70-R118 PolarHBondContact OE2-NH1 2.96Å; E70-R118 IonicContact OE2-NH2 2.91Å; T116-R118 VanDerWaalsContact C-N 3.34Å; T116-R118 PolarHBondContact O-N 3.44Å; R118-M121 PolarHBondContact O-N 3.35Å; R118-E122 IonicContact CZ-OE1 2.69Å; R118-E122 IonicContact NE-OE1 3.55Å; R118-E122 PolarHBondContact NE-OE1 3.46Å; R118-E122 IonicContact NH2-OE1 3.3Å; R118-E122 PolarHBondContact NH2-OE1 3.37Å; R118-E122 WeakPolarHBondContact O-CG 3.44Å; R118-E122 PolarHBondContact O-N 3.45Å
119	I	91.5	Very high	91.1	Very high	10 Å²	10	38.9 Å²	38.9	5%	0.051	17%	0.173	C	C	.	.	H	α-helix	trans	-67.5	-40.3	-176.7	-62.6	-179.4	0	0	0	110.2	M45 C72 D112 C114 T116 M121 E122 Q123	M45-I119 HydrophobicContact CE-CG2 3.97Å; M45-I119 HydrophobicContact SD-CG2 4.08Å; C72-I119 WeakPolarHBondContact SG-CD1 3.35Å; D112-I119 WeakPolarHBondContact O-CG2 3.45Å; C114-I119 HydrophobicContact CB-CD1 3.84Å; C114-I119 HydrophobicContact CB-CG2 4.37Å; T116-I119 PolarHBondContact O-N 3.47Å; T116-I119 VanDerWaalsContact OG1-CB 3.29Å; T116-I119 WeakPolarHBondContact OG1-CB 3.41Å; T116-I119 VanDerWaalsContact OG1-CG1 3.32Å; T116-I119 WeakPolarHBondContact OG1-CG1 3.48Å; I119-M121 VanDerWaalsContact C-N 3.31Å; I119-M121 PolarHBondContact O-N 3.4Å; I119-E122 PolarHBondContact O-N 2.97Å; I119-Q123 HydrophobicContact CG2-CG 4.41Å; I119-Q123 WeakPolarHBondContact O-CB 3.34Å; I119-Q123 WeakPolarHBondContact O-CG 3.37Å; I119-Q123 PolarHBondContact O-N 3.05Å
120	A	93.5	Very high	89.7	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-58.6	-43	174.6	0	0	0	0	0	112.1	D113 T116 E117 Q123 T124 V176 V180	D113-A120 HydrophobicContact CB-CB 3.87Å; T116-A120 VanDerWaalsContact O-CB 3.3Å; T116-A120 WeakPolarHBondContact O-CB 3.35Å; T116-A120 PolarHBondContact O-N 3Å; E117-A120 PolarHBondContact O-N 3.38Å; A120-Q123 PolarHBondContact O-N 2.83Å; A120-T124 WeakPolarHBondContact O-CB 3.33Å; A120-T124 PolarHBondContact O-N 3.49Å; A120-T124 PolarHBondContact O-OG1 2.83Å; A120-V176 HydrophobicContact CB-CG1 3.21Å; A120-V180 HydrophobicContact CB-CG2 3.98Å
121	M	92.8	Very high	88.3	Confident	54 Å²	54	44.5 Å²	44.5	27%	0.266	20%	0.203	S	C	.	.	H	α-helix	trans	-65.8	-45	176.4	-73.2	-67.4	-70.4	0	0	112	E117 R118 I119 Q123 T124 I125 A179 L183	E117-M121 WeakPolarHBondContact O-CB 3.27Å; E117-M121 WeakPolarHBondContact O-CG 3.4Å; E117-M121 PolarHBondContact O-N 2.92Å; R118-M121 PolarHBondContact O-N 3.35Å; I119-M121 VanDerWaalsContact C-N 3.31Å; I119-M121 PolarHBondContact O-N 3.4Å; M121-Q123 VanDerWaalsContact C-N 3.32Å; M121-Q123 PolarHBondContact O-N 2.98Å; M121-T124 PolarHBondContact O-N 3.47Å; M121-I125 WeakPolarHBondContact O-CG1 3.32Å; M121-I125 PolarHBondContact O-N 3.04Å; M121-A179 HydrophobicContact CG-CB 4.17Å; M121-A179 HydrophobicContact SD-CB 4.11Å; M121-L183 HydrophobicContact CE-CB 3.92Å; M121-L183 HydrophobicContact CE-CD2 3.97Å; M121-L183 HydrophobicContact CE-CG 4.5Å; M121-L183 HydrophobicContact SD-CB 4.33Å; M121-L183 HydrophobicContact SD-CD2 4.45Å
122	E	92.1	Very high	86.8	Confident	70 Å²	70	46.7 Å²	46.7	33%	0.327	22%	0.22	S	C	.	.	H	α-helix	trans	-57.1	-45.7	173.9	-73.3	174.8	-172.1	0	0	111	R118 I119 I125 E126	R118-E122 IonicContact CZ-OE1 2.69Å; R118-E122 IonicContact NE-OE1 3.55Å; R118-E122 PolarHBondContact NE-OE1 3.46Å; R118-E122 IonicContact NH2-OE1 3.3Å; R118-E122 PolarHBondContact NH2-OE1 3.37Å; R118-E122 WeakPolarHBondContact O-CG 3.44Å; R118-E122 PolarHBondContact O-N 3.45Å; I119-E122 PolarHBondContact O-N 2.97Å; E122-I125 PolarHBondContact O-N 3.06Å; E122-E126 PolarHBondContact O-N 2.87Å; E122-E126 VanDerWaalsContact O-N 3.13Å
123	Q	92.7	Very high	84.9	Confident	7 Å²	7	47.8 Å²	47.8	3%	0.033	23%	0.233	C	C	.	.	H	α-helix	trans	-69.2	-31.8	176.7	-69.5	-43.3	-75	0	0	113.5	M45 L59 R111 D112 I119 A120 M121 E126 L127	M45-Q123 HydrophobicContact CE-CG 4.33Å; M45-Q123 HydrophobicContact SD-CG 4.13Å; M45-Q123 PolarHBondContact SD-NE2 3.04Å; L59-Q123 HydrophobicContact CD2-CB 3.91Å; R111-Q123 HydrophobicContact CB-CB 4.08Å; R111-Q123 HydrophobicContact CB-CG 4.14Å; D112-Q123 WeakPolarHBondContact O-CG 3.31Å; I119-Q123 HydrophobicContact CG2-CG 4.41Å; I119-Q123 WeakPolarHBondContact O-CB 3.34Å; I119-Q123 WeakPolarHBondContact O-CG 3.37Å; I119-Q123 PolarHBondContact O-N 3.05Å; A120-Q123 PolarHBondContact O-N 2.83Å; M121-Q123 VanDerWaalsContact C-N 3.32Å; M121-Q123 PolarHBondContact O-N 2.98Å; Q123-E126 PolarHBondContact O-N 3.45Å; Q123-L127 WeakPolarHBondContact O-CG 3.27Å; Q123-L127 PolarHBondContact O-N 3.44Å
124	T	93.1	Very high	82.8	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-66.4	-42.2	174.1	-57.1	0	0	0	0	110.7	A120 M121 E126 L127 I128 V180 L183 L184	A120-T124 WeakPolarHBondContact O-CB 3.33Å; A120-T124 PolarHBondContact O-N 3.49Å; A120-T124 PolarHBondContact O-OG1 2.83Å; M121-T124 PolarHBondContact O-N 3.47Å; T124-E126 VanDerWaalsContact C-N 3.29Å; T124-E126 PolarHBondContact O-N 3.28Å; T124-L127 WeakPolarHBondContact O-CB 3.48Å; T124-L127 PolarHBondContact O-N 2.67Å; T124-L127 VanDerWaalsContact O-N 3.14Å; T124-I128 WeakPolarHBondContact O-CG1 3.44Å; T124-I128 PolarHBondContact O-N 2.82Å; T124-I128 VanDerWaalsContact O-N 3.11Å; T124-V180 HydrophobicContact CG2-CG1 4.15Å; T124-L183 HydrophobicContact CG2-CD2 3.74Å; T124-L183 HydrophobicContact CG2-CG 4.35Å; T124-L184 HydrophobicContact CG2-CD2 3.71Å; T124-L184 HydrophobicContact CG2-CG 4.1Å
125	I	91.3	Very high	80.7	Confident	88 Å²	88	59.8 Å²	59.8	45%	0.451	29%	0.29	S	S	.	.	H	α-helix	trans	-58.8	-43	173.9	-68	166.2	0	0	0	110.4	M121 E122 L127 I128 R129 L183	M121-I125 WeakPolarHBondContact O-CG1 3.32Å; M121-I125 PolarHBondContact O-N 3.04Å; E122-I125 PolarHBondContact O-N 3.06Å; I125-L127 VanDerWaalsContact C-N 3.35Å; I125-L127 PolarHBondContact O-N 2.86Å; I125-I128 WeakPolarHBondContact O-CG1 3.19Å; I125-I128 PolarHBondContact O-N 3.04Å; I125-R129 WeakPolarHBondContact O-CB 3.24Å; I125-R129 PolarHBondContact O-N 3.11Å; I125-L183 HydrophobicContact CG1-CD2 3.71Å
126	E	88.6	Confident	78.2	Confident	60 Å²	60	61.1 Å²	61.1	28%	0.28	31%	0.308	S	S	.	.	H	α-helix	trans	-68.4	-28	176.8	-69.1	-62.6	145.1	0	0	113.7	R111 E122 Q123 T124 R129	R111-E126 PolarHBondContact NH2-O 2.99Å; E122-E126 PolarHBondContact O-N 2.87Å; E122-E126 VanDerWaalsContact O-N 3.13Å; Q123-E126 PolarHBondContact O-N 3.45Å; T124-E126 VanDerWaalsContact C-N 3.29Å; T124-E126 PolarHBondContact O-N 3.28Å; E126-R129 IonicContact OE1-NH1 3.39Å; E126-R129 PolarHBondContact OE1-NH1 3.36Å; E126-R129 IonicContact OE2-NH1 3.58Å
127	L	87.9	Confident	75.9	Confident	2 Å²	2	67.1 Å²	67.1	1%	0.01	34%	0.338	C	S	.	.	H	α-helix	trans	-68.6	-40.5	171.7	-74.4	167.7	0	0	0	111.9	L59 R111 Q123 T124 I125 I165	L59-L127 HydrophobicContact CD2-CD1 4.22Å; L59-L127 HydrophobicContact CG-CD1 4.49Å; R111-L127 HydrophobicContact CG-CD2 4.47Å; Q123-L127 WeakPolarHBondContact O-CG 3.27Å; Q123-L127 PolarHBondContact O-N 3.44Å; T124-L127 WeakPolarHBondContact O-CB 3.48Å; T124-L127 PolarHBondContact O-N 2.67Å; T124-L127 VanDerWaalsContact O-N 3.14Å; I125-L127 VanDerWaalsContact C-N 3.35Å; I125-L127 PolarHBondContact O-N 2.86Å; L127-I165 HydrophobicContact CD2-CD1 4.09Å; L127-I165 WeakPolarHBondContact O-CG1 3.05Å
128	I	86.7	Confident	73.5	Confident	5 Å²	5	71.2 Å²	71.2	3%	0.026	36%	0.357	C	S	.	.	H	α-helix	trans	-92.4	-5.9	-174.4	69.1	-174	0	0	0	113.2	T124 I125 D130 V131 V132 L183 L184 F187 I189	T124-I128 WeakPolarHBondContact O-CG1 3.44Å; T124-I128 PolarHBondContact O-N 2.82Å; T124-I128 VanDerWaalsContact O-N 3.11Å; I125-I128 WeakPolarHBondContact O-CG1 3.19Å; I125-I128 PolarHBondContact O-N 3.04Å; I128-D130 VanDerWaalsContact C-N 3.26Å; I128-D130 PolarHBondContact O-N 3Å; I128-V131 WeakPolarHBondContact O-CA 3.47Å; I128-V131 WeakPolarHBondContact O-CB 3.1Å; I128-V131 PolarHBondContact O-N 3.28Å; I128-V132 WeakPolarHBondContact O-CG2 3.47Å; I128-V132 PolarHBondContact O-N 3.1Å; I128-L183 HydrophobicContact CD1-CD1 4.14Å; I128-L183 HydrophobicContact CD1-CD2 3.91Å; I128-L183 HydrophobicContact CD1-CG 3.9Å; I128-L184 HydrophobicContact CG2-CD2 4.07Å; I128-F187 HydrophobicContact CD1-CD2 3.73Å; I128-F187 HydrophobicContact CD1-CE2 3.52Å; I128-F187 HydrophobicContact CD1-CZ 4.34Å; I128-I189 HydrophobicContact CG2-CD1 3.61Å
129	R	82	Confident	70.7	Confident	148 Å²	148	74.4 Å²	74.4	56%	0.558	37%	0.374	S	S	*	.	H	α-helix	trans	-53.4	-43.1	-176.6	-172.9	174.9	-179	167.7	-2	112.3	I125 E126 V132 G133	I125-R129 WeakPolarHBondContact O-CB 3.24Å; I125-R129 PolarHBondContact O-N 3.11Å; E126-R129 IonicContact OE1-NH1 3.39Å; E126-R129 PolarHBondContact OE1-NH1 3.36Å; E126-R129 IonicContact OE2-NH1 3.58Å; R129-V132 PolarHBondContact O-N 3.21Å; R129-G133 PolarHBondContact O-N 3.4Å
130	D	65.7	Low	68	Low	81 Å²	81	78.7 Å²	78.7	43%	0.433	40%	0.401	S	S	.	.	H	α-helix	trans	-74.3	-30	-179.7	-67.5	-10.8	0	0	0	112.2	I128 V132 G134 S163	I128-D130 VanDerWaalsContact C-N 3.26Å; I128-D130 PolarHBondContact O-N 3Å; D130-V132 VanDerWaalsContact C-N 3.3Å; D130-V132 PolarHBondContact O-N 3.38Å; D130-G134 PolarHBondContact O-N 3.08Å; D130-S163 PolarHBondContact OD2-OG 2.87Å
131	V	66.8	Low	65	Low	50 Å²	50	83.6 Å²	83.6	30%	0.303	44%	0.435	S	S	.	.	H	α-helix	trans	-64.5	-37.2	172.6	-175.6	0	0	0	0	110.8	I128 I165	I128-V131 WeakPolarHBondContact O-CA 3.47Å; I128-V131 WeakPolarHBondContact O-CB 3.1Å; I128-V131 PolarHBondContact O-N 3.28Å; V131-I165 HydrophobicContact CG2-CB 4.46Å
132	V	63.1	Low	62.4	Low	76 Å²	76	90.9 Å²	90.9	46%	0.461	46%	0.461	S	S	.	.	H	α-helix	trans	-78.8	-44.2	177.8	-178.6	0	0	0	0	111.5	I128 R129 D130 F187	I128-V132 WeakPolarHBondContact O-CG2 3.47Å; I128-V132 PolarHBondContact O-N 3.1Å; R129-V132 PolarHBondContact O-N 3.21Å; D130-V132 VanDerWaalsContact C-N 3.3Å; D130-V132 PolarHBondContact O-N 3.38Å; V132-F187 HydrophobicContact CG2-CD1 4.19Å; V132-F187 HydrophobicContact CG2-CE1 3.49Å; V132-F187 VanDerWaalsContact CG2-CE1 3.49Å; V132-F187 HydrophobicContact CG2-CZ 3.75Å
133	G	54.8	Low	59.7	Low	31 Å²	31	93.4 Å²	93.4	32%	0.32	49%	0.485	S	S	.	.	H	α-helix	trans	-70.3	-33	-177.5	0	0	0	0	0	114.1	R129 R135 S136 L137	R129-G133 PolarHBondContact O-N 3.4Å; G133-R135 VanDerWaalsContact C-N 3.26Å; G133-R135 PolarHBondContact O-N 2.92Å; G133-S136 PolarHBondContact O-N 2.92Å; G133-S136 VanDerWaalsContact O-N 3.14Å; G133-L137 PolarHBondContact O-N 2.81Å; G133-L137 VanDerWaalsContact O-N 3.07Å
134	G	48.7	Very low	56.9	Low	37 Å²	37	99 Å²	99	38%	0.381	53%	0.525	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-20.4	-176.2	0	0	0	0	0	115.2	D130	D130-G134 PolarHBondContact O-N 3.08Å
135	R	46.7	Very low	54.2	Low	216 Å²	216	104 Å²	104	82%	0.815	57%	0.566	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.3	-11.7	175.8	-73.9	-173.7	-176.2	171.2	3.7	114.4	G133	G133-R135 VanDerWaalsContact C-N 3.26Å; G133-R135 PolarHBondContact O-N 2.92Å
136	S	36.5	Very low	51.6	Low	85 Å²	85	103.3 Å²	103.3	59%	0.594	58%	0.581	S	S	*	*	T	Hydrogen-bonded Turn	trans	-128.5	-19.9	-172	-126.8	0	0	0	0	115.2	G133 H138	G133-S136 PolarHBondContact O-N 2.92Å; G133-S136 VanDerWaalsContact O-N 3.14Å; S136-H138 PolarHBondContact O-N 2.93Å
137	L	39	Very low	49.3	Very low	153 Å²	153	106.4 Å²	106.4	80%	0.801	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.2	-8.3	-175.2	-130.3	79.9	0	0	0	115.4	G133	G133-L137 PolarHBondContact O-N 2.81Å; G133-L137 VanDerWaalsContact O-N 3.07Å
138	H	38.5	Very low	46.7	Very low	191 Å²	191	118 Å²	118	88%	0.884	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.1	9.6	179.8	-124.2	-73.1	0	0	0	114.6	S136	S136-H138 PolarHBondContact O-N 2.93Å
139	K	33.5	Very low	44.5	Very low	199 Å²	199	127 Å²	127	87%	0.865	70%	0.695	S	S	*	*	S	Bend	trans	-136.7	14.1	-177.2	-133.9	179	-174.2	-180	0	116.4	S141	K139-S141 PolarHBondContact O-N 2.88Å
140	V	33.9	Very low	42.1	Very low	100 Å²	100	125.7 Å²	125.7	61%	0.606	70%	0.703	S	S	*	*			trans	-95.3	92.7	169.9	-176.5	0	0	0	0	109	Y142	V140-Y142 PolarHBondContact O-N 2.77Å
141	S	30.4	Very low	40.6	Very low	103 Å²	103	130.3 Å²	130.3	72%	0.72	72%	0.722	S	S	*	*			trans	-60.4	109.2	160.6	172.7	0	0	0	0	108	K139 C143	K139-S141 PolarHBondContact O-N 2.88Å; S141-C143 PolarHBondContact O-N 2.88Å
142	Y	37.8	Very low	38.7	Very low	206 Å²	206	132.5 Å²	132.5	81%	0.808	74%	0.739	S	S	*	*	P	Polyproline II helix	trans	-65.8	117.2	162.2	-76.1	-86.8	0	0	0	107.3	V140 S144	V140-Y142 PolarHBondContact O-N 2.77Å; Y142-S144 PolarHBondContact O-N 3.47Å; Y142-S144 VanDerWaalsContact O-N 3.14Å
143	C	35.3	Very low	37.3	Very low	124 Å²	124	136.5 Å²	136.5	84%	0.838	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-58.3	116.2	170.6	-66.5	0	0	0	0	109.4	S141 A145	S141-C143 PolarHBondContact O-N 2.88Å; C143-A145 PolarHBondContact O-N 2.92Å
144	S	34.4	Very low	35.9	Very low	125 Å²	125	144.5 Å²	144.5	87%	0.874	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-66.6	123.6	174.8	-59.8	0	0	0	0	111.5	Y142	Y142-S144 PolarHBondContact O-N 3.47Å; Y142-S144 VanDerWaalsContact O-N 3.14Å
145	A	37.5	Very low	35.1	Very low	103 Å²	103	151.9 Å²	151.9	85%	0.851	81%	0.812	S	S	*	*			trans	-127.3	99.1	154	0	0	0	0	0	108.7	C143	C143-A145 PolarHBondContact O-N 2.92Å
146	G	35.8	Very low	34.2	Very low	74 Å²	74	150 Å²	150	76%	0.763	81%	0.813	S	S	*	*			trans	61.9	97.8	147.5	0	0	0	0	0	119.4
147	S	40.4	Very low	33.6	Very low	125 Å²	125	152.1 Å²	152.1	87%	0.874	82%	0.822	S	S	*	*				176.8	131	106.9	54.4	0	0	0	0	110.8
148	R	34.3	Very low	33	Very low	246 Å²	246	152.6 Å²	152.6	93%	0.928	83%	0.825	S	S	*	*			trans	-68.3	135.1	174.4	-71.8	171.4	174.1	141.2	-2.6	110.6
149	Q	38.8	Very low	32.5	Very low	194 Å²	194	148.4 Å²	148.4	91%	0.907	82%	0.817	S	S	*	*			trans	-150.1	120.1	136.6	-106.7	172.5	7.1	0	0	108.8
150	T	31.7	Very low	32.6	Very low	121 Å²	121	144.8 Å²	144.8	74%	0.742	81%	0.814	S	S	*	*			trans	-76.9	136.9	170.8	39.4	0	0	0	0	109.7
151	E	34	Very low	33.1	Very low	178 Å²	178	148.2 Å²	148.2	83%	0.832	82%	0.824	S	S	*	*				165	133.6	117	-91.6	175.8	170.1	0	0	111.4
152	S	28.3	Very low	33.8	Very low	95 Å²	95	148.9 Å²	148.9	66%	0.664	82%	0.817	S	S	*	*			trans	33.5	110.4	153	58.8	0	0	0	0	119
153	D	32.5	Very low	34.7	Very low	160 Å²	160	140.8 Å²	140.8	86%	0.856	79%	0.79	S	S	*	*				-162.3	138.3	113.6	-87.3	-28.1	0	0	0	110.7	E155	D153-E155 PolarHBondContact O-N 2.99Å
154	Q	27.1	Very low	36.6	Very low	200 Å²	200	136.5 Å²	136.5	94%	0.935	76%	0.759	S	S	*	*			trans	-69.1	113.3	175.6	-69.2	171.4	-33.1	0	0	109
155	E	30.5	Very low	39.2	Very low	191 Å²	191	131.2 Å²	131.2	89%	0.893	72%	0.721	S	S	*	*			trans	-130.7	112.3	163.1	-140.7	167.9	-164.5	0	0	110	D153 T157	D153-E155 PolarHBondContact O-N 2.99Å; E155-T157 PolarHBondContact O-N 3.09Å
156	Q	27.7	Very low	41.8	Very low	178 Å²	178	126.7 Å²	126.7	83%	0.832	68%	0.683	S	S	*	*			trans	-57.1	116.2	177.9	-87.1	162.8	-31.2	0	0	110.8	N158	Q156-N158 PolarHBondContact O-N 3.48Å; Q156-N158 VanDerWaalsContact O-N 3.16Å
157	T	24.1	Very low	44.6	Very low	129 Å²	129	123.2 Å²	123.2	79%	0.791	65%	0.647	S	S	*	*			trans	6.8	90.6	142.7	52.4	0	0	0	0	116.6	E155	E155-T157 PolarHBondContact O-N 3.09Å
158	N	27.5	Very low	47.3	Very low	162 Å²	162	117.2 Å²	117.2	87%	0.866	61%	0.605	S	S	*	*			trans	-111.3	83.6	151	-79.5	-28.1	0	0	0	107.5	Q156	Q156-N158 PolarHBondContact O-N 3.48Å; Q156-N158 VanDerWaalsContact O-N 3.16Å
159	S	27.2	Very low	50.3	Low	103 Å²	103	105.6 Å²	105.6	72%	0.72	56%	0.561	S	S	*	*			trans	-58.4	130.5	166.2	42.1	0	0	0	0	108.7	E161	S159-E161 PolarHBondContact O-N 2.92Å; S159-E161 VanDerWaalsContact O-N 3.16Å
160	P	36.2	Very low	53	Low	123 Å²	123	96.3 Å²	96.3	80%	0.799	52%	0.518	S	S	*	.			trans	-62.8	120.9	-175	25.5	-31.4	0	0	0	109.1	M162	P160-M162 PolarHBondContact O-N 3.2Å
161	E	43.4	Very low	56.1	Low	172 Å²	172	90.6 Å²	90.6	80%	0.804	48%	0.482	S	S	*	.			trans	-56.1	101.6	177.2	-69.9	179.5	162.4	0	0	109.4	S159 S163	S159-E161 PolarHBondContact O-N 2.92Å; S159-E161 VanDerWaalsContact O-N 3.16Å; E161-S163 PolarHBondContact O-N 2.97Å
162	M	46.4	Very low	58.7	Low	118 Å²	118	82.2 Å²	82.2	58%	0.581	44%	0.444	S	S	*	.			trans	-59.7	109.4	172	-96.4	171.1	49.6	0	0	108.7	P160 N164	P160-M162 PolarHBondContact O-N 3.2Å; M162-N164 PolarHBondContact O-N 3.03Å
163	S	55.1	Low	61.6	Low	35 Å²	35	78.2 Å²	78.2	25%	0.245	42%	0.416	C	S	.	.			trans	-70.9	101.9	173.8	73.1	0	0	0	0	109.7	D130 E161 I165	D130-S163 PolarHBondContact OD2-OG 2.87Å; E161-S163 PolarHBondContact O-N 2.97Å; S163-I165 PolarHBondContact O-N 2.97Å; S163-I165 VanDerWaalsContact O-N 3.12Å
164	N	75.4	Confident	64.4	Low	35 Å²	35	71 Å²	71	19%	0.187	38%	0.378	C	S	.	.			trans	-82.9	81.5	176.2	-72.5	-33.2	0	0	0	109.9	Q55 M162 V166	Q55-N164 PolarHBondContact N-O 3.33Å; M162-N164 PolarHBondContact O-N 3.03Å; N164-V166 WeakPolarHBondContact O-CG1 3.22Å; N164-V166 PolarHBondContact O-N 3Å; N164-V166 VanDerWaalsContact O-N 3.12Å
165	I	89	Confident	67.4	Low	13 Å²	13	62.7 Å²	62.7	7%	0.067	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	110	173.8	-62.5	-68.7	0	0	0	109.4	Q55 L127 V131 S163 V168	Q55-I165 HydrophobicContact CB-CD1 3.82Å; Q55-I165 CarbonylContact O-C 3.57Å; Q55-I165 VanDerWaalsContact O-CA 3.27Å; Q55-I165 WeakPolarHBondContact O-CA 3.1Å; L127-I165 HydrophobicContact CD2-CD1 4.09Å; L127-I165 WeakPolarHBondContact O-CG1 3.05Å; V131-I165 HydrophobicContact CG2-CB 4.46Å; S163-I165 PolarHBondContact O-N 2.97Å; S163-I165 VanDerWaalsContact O-N 3.12Å; I165-V168 HydrophobicContact CG2-CG2 4.07Å
166	V	92.6	Very high	70.3	Confident	9 Å²	9	53.8 Å²	53.8	6%	0.055	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	-30.5	-176.5	-59	0	0	0	0	113.2	L54 Q55 I56 N164 P190 L456 V479 L484	L54-V166 HydrophobicContact CB-CG1 4.16Å; L54-V166 HydrophobicContact CD2-CG1 4.07Å; Q55-V166 PolarHBondContact O-N 3.45Å; I56-V166 HydrophobicContact CG1-CG2 4.35Å; N164-V166 WeakPolarHBondContact O-CG1 3.22Å; N164-V166 PolarHBondContact O-N 3Å; N164-V166 VanDerWaalsContact O-N 3.12Å; V166-P190 WeakPolarHBondContact O-CD 3.22Å; V166-L456 HydrophobicContact CG2-CD1 4.03Å; V166-L456 HydrophobicContact CG2-CD2 4.36Å; V166-V479 HydrophobicContact CG1-CB 4.05Å; V166-V479 HydrophobicContact CG1-CG2 3.7Å; V166-L484 HydrophobicContact CB-CD2 4.24Å; V166-L484 WeakPolarHBondContact O-CD2 3.49Å
167	A	95.3	Very high	73.5	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156	157.9	179	0	0	0	0	0	110	G57 P190 V452	G57-A167 PolarHBondContact N-O 3.28Å; A167-P190 WeakPolarHBondContact CA-O 3.44Å; A167-V452 HydrophobicContact CB-CG1 4.02Å; A167-V452 HydrophobicContact CB-CG2 4.1Å
168	V	96.7	Very high	76.9	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	131.5	175.2	178.1	0	0	0	0	110.7	G57 L59 I165 L184 I189 P190 Q191 V192	G57-V168 CarbonylContact O-C 3.56Å; G57-V168 VanDerWaalsContact O-CA 3.25Å; G57-V168 WeakPolarHBondContact O-CA 3.25Å; L59-V168 HydrophobicContact CD1-CG1 4.42Å; I165-V168 HydrophobicContact CG2-CG2 4.07Å; V168-L184 HydrophobicContact CB-CD1 3.69Å; V168-L184 HydrophobicContact CG1-CD1 4.09Å; V168-L184 HydrophobicContact CG2-CD1 3.9Å; V168-L184 HydrophobicContact CG2-CD2 3.87Å; V168-I189 HydrophobicContact CG2-CG2 4.07Å; V168-P190 PolarHBondContact N-O 2.75Å; V168-Q191 CarbonylContact O-C 3.58Å; V168-Q191 VanDerWaalsContact O-CA 3.25Å; V168-Q191 WeakPolarHBondContact O-CA 3.15Å; V168-V192 PolarHBondContact O-N 3.01Å
169	I	97.7	Very high	80.1	Confident	1 Å²	1	33.3 Å²	33.3	1%	0.005	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	132.7	176.1	-62.8	177	0	0	0	109.7	I56 G57 V58 L59 V192 Y194 S448 I449 V452	I56-I169 HydrophobicContact CG2-CD1 3.69Å; I56-I169 HydrophobicContact CG2-CG1 3.88Å; G57-I169 PolarHBondContact O-N 3.4Å; V58-I169 WeakPolarHBondContact CA-O 3.27Å; V58-I169 HydrophobicContact CG1-CB 4.43Å; V58-I169 HydrophobicContact CG2-CB 4.22Å; L59-I169 PolarHBondContact N-O 3.39Å; I169-V192 WeakPolarHBondContact CA-O 3.15Å; I169-V192 HydrophobicContact CG1-CB 4.4Å; I169-Y194 HydrophobicContact CG2-CD1 3.81Å; I169-Y194 HydrophobicContact CG2-CE1 4.38Å; I169-S448 VanDerWaalsContact CG2-OG 3.28Å; I169-S448 WeakPolarHBondContact CG2-OG 3.32Å; I169-I449 HydrophobicContact CD1-CB 4.25Å; I169-I449 HydrophobicContact CD1-CG1 3.51Å; I169-V452 HydrophobicContact CD1-CG2 4.44Å
170	G	95.2	Very high	83.4	Confident	0 Å²	0	28.4 Å²	28.4	0%	0	16%	0.159	C	C	.	.			trans	87.2	-171.3	-174.4	0	0	0	0	0	113.2	Q191 V192	G170-Q191 WeakPolarHBondContact O-CG 3.43Å; G170-Q191 PolarHBondContact O-NE2 2.8Å; G170-V192 PolarHBondContact N-O 2.89Å
171	P	95.2	Very high	86.2	Confident	0 Å²	0	22.6 Å²	22.6	0%	0	12%	0.121	C	C	.	.			cis	-76.5	-176.5	2.2	31.7	-35.7	0	0	0	114	L59 D113 V176 S177 V180	L59-P171 HydrophobicContact CB-CB 4.12Å; D113-P171 HydrophobicContact CB-CB 4.44Å; D113-P171 WeakPolarHBondContact OD2-CB 3.25Å; P171-V176 HydrophobicContact CB-CB 4.34Å; P171-V176 HydrophobicContact CB-CG1 3.93Å; P171-V176 HydrophobicContact CG-CB 3.77Å; P171-V176 HydrophobicContact CG-CG1 3.47Å; P171-V176 VanDerWaalsContact CG-CG1 3.47Å; P171-S177 WeakPolarHBondContact CD-OG 3.08Å; P171-S177 WeakPolarHBondContact CG-OG 3.36Å; P171-S177 PolarHBondContact O-OG 3.15Å; P171-V180 HydrophobicContact CG-CG2 4.12Å
172	G	89	Confident	88.7	Confident	2 Å²	2	17.6 Å²	17.6	2%	0.021	10%	0.099	C	C	.	.	S	Bend	trans	-84.4	-22.2	-174.8	0	0	0	0	0	115.6	Y194 S195	G172-Y194 WeakPolarHBondContact CA-OH 3.31Å; G172-Y194 PolarHBondContact N-OH 3.3Å; G172-Y194 VanDerWaalsContact N-OH 3.14Å; G172-S195 CarbonylContact O-C 3.54Å; G172-S195 WeakPolarHBondContact O-CB 3.16Å; G172-S195 PolarHBondContact O-OG 3.1Å
173	S	89.4	Confident	90.9	Very high	12 Å²	12	13.5 Å²	13.5	8%	0.084	8%	0.08	C	C	.	.	S	Bend	trans	-95.3	139.5	-179.8	172.7	0	0	0	0	111.3	V176 S177	S173-V176 PolarHBondContact O-N 2.83Å; S173-S177 WeakPolarHBondContact O-CB 3.21Å; S173-S177 PolarHBondContact O-N 2.77Å; S173-S177 PolarHBondContact O-OG 3.34Å; S173-S177 VanDerWaalsContact O-OG 3.07Å
174	S	91.8	Very high	92.8	Very high	9 Å²	9	11.9 Å²	11.9	6%	0.063	7%	0.068	C	C	.	.	H	α-helix	trans	-59.8	-47.1	177.9	-66.3	0	0	0	0	112.8	V176 S177 I178 T197 T198	S174-V176 PolarHBondContact O-N 3.07Å; S174-S177 PolarHBondContact O-N 2.95Å; S174-I178 WeakPolarHBondContact O-CG1 3.46Å; S174-I178 PolarHBondContact O-N 3.47Å; S174-T197 PolarHBondContact OG-N 2.94Å; S174-T198 PolarHBondContact OG-N 3.34Å
175	D	89.2	Confident	93.6	Very high	24 Å²	24	12.5 Å²	12.5	13%	0.128	7%	0.07	C	C	.	.	H	α-helix	trans	-66.3	-39.2	-179.1	-62.8	-57.5	0	0	0	111.7	I178 A179 N244	D175-I178 PolarHBondContact O-N 3.36Å; D175-A179 PolarHBondContact O-N 3.44Å; D175-A179 VanDerWaalsContact O-N 3.16Å; D175-N244 VanDerWaalsContact OD1-CB 3.23Å; D175-N244 WeakPolarHBondContact OD1-CB 3.46Å; D175-N244 PolarHBondContact OD1-N 3.5Å; D175-N244 PolarHBondContact OD1-ND2 2.85Å
176	V	92.4	Very high	93.7	Very high	4 Å²	4	16.6 Å²	16.6	2%	0.024	10%	0.095	C	C	.	.	H	α-helix	trans	-67.5	-39	176.1	-169.7	0	0	0	0	110.6	E117 A120 P171 S173 S174 A179 V180	E117-V176 HydrophobicContact CG-CG2 4.08Å; A120-V176 HydrophobicContact CB-CG1 3.21Å; P171-V176 HydrophobicContact CB-CB 4.34Å; P171-V176 HydrophobicContact CB-CG1 3.93Å; P171-V176 HydrophobicContact CG-CB 3.77Å; P171-V176 HydrophobicContact CG-CG1 3.47Å; P171-V176 VanDerWaalsContact CG-CG1 3.47Å; S173-V176 PolarHBondContact O-N 2.83Å; S174-V176 PolarHBondContact O-N 3.07Å; V176-A179 PolarHBondContact O-N 2.96Å; V176-V180 WeakPolarHBondContact O-CG2 3.43Å; V176-V180 PolarHBondContact O-N 2.89Å
177	S	95.5	Very high	93.6	Very high	0 Å²	0	20 Å²	20	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-65.5	-38.3	176.7	-71.2	0	0	0	0	112.8	P171 S173 S174 V180 Q181	P171-S177 WeakPolarHBondContact CD-OG 3.08Å; P171-S177 WeakPolarHBondContact CG-OG 3.36Å; P171-S177 PolarHBondContact O-OG 3.15Å; S173-S177 WeakPolarHBondContact O-CB 3.21Å; S173-S177 PolarHBondContact O-N 2.77Å; S173-S177 PolarHBondContact O-OG 3.34Å; S173-S177 VanDerWaalsContact O-OG 3.07Å; S174-S177 PolarHBondContact O-N 2.95Å; S177-V180 PolarHBondContact O-N 3.25Å; S177-Q181 VanDerWaalsContact O-CB 3.28Å; S177-Q181 WeakPolarHBondContact O-CB 3.4Å; S177-Q181 PolarHBondContact O-N 2.83Å
178	I	94.7	Very high	93.5	Very high	20 Å²	20	24.4 Å²	24.4	10%	0.103	13%	0.13	C	C	.	.	H	α-helix	trans	-60.7	-46.9	173.4	-71.4	167.3	0	0	0	110.2	S174 D175 V180 Q181 N182 T198 A200 L201 F207 N244	S174-I178 WeakPolarHBondContact O-CG1 3.46Å; S174-I178 PolarHBondContact O-N 3.47Å; D175-I178 PolarHBondContact O-N 3.36Å; I178-V180 PolarHBondContact O-N 2.03Å; I178-Q181 PolarHBondContact O-N 3.29Å; I178-N182 PolarHBondContact O-N 2.76Å; I178-N182 VanDerWaalsContact O-N 3.08Å; I178-N182 PolarHBondContact O-ND2 3.1Å; I178-T198 HydrophobicContact CD1-CG2 4.22Å; I178-A200 HydrophobicContact CD1-CB 4.36Å; I178-L201 HydrophobicContact CG1-CD1 4.41Å; I178-L201 HydrophobicContact CG1-CD2 3.65Å; I178-L201 HydrophobicContact CG1-CG 3.98Å; I178-F207 HydrophobicContact CG1-CZ 4.2Å; I178-F207 HydrophobicContact CG2-CE1 3.98Å; I178-F207 HydrophobicContact CG2-CZ 3.86Å; I178-N244 HydrophobicContact CD1-CB 3.93Å
179	A	94.4	Very high	93.3	Very high	20 Å²	20	24.9 Å²	24.9	17%	0.165	13%	0.132	C	C	.	.	H	α-helix	trans	-59.3	-48.5	178.1	0	0	0	0	0	111.7	E117 M121 D175 V176 N182	E117-A179 HydrophobicContact CB-CB 4.4Å; E117-A179 HydrophobicContact CG-CB 4.3Å; M121-A179 HydrophobicContact CG-CB 4.17Å; M121-A179 HydrophobicContact SD-CB 4.11Å; D175-A179 PolarHBondContact O-N 3.44Å; D175-A179 VanDerWaalsContact O-N 3.16Å; V176-A179 PolarHBondContact O-N 2.96Å; A179-N182 PolarHBondContact O-N 3.44Å
180	V	96	Very high	93.3	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-62.5	-44.7	178.8	170.1	0	0	0	0	111.6	L59 A120 T124 P171 V176 S177 I178 N182 L183 L184	L59-V180 HydrophobicContact CD1-CG1 4.05Å; L59-V180 HydrophobicContact CD1-CG2 3.87Å; A120-V180 HydrophobicContact CB-CG2 3.98Å; T124-V180 HydrophobicContact CG2-CG1 4.15Å; P171-V180 HydrophobicContact CG-CG2 4.12Å; V176-V180 WeakPolarHBondContact O-CG2 3.43Å; V176-V180 PolarHBondContact O-N 2.89Å; S177-V180 PolarHBondContact O-N 3.25Å; I178-V180 PolarHBondContact O-N 2.03Å; V180-N182 VanDerWaalsContact C-N 3.3Å; V180-N182 PolarHBondContact O-N 3.33Å; V180-L183 PolarHBondContact O-N 2.88Å; V180-L183 VanDerWaalsContact O-N 3.1Å; V180-L184 HydrophobicContact CG1-CD1 3.59Å; V180-L184 HydrophobicContact CG1-CG 4.02Å; V180-L184 WeakPolarHBondContact O-CG 3.23Å; V180-L184 PolarHBondContact O-N 3.15Å
181	Q	95.8	Very high	93.4	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-62	-38.1	-179.7	-178.2	54.8	20.9	0	0	112.3	S177 I178 L183 L184 Q185 Q191 F207	S177-Q181 VanDerWaalsContact O-CB 3.28Å; S177-Q181 WeakPolarHBondContact O-CB 3.4Å; S177-Q181 PolarHBondContact O-N 2.83Å; I178-Q181 PolarHBondContact O-N 3.29Å; Q181-L183 PolarHBondContact O-N 3.41Å; Q181-L184 PolarHBondContact O-N 2.94Å; Q181-Q185 WeakPolarHBondContact O-CB 3.45Å; Q181-Q185 VanDerWaalsContact O-CG 3.27Å; Q181-Q185 WeakPolarHBondContact O-CG 3.34Å; Q181-Q185 PolarHBondContact O-N 3.47Å; Q181-Q191 VanDerWaalsContact CB-OE1 3.22Å; Q181-Q191 VanDerWaalsContact OE1-CB 3.25Å; Q181-F207 HydrophobicContact CB-CD1 4.17Å; Q181-F207 HydrophobicContact CG-CB 4.14Å; Q181-F207 HydrophobicContact CG-CD1 3.64Å; Q181-F207 HydrophobicContact CG-CG 4.31Å
182	N	94.8	Very high	93.5	Very high	67 Å²	67	24.8 Å²	24.8	36%	0.358	13%	0.132	S	C	.	.	H	α-helix	trans	-59.2	-28.8	177.5	-79.2	-28.8	0	0	0	112.7	I178 A179 V180 Q185	I178-N182 PolarHBondContact O-N 2.76Å; I178-N182 VanDerWaalsContact O-N 3.08Å; I178-N182 PolarHBondContact O-ND2 3.1Å; A179-N182 PolarHBondContact O-N 3.44Å; V180-N182 VanDerWaalsContact C-N 3.3Å; V180-N182 PolarHBondContact O-N 3.33Å; N182-Q185 PolarHBondContact OD1-NE2 3Å
183	L	93.8	Very high	93.9	Very high	33 Å²	33	24.7 Å²	24.7	17%	0.173	13%	0.131	C	C	.	.	H	α-helix	trans	-84.7	-48.5	173.3	-179.3	58.9	0	0	0	112.2	M121 T124 I125 I128 V180 Q181 Q185 V186 F187	M121-L183 HydrophobicContact CE-CB 3.92Å; M121-L183 HydrophobicContact CE-CD2 3.97Å; M121-L183 HydrophobicContact CE-CG 4.5Å; M121-L183 HydrophobicContact SD-CB 4.33Å; M121-L183 HydrophobicContact SD-CD2 4.45Å; T124-L183 HydrophobicContact CG2-CD2 3.74Å; T124-L183 HydrophobicContact CG2-CG 4.35Å; I125-L183 HydrophobicContact CG1-CD2 3.71Å; I128-L183 HydrophobicContact CD1-CD1 4.14Å; I128-L183 HydrophobicContact CD1-CD2 3.91Å; I128-L183 HydrophobicContact CD1-CG 3.9Å; V180-L183 PolarHBondContact O-N 2.88Å; V180-L183 VanDerWaalsContact O-N 3.1Å; Q181-L183 PolarHBondContact O-N 3.41Å; L183-Q185 VanDerWaalsContact C-N 3.29Å; L183-Q185 PolarHBondContact O-N 3.43Å; L183-V186 WeakPolarHBondContact O-CB 3.4Å; L183-V186 PolarHBondContact O-N 2.77Å; L183-F187 HydrophobicContact CD1-CE2 3.94Å
184	L	94	Very high	94.1	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-62	-35.4	-175.3	-69.2	178.8	0	0	0	113.2	T124 I128 V168 V180 Q181 V186 F187 H188 I189 Q191	T124-L184 HydrophobicContact CG2-CD2 3.71Å; T124-L184 HydrophobicContact CG2-CG 4.1Å; I128-L184 HydrophobicContact CG2-CD2 4.07Å; V168-L184 HydrophobicContact CB-CD1 3.69Å; V168-L184 HydrophobicContact CG1-CD1 4.09Å; V168-L184 HydrophobicContact CG2-CD1 3.9Å; V168-L184 HydrophobicContact CG2-CD2 3.87Å; V180-L184 HydrophobicContact CG1-CD1 3.59Å; V180-L184 HydrophobicContact CG1-CG 4.02Å; V180-L184 WeakPolarHBondContact O-CG 3.23Å; V180-L184 PolarHBondContact O-N 3.15Å; Q181-L184 PolarHBondContact O-N 2.94Å; L184-V186 PolarHBondContact O-N 2.78Å; L184-F187 CarbonylContact O-C 3.54Å; L184-F187 PolarHBondContact O-N 3.32Å; L184-F187 VanDerWaalsContact O-N 3.08Å; L184-H188 PolarHBondContact O-N 3.12Å; L184-I189 HydrophobicContact CB-CB 4.33Å; L184-I189 HydrophobicContact CD2-CB 4.13Å; L184-I189 HydrophobicContact CD2-CD1 4.3Å; L184-I189 HydrophobicContact CD2-CG2 4.14Å; L184-I189 PolarHBondContact O-N 2.95Å; L184-Q191 HydrophobicContact CD1-CB 3.96Å; L184-Q191 HydrophobicContact CD1-CG 4.16Å
185	Q	92.8	Very high	94.2	Very high	48 Å²	48	24.2 Å²	24.2	22%	0.224	13%	0.128	C	C	.	.	G	3₁₀ helix	trans	-63.9	-28.8	179.9	69.7	-172.1	0.8	0	0	113.7	Q181 N182 L183 F187 H188 E206 Y209	Q181-Q185 WeakPolarHBondContact O-CB 3.45Å; Q181-Q185 VanDerWaalsContact O-CG 3.27Å; Q181-Q185 WeakPolarHBondContact O-CG 3.34Å; Q181-Q185 PolarHBondContact O-N 3.47Å; N182-Q185 PolarHBondContact OD1-NE2 3Å; L183-Q185 VanDerWaalsContact C-N 3.29Å; L183-Q185 PolarHBondContact O-N 3.43Å; Q185-F187 PolarHBondContact O-N 3.19Å; Q185-H188 PolarHBondContact O-N 3.49Å; Q185-H188 VanDerWaalsContact O-N 3.16Å; Q185-E206 PolarHBondContact OE1-O 2.85Å; Q185-Y209 HydrophobicContact CB-CD2 4.01Å
186	V	91.7	Very high	94.3	Very high	99 Å²	99	23 Å²	23	60%	0.6	12%	0.121	S	C	*	.	G	3₁₀ helix	trans	-63.5	-32.6	176.1	-179.9	0	0	0	0	110.7	L183 L184	L183-V186 WeakPolarHBondContact O-CB 3.4Å; L183-V186 PolarHBondContact O-N 2.77Å; L184-V186 PolarHBondContact O-N 2.78Å
187	F	90.3	Very high	94.4	Very high	80 Å²	80	23 Å²	23	35%	0.351	12%	0.121	S	C	.	.	G	3₁₀ helix	trans	-97.9	7.3	178.8	-60.7	-75.2	0	0	0	113.2	I128 V132 L183 L184 Q185 I189	I128-F187 HydrophobicContact CD1-CD2 3.73Å; I128-F187 HydrophobicContact CD1-CE2 3.52Å; I128-F187 HydrophobicContact CD1-CZ 4.34Å; V132-F187 HydrophobicContact CG2-CD1 4.19Å; V132-F187 HydrophobicContact CG2-CE1 3.49Å; V132-F187 VanDerWaalsContact CG2-CE1 3.49Å; V132-F187 HydrophobicContact CG2-CZ 3.75Å; L183-F187 HydrophobicContact CD1-CE2 3.94Å; L184-F187 CarbonylContact O-C 3.54Å; L184-F187 PolarHBondContact O-N 3.32Å; L184-F187 VanDerWaalsContact O-N 3.08Å; Q185-F187 PolarHBondContact O-N 3.19Å; F187-I189 HydrophobicContact CB-CD1 3.95Å; F187-I189 HydrophobicContact CB-CG1 4.01Å; F187-I189 PolarHBondContact O-N 3.47Å
188	H	92.5	Very high	94.3	Very high	94 Å²	94	23 Å²	23	44%	0.435	12%	0.121	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.7	34.1	-175.2	-52.4	137.1	0	0	0	113.7	L184 Q185 P190 Y209 G481	L184-H188 PolarHBondContact O-N 3.12Å; Q185-H188 PolarHBondContact O-N 3.49Å; Q185-H188 VanDerWaalsContact O-N 3.16Å; H188-P190 WeakPolarHBondContact O-CD 3.36Å; H188-Y209 HydrophobicContact CB-CE1 4.39Å; H188-Y209 HydrophobicContact CB-CE2 4.34Å; H188-Y209 AromaticContact CD2-CE2 3.52Å; H188-Y209 AromaticContact CD2-CZ 3.55Å; H188-Y209 PolarHBondContact CD2-OH 3.01Å; H188-G481 CarbonylContact O-C 3.45Å; H188-G481 VanDerWaalsContact O-CA 3.27Å; H188-G481 WeakPolarHBondContact O-CA 3.44Å
189	I	93.7	Very high	94.2	Very high	9 Å²	9	25.2 Å²	25.2	5%	0.046	13%	0.13	C	C	.	.			trans	-91.3	120.6	179	-61.4	174	0	0	0	109.2	I128 V168 L184 F187	I128-I189 HydrophobicContact CG2-CD1 3.61Å; V168-I189 HydrophobicContact CG2-CG2 4.07Å; L184-I189 HydrophobicContact CB-CB 4.33Å; L184-I189 HydrophobicContact CD2-CB 4.13Å; L184-I189 HydrophobicContact CD2-CD1 4.3Å; L184-I189 HydrophobicContact CD2-CG2 4.14Å; L184-I189 PolarHBondContact O-N 2.95Å; F187-I189 HydrophobicContact CB-CD1 3.95Å; F187-I189 HydrophobicContact CB-CG1 4.01Å; F187-I189 PolarHBondContact O-N 3.47Å
190	P	96.7	Very high	94.1	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	13%	0.13	C	C	.	.			trans	-63.4	137.8	175	-24.4	36.5	0	0	0	113	V166 A167 V168 H188 Y209 G481 L484 F485 M488	V166-P190 WeakPolarHBondContact O-CD 3.22Å; A167-P190 WeakPolarHBondContact CA-O 3.44Å; V168-P190 PolarHBondContact N-O 2.75Å; H188-P190 WeakPolarHBondContact O-CD 3.36Å; P190-Y209 WeakPolarHBondContact CA-O 3.44Å; P190-G481 VanDerWaalsContact CG-O 3.31Å; P190-G481 WeakPolarHBondContact CG-O 3.24Å; P190-L484 HydrophobicContact CG-CB 4.48Å; P190-L484 HydrophobicContact CG-CD2 4.33Å; P190-L484 HydrophobicContact CG-CG 4.43Å; P190-F485 HydrophobicContact CB-CD2 4.2Å; P190-F485 HydrophobicContact CG-CB 4.16Å; P190-M488 HydrophobicContact CB-CE 4.12Å; P190-M488 HydrophobicContact CB-SD 3.66Å; P190-M488 HydrophobicContact CG-SD 4.12Å
191	Q	97.4	Very high	94	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	133.1	173.3	-172.4	-172.7	-14.9	0	0	110.9	V168 G170 Q181 L184 Y209 Y210 M211	V168-Q191 CarbonylContact O-C 3.58Å; V168-Q191 VanDerWaalsContact O-CA 3.25Å; V168-Q191 WeakPolarHBondContact O-CA 3.15Å; G170-Q191 WeakPolarHBondContact O-CG 3.43Å; G170-Q191 PolarHBondContact O-NE2 2.8Å; Q181-Q191 VanDerWaalsContact CB-OE1 3.22Å; Q181-Q191 VanDerWaalsContact OE1-CB 3.25Å; L184-Q191 HydrophobicContact CD1-CB 3.96Å; L184-Q191 HydrophobicContact CD1-CG 4.16Å; Q191-Y209 PolarHBondContact N-O 3.3Å; Q191-Y210 HydrophobicContact CB-CD2 4.09Å; Q191-Y210 HydrophobicContact CG-CD2 4.05Å; Q191-Y210 HydrophobicContact CG-CE2 4.21Å; Q191-M211 PolarHBondContact O-N 2.9Å
192	V	97.8	Very high	93.9	Very high	0 Å²	0	26 Å²	26	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	109.6	173.5	-171.1	0	0	0	0	110.5	V168 I169 G170 M211 V213 V452 M488	V168-V192 PolarHBondContact O-N 3.01Å; I169-V192 WeakPolarHBondContact CA-O 3.15Å; I169-V192 HydrophobicContact CG1-CB 4.4Å; G170-V192 PolarHBondContact N-O 2.89Å; V192-M211 CarbonylContact C-O 3.59Å; V192-M211 WeakPolarHBondContact CA-O 3.47Å; V192-M211 HydrophobicContact CG1-CG 4.48Å; V192-M211 HydrophobicContact CG2-CG 3.98Å; V192-M211 HydrophobicContact CG2-SD 4.34Å; V192-V213 HydrophobicContact CG1-CG1 4.05Å; V192-V452 HydrophobicContact CG2-CG2 3.91Å; V192-M488 HydrophobicContact CG2-CE 3.15Å
193	G	96.5	Very high	93.9	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	134	174.5	0	0	0	0	0	112.8	M211 R212 V213	G193-M211 PolarHBondContact N-O 3.48Å; G193-R212 WeakPolarHBondContact O-CA 3.48Å; G193-R212 VanDerWaalsContact O-CB 3.26Å; G193-R212 WeakPolarHBondContact O-CB 3.48Å; G193-V213 PolarHBondContact O-N 3.18Å
194	Y	94.8	Very high	93.9	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	14%	0.138	C	C	.	.	S	Bend	trans	-105.2	-12.5	173.7	61	-103.6	0	0	0	113.5	L59 F60 R83 I169 G172 V214 V445	L59-Y194 PolarHBondContact O-OH 3.35Å; F60-Y194 AromaticContact CD1-CE1 3.81Å; F60-Y194 HydrophobicContact CD1-CE1 3.81Å; F60-Y194 AromaticContact CD1-CZ 3.84Å; F60-Y194 HydrophobicContact CE1-CD1 4.26Å; F60-Y194 AromaticContact CE1-CE1 3.59Å; F60-Y194 HydrophobicContact CE1-CE1 3.59Å; F60-Y194 AromaticContact CE1-CZ 3.98Å; R83-Y194 VanDerWaalsContact NH1-CE2 3.26Å; I169-Y194 HydrophobicContact CG2-CD1 3.81Å; I169-Y194 HydrophobicContact CG2-CE1 4.38Å; G172-Y194 WeakPolarHBondContact CA-OH 3.31Å; G172-Y194 PolarHBondContact N-OH 3.3Å; G172-Y194 VanDerWaalsContact N-OH 3.14Å; Y194-V214 WeakPolarHBondContact O-CG1 2.98Å; Y194-V445 HydrophobicContact CG-CG2 4.4Å
195	S	92.5	Very high	93.8	Very high	10 Å²	10	32.9 Å²	32.9	7%	0.07	18%	0.175	C	C	.	.	S	Bend	trans	-147.2	-5.1	-179	-174	0	0	0	0	115.2	G172 T197 K441	G172-S195 CarbonylContact O-C 3.54Å; G172-S195 WeakPolarHBondContact O-CB 3.16Å; G172-S195 PolarHBondContact O-OG 3.1Å; S195-T197 PolarHBondContact O-N 2.95Å; S195-K441 PolarHBondContact OG-NZ 2.91Å
196	A	92.5	Very high	93.8	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	19%	0.187	C	C	.	.			trans	-83	108.9	177.9	0	0	0	0	0	111	L201 Y210 R212	A196-L201 HydrophobicContact CB-CD1 3.89Å; A196-Y210 WeakPolarHBondContact CB-OH 3.25Å; A196-Y210 PolarHBondContact O-OH 2.89Å; A196-R212 VanDerWaalsContact O-CD 3.25Å; A196-R212 WeakPolarHBondContact O-CD 3.34Å; A196-R212 PolarHBondContact O-NH1 2.98Å; A196-R212 VanDerWaalsContact O-NH1 3.14Å
197	T	93.2	Very high	93.9	Very high	3 Å²	3	30.8 Å²	30.8	2%	0.018	16%	0.159	C	C	.	.			trans	-107	-4.9	-169.6	58.3	0	0	0	0	114.3	S174 S195 R212 V214 S216 D217 Y245 I376	S174-T197 PolarHBondContact OG-N 2.94Å; S195-T197 PolarHBondContact O-N 2.95Å; T197-R212 PolarHBondContact O-NH1 2.94Å; T197-V214 HydrophobicContact CG2-CB 4.47Å; T197-V214 HydrophobicContact CG2-CG2 3.94Å; T197-S216 CarbonylContact O-C 3.49Å; T197-S216 WeakPolarHBondContact O-CA 3.27Å; T197-D217 VanDerWaalsContact C-OD2 3.29Å; T197-D217 WeakPolarHBondContact CB-OD1 3.05Å; T197-D217 PolarHBondContact O-N 2.93Å; T197-D217 VanDerWaalsContact OG1-CG 3.31Å; T197-D217 PolarHBondContact OG1-OD1 2.87Å; T197-D217 PolarHBondContact OG1-OD2 3.03Å; T197-Y245 WeakPolarHBondContact OG1-CE2 3.47Å; T197-I376 HydrophobicContact CG2-CD1 4.08Å
198	T	93.6	Very high	94.1	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	17%	0.165	C	C	.	.			trans	-55.1	144.1	-179.8	-174.3	0	0	0	0	112.1	S174 I178 A200 L201 R212 D217 N244	S174-T198 PolarHBondContact OG-N 3.34Å; I178-T198 HydrophobicContact CD1-CG2 4.22Å; T198-A200 VanDerWaalsContact C-N 3.27Å; T198-A200 HydrophobicContact CG2-CB 4.26Å; T198-A200 PolarHBondContact O-N 3.41Å; T198-L201 HydrophobicContact CG2-CB 4.37Å; T198-L201 HydrophobicContact CG2-CD1 3.64Å; T198-L201 HydrophobicContact CG2-CG 3.77Å; T198-R212 PolarHBondContact O-NH1 2.85Å; T198-D217 WeakPolarHBondContact CA-OD2 3.29Å; T198-D217 PolarHBondContact N-OD2 2.91Å; T198-N244 PolarHBondContact OG1-O 3.07Å
199	K	92.7	Very high	94.3	Very high	67 Å²	67	28.3 Å²	28.3	29%	0.291	15%	0.146	S	C	.	.	G	3₁₀ helix	trans	-63	-31.7	175.8	171.6	173.9	-176.7	163.2	0	113	L201 S202 S218 K248 E252	K199-L201 PolarHBondContact O-N 3.03Å; K199-L201 VanDerWaalsContact O-N 3.13Å; K199-S202 WeakPolarHBondContact O-CB 3.45Å; K199-S202 PolarHBondContact O-N 2.78Å; K199-S218 WeakPolarHBondContact CD-OG 3.32Å; K199-K248 HydrophobicContact CB-CB 4.49Å; K199-E252 HydrophobicContact CB-CG 4.36Å; K199-E252 HydrophobicContact CD-CG 3.49Å; K199-E252 VanDerWaalsContact CD-CG 3.49Å; K199-E252 VanDerWaalsContact CD-OE1 3.29Å; K199-E252 WeakPolarHBondContact CD-OE1 3.2Å; K199-E252 WeakPolarHBondContact CD-OE2 3.49Å; K199-E252 WeakPolarHBondContact CE-OE1 3.38Å; K199-E252 IonicContact NZ-OE1 2.72Å; K199-E252 PolarHBondContact NZ-OE1 3.14Å; K199-E252 IonicContact NZ-OE2 3.65Å; K199-E252 PolarHBondContact NZ-OE2 3.18Å
200	A	93.4	Very high	94.4	Very high	20 Å²	20	28 Å²	28	17%	0.165	14%	0.144	C	C	.	.	G	3₁₀ helix	trans	-53.3	-39.5	-174.5	0	0	0	0	0	112.1	I178 T198 S202 D203 F207 K248	I178-A200 HydrophobicContact CD1-CB 4.36Å; T198-A200 VanDerWaalsContact C-N 3.27Å; T198-A200 HydrophobicContact CG2-CB 4.26Å; T198-A200 PolarHBondContact O-N 3.41Å; A200-S202 PolarHBondContact O-N 2.75Å; A200-S202 VanDerWaalsContact O-N 3.16Å; A200-D203 WeakPolarHBondContact O-CB 3.32Å; A200-D203 PolarHBondContact O-N 3.48Å; A200-D203 VanDerWaalsContact O-N 3.1Å; A200-F207 HydrophobicContact CB-CE2 4.38Å; A200-F207 VanDerWaalsContact O-CD2 3.23Å; A200-F207 WeakPolarHBondContact O-CD2 3.47Å; A200-F207 WeakPolarHBondContact O-CE2 3.42Å; A200-K248 HydrophobicContact CB-CG 4.44Å
201	L	94.5	Very high	94.4	Very high	0 Å²	0	28 Å²	28	0%	0	14%	0.144	C	C	.	.	G	3₁₀ helix	trans	-68.4	-11.8	-179.2	-69.1	168.5	0	0	0	114.9	I178 A196 T198 K199 D203 F207 Y210	I178-L201 HydrophobicContact CG1-CD1 4.41Å; I178-L201 HydrophobicContact CG1-CD2 3.65Å; I178-L201 HydrophobicContact CG1-CG 3.98Å; A196-L201 HydrophobicContact CB-CD1 3.89Å; T198-L201 HydrophobicContact CG2-CB 4.37Å; T198-L201 HydrophobicContact CG2-CD1 3.64Å; T198-L201 HydrophobicContact CG2-CG 3.77Å; K199-L201 PolarHBondContact O-N 3.03Å; K199-L201 VanDerWaalsContact O-N 3.13Å; L201-D203 VanDerWaalsContact C-N 3.32Å; L201-F207 HydrophobicContact CD2-CD1 4.29Å; L201-F207 HydrophobicContact CD2-CD2 4.21Å; L201-F207 HydrophobicContact CD2-CE2 4.45Å; L201-F207 HydrophobicContact CD2-CG 4.11Å; L201-Y210 HydrophobicContact CB-CD1 3.68Å; L201-Y210 HydrophobicContact CB-CE1 3.53Å; L201-Y210 HydrophobicContact CB-CG 4.39Å; L201-Y210 HydrophobicContact CD1-CE1 3.89Å; L201-Y210 HydrophobicContact CD1-CE2 4.09Å; L201-Y210 HydrophobicContact CD2-CD1 4.23Å; L201-Y210 HydrophobicContact CD2-CD2 4.1Å; L201-Y210 HydrophobicContact CD2-CE1 4.33Å; L201-Y210 HydrophobicContact CD2-CE2 4.2Å; L201-Y210 HydrophobicContact CD2-CG 4.12Å; L201-Y210 HydrophobicContact CG-CD1 4.37Å; L201-Y210 HydrophobicContact CG-CE1 4.12Å
202	S	93.7	Very high	94.4	Very high	15 Å²	15	28 Å²	28	11%	0.105	14%	0.144	C	C	.	.	G	3₁₀ helix	trans	-78.3	-16.1	173.1	-59.4	0	0	0	0	112.5	K199 A200 K204 R212 D508	K199-S202 WeakPolarHBondContact O-CB 3.45Å; K199-S202 PolarHBondContact O-N 2.78Å; A200-S202 PolarHBondContact O-N 2.75Å; A200-S202 VanDerWaalsContact O-N 3.16Å; S202-K204 PolarHBondContact O-N 3.18Å; S202-R212 PolarHBondContact OG-NH2 3.1Å; S202-D508 WeakPolarHBondContact CB-OD2 3.4Å; S202-D508 PolarHBondContact OG-OD2 2.78Å
203	D	94.2	Very high	94.2	Very high	73 Å²	73	28.7 Å²	28.7	39%	0.39	15%	0.149	S	C	.	.			trans	-76	106	179.9	-167.9	-18.2	0	0	0	111.2	A200 L201 T205 E206 F207	A200-D203 WeakPolarHBondContact O-CB 3.32Å; A200-D203 PolarHBondContact O-N 3.48Å; A200-D203 VanDerWaalsContact O-N 3.1Å; L201-D203 VanDerWaalsContact C-N 3.32Å; D203-T205 VanDerWaalsContact CG-OG1 3.23Å; D203-T205 PolarHBondContact O-N 3.44Å; D203-T205 WeakPolarHBondContact OD1-CB 3.28Å; D203-T205 PolarHBondContact OD1-N 3.05Å; D203-T205 PolarHBondContact OD1-OG1 2.91Å; D203-T205 PolarHBondContact OD2-OG1 3.49Å; D203-E206 PolarHBondContact O-N 3.09Å; D203-F207 PolarHBondContact O-N 2.68Å
204	K	92.9	Very high	94.1	Very high	45 Å²	45	28.7 Å²	28.7	20%	0.196	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.8	-7.6	179.2	-60.6	-56	173.8	-144.3	0	114.8	S202 Y210 N506	S202-K204 PolarHBondContact O-N 3.18Å; K204-Y210 PolarHBondContact NZ-O 3.41Å; K204-N506 VanDerWaalsContact CE-CA 3.49Å; K204-N506 WeakPolarHBondContact CE-O 3.35Å; K204-N506 PolarHBondContact NZ-O 3.12Å
205	T	93	Very high	94	Very high	128 Å²	128	29 Å²	29	79%	0.785	15%	0.151	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.2	-34.9	171.5	69.2	0	0	0	0	111.1	D203	D203-T205 VanDerWaalsContact CG-OG1 3.23Å; D203-T205 PolarHBondContact O-N 3.44Å; D203-T205 WeakPolarHBondContact OD1-CB 3.28Å; D203-T205 PolarHBondContact OD1-N 3.05Å; D203-T205 PolarHBondContact OD1-OG1 2.91Å; D203-T205 PolarHBondContact OD2-OG1 3.49Å
206	E	91.4	Very high	94	Very high	101 Å²	101	28.6 Å²	28.6	47%	0.472	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.4	-47.6	177.4	-167.6	175.4	175.7	0	0	111.8	Q185 D203	Q185-E206 PolarHBondContact OE1-O 2.85Å; D203-E206 PolarHBondContact O-N 3.09Å
207	F	94.5	Very high	94	Very high	2 Å²	2	28.6 Å²	28.6	1%	0.009	15%	0.148	C	C	.	.			trans	-113.9	64.7	-172.7	-54.2	-66.2	0	0	0	112.2	I178 Q181 A200 L201 D203 Y209 Y210	I178-F207 HydrophobicContact CG1-CZ 4.2Å; I178-F207 HydrophobicContact CG2-CE1 3.98Å; I178-F207 HydrophobicContact CG2-CZ 3.86Å; Q181-F207 HydrophobicContact CB-CD1 4.17Å; Q181-F207 HydrophobicContact CG-CB 4.14Å; Q181-F207 HydrophobicContact CG-CD1 3.64Å; Q181-F207 HydrophobicContact CG-CG 4.31Å; A200-F207 HydrophobicContact CB-CE2 4.38Å; A200-F207 VanDerWaalsContact O-CD2 3.23Å; A200-F207 WeakPolarHBondContact O-CD2 3.47Å; A200-F207 WeakPolarHBondContact O-CE2 3.42Å; L201-F207 HydrophobicContact CD2-CD1 4.29Å; L201-F207 HydrophobicContact CD2-CD2 4.21Å; L201-F207 HydrophobicContact CD2-CE2 4.45Å; L201-F207 HydrophobicContact CD2-CG 4.11Å; D203-F207 PolarHBondContact O-N 2.68Å; F207-Y209 PolarHBondContact O-N 3.16Å; F207-Y210 PolarHBondContact O-N 3.43Å
208	K	94.9	Very high	93.9	Very high	113 Å²	113	29.7 Å²	29.7	49%	0.491	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-39.6	-172.4	-174.7	-179.9	175.8	-163.6	0	114.8	F485	K208-F485 WeakPolarHBondContact O-CE1 3.25Å; K208-F485 VanDerWaalsContact O-CZ 3.26Å; K208-F485 WeakPolarHBondContact O-CZ 3.49Å
209	Y	96	Very high	93.8	Very high	9 Å²	9	32.2 Å²	32.2	4%	0.035	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.6	11.4	-172.8	-61.5	-76.3	0	0	0	114.2	Q185 H188 P190 Q191 F207 S482 F485	Q185-Y209 HydrophobicContact CB-CD2 4.01Å; H188-Y209 HydrophobicContact CB-CE1 4.39Å; H188-Y209 HydrophobicContact CB-CE2 4.34Å; H188-Y209 AromaticContact CD2-CE2 3.52Å; H188-Y209 AromaticContact CD2-CZ 3.55Å; H188-Y209 PolarHBondContact CD2-OH 3.01Å; P190-Y209 WeakPolarHBondContact CA-O 3.44Å; Q191-Y209 PolarHBondContact N-O 3.3Å; F207-Y209 PolarHBondContact O-N 3.16Å; Y209-S482 WeakPolarHBondContact CE1-OG 3.41Å; Y209-S482 PolarHBondContact OH-OG 3.49Å; Y209-F485 HydrophobicContact CD1-CB 4.22Å; Y209-F485 HydrophobicContact CD1-CG 4.29Å
210	Y	96.9	Very high	93.8	Very high	1 Å²	1	29 Å²	29	0%	0.004	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	141.4	177.2	-175.1	-92.6	0	0	0	110.7	Q191 A196 L201 K204 F207 R212 F485	Q191-Y210 HydrophobicContact CB-CD2 4.09Å; Q191-Y210 HydrophobicContact CG-CD2 4.05Å; Q191-Y210 HydrophobicContact CG-CE2 4.21Å; A196-Y210 WeakPolarHBondContact CB-OH 3.25Å; A196-Y210 PolarHBondContact O-OH 2.89Å; L201-Y210 HydrophobicContact CB-CD1 3.68Å; L201-Y210 HydrophobicContact CB-CE1 3.53Å; L201-Y210 HydrophobicContact CB-CG 4.39Å; L201-Y210 HydrophobicContact CD1-CE1 3.89Å; L201-Y210 HydrophobicContact CD1-CE2 4.09Å; L201-Y210 HydrophobicContact CD2-CD1 4.23Å; L201-Y210 HydrophobicContact CD2-CD2 4.1Å; L201-Y210 HydrophobicContact CD2-CE1 4.33Å; L201-Y210 HydrophobicContact CD2-CE2 4.2Å; L201-Y210 HydrophobicContact CD2-CG 4.12Å; L201-Y210 HydrophobicContact CG-CD1 4.37Å; L201-Y210 HydrophobicContact CG-CE1 4.12Å; K204-Y210 PolarHBondContact NZ-O 3.41Å; F207-Y210 PolarHBondContact O-N 3.43Å; Y210-R212 HydrophobicContact CE1-CB 4.11Å; Y210-R212 HydrophobicContact CE1-CG 4.25Å; Y210-F485 WeakPolarHBondContact O-CZ 3.42Å
211	M	97	Very high	93.8	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	172.7	163.5	65.6	-179.8	-66.9	0	0	109.7	Q191 V192 G193 T451 F485 M488 F503	Q191-M211 PolarHBondContact O-N 2.9Å; V192-M211 CarbonylContact C-O 3.59Å; V192-M211 WeakPolarHBondContact CA-O 3.47Å; V192-M211 HydrophobicContact CG1-CG 4.48Å; V192-M211 HydrophobicContact CG2-CG 3.98Å; V192-M211 HydrophobicContact CG2-SD 4.34Å; G193-M211 PolarHBondContact N-O 3.48Å; M211-T451 HydrophobicContact CE-CG2 3.78Å; M211-T451 HydrophobicContact SD-CG2 4.45Å; M211-F485 HydrophobicContact CB-CE2 4.06Å; M211-F485 HydrophobicContact CG-CE2 4.24Å; M211-F485 HydrophobicContact SD-CE2 4.37Å; M211-M488 HydrophobicContact CE-CB 4.3Å; M211-M488 HydrophobicContact CG-CE 4.1Å; M211-M488 HydrophobicContact SD-CB 3.51Å; M211-M488 VanDerWaalsContact SD-CB 3.51Å; M211-M488 HydrophobicContact SD-CE 3.34Å; M211-M488 WeakPolarHBondContact SD-CE 3.38Å; M211-M488 HydrophobicContact SD-CG 4.33Å; M211-M488 HydrophobicContact SD-SD 4.28Å; M211-F503 HydrophobicContact CE-CD1 3.79Å; M211-F503 HydrophobicContact CE-CD2 3.58Å; M211-F503 HydrophobicContact CE-CE1 3.73Å; M211-F503 HydrophobicContact CE-CE2 3.51Å; M211-F503 HydrophobicContact CE-CG 3.73Å; M211-F503 HydrophobicContact CE-CZ 3.58Å
212	R	95.9	Very high	93.7	Very high	0 Å²	0	30 Å²	30	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	158.6	179.5	56.2	178	175	-151.4	-13.4	112.7	G193 A196 T197 T198 S202 Y210 V214 S216 F503 G507 D508 P509	G193-R212 WeakPolarHBondContact O-CA 3.48Å; G193-R212 VanDerWaalsContact O-CB 3.26Å; G193-R212 WeakPolarHBondContact O-CB 3.48Å; A196-R212 VanDerWaalsContact O-CD 3.25Å; A196-R212 WeakPolarHBondContact O-CD 3.34Å; A196-R212 PolarHBondContact O-NH1 2.98Å; A196-R212 VanDerWaalsContact O-NH1 3.14Å; T197-R212 PolarHBondContact O-NH1 2.94Å; T198-R212 PolarHBondContact O-NH1 2.85Å; S202-R212 PolarHBondContact OG-NH2 3.1Å; Y210-R212 HydrophobicContact CE1-CB 4.11Å; Y210-R212 HydrophobicContact CE1-CG 4.25Å; R212-V214 HydrophobicContact CB-CG2 4.37Å; R212-V214 WeakPolarHBondContact CD-O 3.29Å; R212-V214 VanDerWaalsContact CG-O 3.26Å; R212-V214 WeakPolarHBondContact CG-O 3.41Å; R212-V214 PolarHBondContact NE-O 3.4Å; R212-S216 VanDerWaalsContact NH2-CA 3.26Å; R212-S216 PolarHBondContact NH2-OG 3.43Å; R212-S216 VanDerWaalsContact NH2-OG 3.1Å; R212-F503 WeakPolarHBondContact O-CE1 3.23Å; R212-G507 PolarHBondContact N-O 3.28Å; R212-G507 VanDerWaalsContact N-O 3.1Å; R212-D508 IonicContact CZ-OD1 2.73Å; R212-D508 IonicContact NE-OD1 3.1Å; R212-D508 PolarHBondContact NE-OD1 2.94Å; R212-D508 IonicContact NH2-OD1 3.99Å; R212-D508 PolarHBondContact NH2-OD1 3.42Å; R212-D508 IonicContact NH2-OD2 3.06Å; R212-D508 PolarHBondContact NH2-OD2 2.87Å; R212-P509 WeakPolarHBondContact O-CD 3.22Å
213	V	94.8	Very high	93.6	Very high	16 Å²	16	29.3 Å²	29.3	10%	0.097	15%	0.147	C	C	.	.	S	Bend	trans	-101.9	8.1	176.4	-58.6	0	0	0	0	113	V192 G193 Q444 T447 F503	V192-V213 HydrophobicContact CG1-CG1 4.05Å; G193-V213 PolarHBondContact O-N 3.18Å; V213-Q444 HydrophobicContact CG2-CB 4.14Å; V213-Q444 WeakPolarHBondContact CG2-O 3.43Å; V213-T447 HydrophobicContact CB-CG2 3.96Å; V213-T447 HydrophobicContact CG1-CG2 3.9Å; V213-F503 HydrophobicContact CG1-CE1 4.23Å; V213-F503 HydrophobicContact CG1-CZ 4.12Å
214	V	93.5	Very high	93.6	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	13%	0.129	C	C	.	.	S	Bend	trans	-117.6	147.2	172.9	-67.7	0	0	0	0	110.5	Y194 T197 R212 I376 Q444 P509	Y194-V214 WeakPolarHBondContact O-CG1 2.98Å; T197-V214 HydrophobicContact CG2-CB 4.47Å; T197-V214 HydrophobicContact CG2-CG2 3.94Å; R212-V214 HydrophobicContact CB-CG2 4.37Å; R212-V214 WeakPolarHBondContact CD-O 3.29Å; R212-V214 VanDerWaalsContact CG-O 3.26Å; R212-V214 WeakPolarHBondContact CG-O 3.41Å; R212-V214 PolarHBondContact NE-O 3.4Å; V214-I376 HydrophobicContact CB-CD1 4.25Å; V214-I376 HydrophobicContact CG1-CD1 4.31Å; V214-I376 HydrophobicContact CG1-CG2 4.34Å; V214-Q444 HydrophobicContact CG1-CB 4.32Å; V214-Q444 HydrophobicContact CG1-CG 3.8Å; V214-P509 VanDerWaalsContact C-CG 3.43Å; V214-P509 VanDerWaalsContact O-CD 3.27Å; V214-P509 WeakPolarHBondContact O-CD 3.26Å; V214-P509 WeakPolarHBondContact O-CG 3.32Å
215	P	93.1	Very high	93.6	Very high	5 Å²	5	23.7 Å²	23.7	3%	0.032	12%	0.119	C	C	.	.			trans	-68.4	156.5	-179.4	27.9	-35.3	0	0	0	113.1	I376 A511 Y513	P215-I376 HydrophobicContact CG-CG2 4.34Å; P215-A511 HydrophobicContact CB-CB 3.56Å; P215-A511 HydrophobicContact CG-CB 4.23Å; P215-Y513 HydrophobicContact CG-CE1 3.86Å; P215-Y513 WeakPolarHBondContact CG-OH 3.12Å
216	S	93.2	Very high	93.6	Very high	2 Å²	2	18.6 Å²	18.6	1%	0.014	9%	0.087	C	C	.	.			trans	-66.9	148.2	172.3	-166	0	0	0	0	113.3	T197 R212 S218 W219 Y513	T197-S216 CarbonylContact O-C 3.49Å; T197-S216 WeakPolarHBondContact O-CA 3.27Å; R212-S216 VanDerWaalsContact NH2-CA 3.26Å; R212-S216 PolarHBondContact NH2-OG 3.43Å; R212-S216 VanDerWaalsContact NH2-OG 3.1Å; S216-S218 PolarHBondContact O-N 3.29Å; S216-S218 VanDerWaalsContact O-N 3.13Å; S216-S218 PolarHBondContact OG-N 2.85Å; S216-W219 PolarHBondContact O-N 3.17Å; S216-Y513 PolarHBondContact O-OH 3.38Å
217	D	91.8	Very high	93.6	Very high	1 Å²	1	13.8 Å²	13.8	1%	0.005	7%	0.065	C	C	.	.	H	α-helix	trans	-57.6	-22.9	169.9	-67.8	-24.8	0	0	0	112.3	T197 T198 W219 Q220 A221 Y245 F300	T197-D217 VanDerWaalsContact C-OD2 3.29Å; T197-D217 WeakPolarHBondContact CB-OD1 3.05Å; T197-D217 PolarHBondContact O-N 2.93Å; T197-D217 VanDerWaalsContact OG1-CG 3.31Å; T197-D217 PolarHBondContact OG1-OD1 2.87Å; T197-D217 PolarHBondContact OG1-OD2 3.03Å; T198-D217 WeakPolarHBondContact CA-OD2 3.29Å; T198-D217 PolarHBondContact N-OD2 2.91Å; D217-W219 PolarHBondContact O-N 2.78Å; D217-Q220 CarbonylContact O-C 3.6Å; D217-Q220 WeakPolarHBondContact O-CB 3.27Å; D217-Q220 PolarHBondContact O-N 2.83Å; D217-A221 WeakPolarHBondContact O-CB 3.37Å; D217-A221 PolarHBondContact O-N 3.49Å; D217-Y245 WeakPolarHBondContact OD2-CD2 3.45Å; D217-Y245 VanDerWaalsContact OD2-CE2 3.3Å; D217-Y245 WeakPolarHBondContact OD2-CE2 3.44Å; D217-F300 HydrophobicContact CB-CE1 4.36Å
218	S	91.4	Very high	93.5	Very high	26 Å²	26	13.7 Å²	13.7	18%	0.182	6%	0.064	C	C	.	.	H	α-helix	trans	-52.4	-42.6	170.6	-68.6	0	0	0	0	112.3	K199 S216 K222 E252	K199-S218 WeakPolarHBondContact CD-OG 3.32Å; S216-S218 PolarHBondContact O-N 3.29Å; S216-S218 VanDerWaalsContact O-N 3.13Å; S216-S218 PolarHBondContact OG-N 2.85Å; S218-K222 PolarHBondContact O-N 3.39Å; S218-K222 VanDerWaalsContact O-N 3.16Å; S218-E252 WeakPolarHBondContact CB-OE2 3.4Å; S218-E252 PolarHBondContact OG-OE2 2.99Å
219	W	91.9	Very high	93.4	Very high	53 Å²	53	15.8 Å²	15.8	20%	0.201	7%	0.069	C	C	.	.	H	α-helix	trans	-75	-31.6	178.6	-66.6	114.9	0	0	0	112.2	S216 D217 K222 A223 A511 Y513 W531 H533 W535	S216-W219 PolarHBondContact O-N 3.17Å; D217-W219 PolarHBondContact O-N 2.78Å; W219-K222 PolarHBondContact O-N 2.95Å; W219-A223 WeakPolarHBondContact O-CB 3.31Å; W219-A223 PolarHBondContact O-N 2.8Å; W219-A511 HydrophobicContact CB-CB 3.42Å; W219-A511 VanDerWaalsContact CB-CB 3.42Å; W219-A511 HydrophobicContact CD2-CB 4.23Å; W219-A511 HydrophobicContact CG-CB 3.5Å; W219-Y513 HydrophobicContact CB-CE2 4.2Å; W219-W531 HydrophobicContact CB-CH2 4.05Å; W219-W531 HydrophobicContact CB-CZ3 4.23Å; W219-W531 HydrophobicContact CD2-CH2 4.43Å; W219-W531 AromaticContact CE3-CH2 3.81Å; W219-W531 HydrophobicContact CE3-CH2 3.81Å; W219-H533 HydrophobicContact CE3-CB 4.29Å; W219-H533 AromaticContact CH2-CD2 3.6Å; W219-H533 AromaticContact CH2-CE1 3.23Å; W219-H533 WeakPolarHBondContact CH2-CE1 3.48Å; W219-H533 AromaticContact CH2-CG 3.77Å; W219-H533 AromaticContact CH2-ND1 3.56Å; W219-H533 AromaticContact CH2-NE2 3.28Å; W219-H533 VanDerWaalsContact CH2-NE2 3.28Å; W219-H533 WeakPolarHBondContact CH2-NE2 2.91Å; W219-H533 AromaticContact CZ2-CE1 3.81Å; W219-H533 AromaticContact CZ2-ND1 3.86Å; W219-H533 HydrophobicContact CZ3-CB 4.35Å; W219-H533 AromaticContact CZ3-CD2 3.29Å; W219-H533 WeakPolarHBondContact CZ3-CD2 3.35Å; W219-H533 AromaticContact CZ3-CE1 3.79Å; W219-H533 AromaticContact CZ3-CG 3.59Å; W219-H533 AromaticContact CZ3-ND1 3.89Å; W219-H533 AromaticContact CZ3-NE2 3.45Å; W219-H533 WeakPolarHBondContact CZ3-NE2 3.5Å; W219-W535 HydrophobicContact CH2-CH2 4.26Å; W219-W535 HydrophobicContact CH2-CZ2 4.06Å; W219-W535 HydrophobicContact CZ2-CH2 4.03Å; W219-W535 AromaticContact CZ2-CZ2 3.52Å; W219-W535 HydrophobicContact CZ2-CZ2 3.52Å
220	Q	91.9	Very high	93.1	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-69.5	-42.4	174.9	-170.9	-178.3	52	0	0	111.5	D217 K222 A223 M224 F300 E352 F374 Y513	D217-Q220 CarbonylContact O-C 3.6Å; D217-Q220 WeakPolarHBondContact O-CB 3.27Å; D217-Q220 PolarHBondContact O-N 2.83Å; Q220-K222 VanDerWaalsContact C-N 3.29Å; Q220-K222 PolarHBondContact O-N 2.9Å; Q220-A223 CarbonylContact O-C 3.51Å; Q220-A223 WeakPolarHBondContact O-CB 3.16Å; Q220-A223 PolarHBondContact O-N 3.08Å; Q220-A223 VanDerWaalsContact O-N 3.11Å; Q220-M224 HydrophobicContact CG-CE 4Å; Q220-M224 WeakPolarHBondContact O-CG 3.38Å; Q220-M224 PolarHBondContact O-N 3.26Å; Q220-F300 HydrophobicContact CG-CZ 4.5Å; Q220-E352 VanDerWaalsContact NE2-N 3.11Å; Q220-E352 PolarHBondContact NE2-OE2 3.45Å; Q220-E352 PolarHBondContact OE1-OE2 3.41Å; Q220-F374 HydrophobicContact CG-CD2 4.29Å; Q220-F374 HydrophobicContact CG-CG 4.27Å; Q220-Y513 HydrophobicContact CB-CE2 4.32Å
221	A	93.2	Very high	92.8	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-57	-44.7	173.4	0	0	0	0	0	110.7	D217 A223 M224 V225 E252 L253 F300	D217-A221 WeakPolarHBondContact O-CB 3.37Å; D217-A221 PolarHBondContact O-N 3.49Å; A221-A223 PolarHBondContact O-N 3.35Å; A221-M224 PolarHBondContact O-N 3.23Å; A221-V225 WeakPolarHBondContact O-CG2 3.25Å; A221-V225 PolarHBondContact O-N 2.81Å; A221-E252 HydrophobicContact CB-CB 3.85Å; A221-L253 HydrophobicContact CB-CB 4.35Å; A221-L253 HydrophobicContact CB-CD1 4.43Å; A221-F300 HydrophobicContact CB-CE2 4.39Å; A221-F300 HydrophobicContact CB-CZ 4.05Å
222	K	92.2	Very high	92.4	Very high	41 Å²	41	25 Å²	25	18%	0.178	11%	0.113	C	C	.	.	H	α-helix	trans	-61.6	-44	173.4	-174.8	59.5	-179	170.8	0	112.3	S218 W219 Q220 M224 V225 D226 E260 W531	S218-K222 PolarHBondContact O-N 3.39Å; S218-K222 VanDerWaalsContact O-N 3.16Å; W219-K222 PolarHBondContact O-N 2.95Å; Q220-K222 VanDerWaalsContact C-N 3.29Å; Q220-K222 PolarHBondContact O-N 2.9Å; K222-M224 VanDerWaalsContact C-N 3.31Å; K222-M224 PolarHBondContact O-N 3.33Å; K222-V225 PolarHBondContact O-N 3.31Å; K222-D226 WeakPolarHBondContact CE-OD1 3.43Å; K222-D226 IonicContact NZ-OD1 3.39Å; K222-D226 PolarHBondContact O-N 2.87Å; K222-E260 IonicContact NZ-OE1 2.74Å; K222-E260 PolarHBondContact NZ-OE1 3.26Å; K222-W531 HydrophobicContact CB-CZ2 4.44Å; K222-W531 HydrophobicContact CG-CZ2 4.25Å
223	A	92.8	Very high	92.2	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-61.2	-38	176.8	0	0	0	0	0	112.7	W219 Q220 A221 D226 I227 F374 Y513 W531	W219-A223 WeakPolarHBondContact O-CB 3.31Å; W219-A223 PolarHBondContact O-N 2.8Å; Q220-A223 CarbonylContact O-C 3.51Å; Q220-A223 WeakPolarHBondContact O-CB 3.16Å; Q220-A223 PolarHBondContact O-N 3.08Å; Q220-A223 VanDerWaalsContact O-N 3.11Å; A221-A223 PolarHBondContact O-N 3.35Å; A223-D226 PolarHBondContact O-N 3.37Å; A223-I227 WeakPolarHBondContact O-CG1 3.08Å; A223-I227 PolarHBondContact O-N 2.93Å; A223-I227 VanDerWaalsContact O-N 3.1Å; A223-F374 HydrophobicContact CB-CE1 3.78Å; A223-F374 HydrophobicContact CB-CZ 4.29Å; A223-Y513 HydrophobicContact CB-CD2 4.33Å; A223-W531 HydrophobicContact CB-CB 4.44Å; A223-W531 HydrophobicContact CB-CD2 3.59Å; A223-W531 HydrophobicContact CB-CE3 4.15Å; A223-W531 HydrophobicContact CB-CG 3.73Å; A223-W531 HydrophobicContact CB-CZ2 4.15Å
224	M	93.4	Very high	92	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-64.2	-42.8	174.5	-70.8	-179.8	177.8	0	0	111.9	Q220 A221 K222 I227 V228 L253 I298 F300 I349 F374	Q220-M224 HydrophobicContact CG-CE 4Å; Q220-M224 WeakPolarHBondContact O-CG 3.38Å; Q220-M224 PolarHBondContact O-N 3.26Å; A221-M224 PolarHBondContact O-N 3.23Å; K222-M224 VanDerWaalsContact C-N 3.31Å; K222-M224 PolarHBondContact O-N 3.33Å; M224-I227 WeakPolarHBondContact O-CB 3.22Å; M224-I227 PolarHBondContact O-N 2.89Å; M224-V228 WeakPolarHBondContact O-CG2 3.24Å; M224-V228 PolarHBondContact O-N 3.01Å; M224-L253 HydrophobicContact CB-CD1 4.12Å; M224-I298 HydrophobicContact CG-CG2 4.48Å; M224-I298 HydrophobicContact SD-CG2 3.44Å; M224-I298 WeakPolarHBondContact SD-CG2 3.27Å; M224-F300 HydrophobicContact CE-CE1 4.3Å; M224-F300 HydrophobicContact CE-CE2 4.04Å; M224-F300 HydrophobicContact CE-CZ 3.91Å; M224-F300 HydrophobicContact SD-CD2 4.1Å; M224-F300 HydrophobicContact SD-CE2 3.36Å; M224-F300 WeakPolarHBondContact SD-CE2 3.43Å; M224-F300 HydrophobicContact SD-CZ 3.63Å; M224-I349 HydrophobicContact CE-CG2 4.35Å; M224-I349 HydrophobicContact CG-CG2 4Å; M224-I349 HydrophobicContact SD-CG2 4.44Å; M224-F374 HydrophobicContact CE-CD2 3.93Å; M224-F374 HydrophobicContact CE-CE2 3.67Å; M224-F374 HydrophobicContact CG-CE2 3.49Å; M224-F374 VanDerWaalsContact CG-CE2 3.49Å; M224-F374 HydrophobicContact CG-CZ 3.61Å; M224-F374 HydrophobicContact SD-CE2 4.41Å
225	V	93	Very high	91.9	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-64.8	-41	175.5	174.5	0	0	0	0	111.7	A221 K222 I227 V228 R229 L253 N256 F257 E260 L263	A221-V225 WeakPolarHBondContact O-CG2 3.25Å; A221-V225 PolarHBondContact O-N 2.81Å; K222-V225 PolarHBondContact O-N 3.31Å; V225-I227 VanDerWaalsContact C-N 3.26Å; V225-I227 PolarHBondContact O-N 2.62Å; V225-V228 WeakPolarHBondContact O-CB 3.47Å; V225-V228 PolarHBondContact O-N 3.37Å; V225-V228 VanDerWaalsContact O-N 3.14Å; V225-R229 WeakPolarHBondContact O-CB 3.21Å; V225-R229 PolarHBondContact O-N 2.93Å; V225-L253 HydrophobicContact CG2-CD1 3.93Å; V225-N256 HydrophobicContact CB-CB 4.42Å; V225-N256 HydrophobicContact CG2-CB 3.72Å; V225-F257 HydrophobicContact CG2-CD2 3.58Å; V225-F257 HydrophobicContact CG2-CE2 3.61Å; V225-E260 HydrophobicContact CG1-CG 3.9Å; V225-L263 HydrophobicContact CG1-CD1 3.85Å
226	D	92.3	Very high	91.9	Very high	20 Å²	20	26.2 Å²	26.2	11%	0.107	12%	0.118	C	C	.	.	H	α-helix	trans	-60.8	-36.5	175.6	-71.2	-9.9	0	0	0	111.4	K222 A223 Y230 W531 S553 L555	K222-D226 WeakPolarHBondContact CE-OD1 3.43Å; K222-D226 IonicContact NZ-OD1 3.39Å; K222-D226 PolarHBondContact O-N 2.87Å; A223-D226 PolarHBondContact O-N 3.37Å; D226-Y230 VanDerWaalsContact O-CB 3.29Å; D226-Y230 WeakPolarHBondContact O-CB 3.39Å; D226-Y230 PolarHBondContact O-N 3.28Å; D226-W531 PolarHBondContact OD2-NE1 2.9Å; D226-S553 PolarHBondContact OD2-OG 3.3Å; D226-L555 HydrophobicContact CB-CD2 4.12Å; D226-L555 WeakPolarHBondContact O-CD2 3.3Å
227	I	92.3	Very high	92	Very high	1 Å²	1	26.1 Å²	26.1	1%	0.005	12%	0.117	C	C	.	.	H	α-helix	trans	-65.5	-46.1	173.3	-68.1	172.4	0	0	0	111.2	A223 M224 V225 R229 Y230 F231 W233 I349 F374 I515 L555 I557	A223-I227 WeakPolarHBondContact O-CG1 3.08Å; A223-I227 PolarHBondContact O-N 2.93Å; A223-I227 VanDerWaalsContact O-N 3.1Å; M224-I227 WeakPolarHBondContact O-CB 3.22Å; M224-I227 PolarHBondContact O-N 2.89Å; V225-I227 VanDerWaalsContact C-N 3.26Å; V225-I227 PolarHBondContact O-N 2.62Å; I227-R229 VanDerWaalsContact C-N 3.31Å; I227-R229 PolarHBondContact O-N 3.41Å; I227-Y230 PolarHBondContact O-N 3.31Å; I227-F231 HydrophobicContact CG2-CD2 3.83Å; I227-F231 HydrophobicContact CG2-CE2 3.87Å; I227-F231 WeakPolarHBondContact O-CD2 3.21Å; I227-F231 PolarHBondContact O-N 3.06Å; I227-F231 VanDerWaalsContact O-N 3.15Å; I227-W233 HydrophobicContact CG2-CZ3 4.34Å; I227-I349 HydrophobicContact CB-CD1 4.47Å; I227-I349 HydrophobicContact CG2-CD1 3.85Å; I227-F374 HydrophobicContact CD1-CE1 4.04Å; I227-F374 HydrophobicContact CD1-CE2 4.42Å; I227-F374 HydrophobicContact CD1-CZ 3.53Å; I227-I515 HydrophobicContact CD1-CD1 3.87Å; I227-I515 HydrophobicContact CD1-CG1 4.4Å; I227-I515 HydrophobicContact CD1-CG2 4.33Å; I227-I515 HydrophobicContact CG1-CD1 4.22Å; I227-L555 HydrophobicContact CG1-CD1 4.19Å; I227-L555 HydrophobicContact CG1-CD2 4.19Å; I227-I557 HydrophobicContact CG1-CD1 4.41Å
228	V	92.9	Very high	92.2	Very high	0 Å²	0	26 Å²	26	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-57.5	-46.2	177.6	168.8	0	0	0	0	110.6	M224 V225 F231 N232 W233 V236 F257 L263 I298 I349	M224-V228 WeakPolarHBondContact O-CG2 3.24Å; M224-V228 PolarHBondContact O-N 3.01Å; V225-V228 WeakPolarHBondContact O-CB 3.47Å; V225-V228 PolarHBondContact O-N 3.37Å; V225-V228 VanDerWaalsContact O-N 3.14Å; V228-F231 PolarHBondContact O-N 3.29Å; V228-N232 PolarHBondContact O-N 3.39Å; V228-W233 HydrophobicContact CG1-CB 3.93Å; V228-W233 WeakPolarHBondContact CG1-O 3.14Å; V228-W233 HydrophobicContact CG2-CE3 4.39Å; V228-W233 PolarHBondContact O-N 3.33Å; V228-V236 HydrophobicContact CG1-CG1 4.45Å; V228-F257 HydrophobicContact CG1-CE1 4.45Å; V228-F257 HydrophobicContact CG1-CZ 4.18Å; V228-F257 HydrophobicContact CG2-CZ 4.23Å; V228-L263 HydrophobicContact CG1-CD1 4.27Å; V228-L263 HydrophobicContact CG1-CD2 4.05Å; V228-I298 HydrophobicContact CG2-CD1 3.83Å; V228-I349 HydrophobicContact CG2-CD1 4.46Å
229	R	91	Very high	92.3	Very high	157 Å²	157	24.9 Å²	24.9	59%	0.592	11%	0.109	S	C	*	.	H	α-helix	trans	-63.8	-43.5	176.2	-174.4	174.4	175.7	164.8	-3.1	112.1	V225 I227 F231 N232 E260	V225-R229 WeakPolarHBondContact O-CB 3.21Å; V225-R229 PolarHBondContact O-N 2.93Å; I227-R229 VanDerWaalsContact C-N 3.31Å; I227-R229 PolarHBondContact O-N 3.41Å; R229-F231 VanDerWaalsContact C-N 3.27Å; R229-F231 PolarHBondContact O-N 2.85Å; R229-N232 PolarHBondContact O-N 3.5Å; R229-N232 VanDerWaalsContact O-N 3.08Å; R229-E260 IonicContact CZ-OE2 3.02Å; R229-E260 IonicContact NH1-OE1 2.93Å; R229-E260 IonicContact NH1-OE2 2.98Å; R229-E260 PolarHBondContact NH1-OE2 2.83Å
230	Y	90.7	Very high	92.5	Very high	83 Å²	83	24 Å²	24	33%	0.325	11%	0.105	S	C	.	.	H	α-helix	trans	-59.8	-35.3	179.5	178.1	-90.9	0	0	0	113.4	D226 I227 L555 I557 R559	D226-Y230 VanDerWaalsContact O-CB 3.29Å; D226-Y230 WeakPolarHBondContact O-CB 3.39Å; D226-Y230 PolarHBondContact O-N 3.28Å; I227-Y230 PolarHBondContact O-N 3.31Å; Y230-L555 HydrophobicContact CD2-CD2 4.41Å; Y230-L555 HydrophobicContact CG-CD2 4.19Å; Y230-I557 HydrophobicContact CD1-CD1 3.82Å; Y230-I557 HydrophobicContact CE1-CB 4.06Å; Y230-I557 HydrophobicContact CE1-CD1 4.06Å; Y230-I557 HydrophobicContact CE1-CG2 4.22Å; Y230-I557 HydrophobicContact CG-CD1 4.29Å; Y230-R559 HydrophobicContact CE1-CG 4.42Å; Y230-R559 PolarHBondContact OH-NE 2.87Å
231	F	89.9	Confident	92.5	Very high	11 Å²	11	24 Å²	24	5%	0.048	11%	0.106	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.3	4.4	177.4	-68.8	-66.5	0	0	0	114.2	I227 V228 R229 W233 I557 I562 W564 T574	I227-F231 HydrophobicContact CG2-CD2 3.83Å; I227-F231 HydrophobicContact CG2-CE2 3.87Å; I227-F231 WeakPolarHBondContact O-CD2 3.21Å; I227-F231 PolarHBondContact O-N 3.06Å; I227-F231 VanDerWaalsContact O-N 3.15Å; V228-F231 PolarHBondContact O-N 3.29Å; R229-F231 VanDerWaalsContact C-N 3.27Å; R229-F231 PolarHBondContact O-N 2.85Å; F231-W233 VanDerWaalsContact C-N 3.26Å; F231-W233 HydrophobicContact CB-CD2 3.7Å; F231-W233 HydrophobicContact CB-CE3 4.07Å; F231-W233 HydrophobicContact CB-CG 4.2Å; F231-W233 HydrophobicContact CB-CH2 4.07Å; F231-W233 HydrophobicContact CB-CZ2 3.72Å; F231-W233 HydrophobicContact CB-CZ3 4.22Å; F231-W233 HydrophobicContact CD2-CE3 4.44Å; F231-W233 AromaticContact CD2-CH2 3.65Å; F231-W233 HydrophobicContact CD2-CH2 3.65Å; F231-W233 HydrophobicContact CD2-CZ2 4.09Å; F231-W233 AromaticContact CD2-CZ3 3.84Å; F231-W233 HydrophobicContact CD2-CZ3 3.84Å; F231-W233 HydrophobicContact CE2-CH2 4.32Å; F231-W233 AromaticContact CG-CH2 3.97Å; F231-W233 HydrophobicContact CG-CH2 3.97Å; F231-W233 AromaticContact CG-CZ2 3.91Å; F231-W233 HydrophobicContact CG-CZ2 3.91Å; F231-W233 HydrophobicContact CG-CZ3 4.35Å; F231-W233 PolarHBondContact O-N 2.74Å; F231-I557 HydrophobicContact CE2-CD1 3.93Å; F231-I557 HydrophobicContact CZ-CD1 4.13Å; F231-I557 HydrophobicContact CZ-CG2 4.3Å; F231-I562 HydrophobicContact CE1-CD1 4.28Å; F231-I562 HydrophobicContact CZ-CD1 3.87Å; F231-W564 HydrophobicContact CD1-CH2 4.18Å; F231-W564 AromaticContact CE1-CH2 3.76Å; F231-W564 HydrophobicContact CE1-CH2 3.76Å; F231-W564 HydrophobicContact CE1-CZ2 4.01Å; F231-W564 HydrophobicContact CZ-CH2 4.01Å; F231-W564 HydrophobicContact CZ-CZ2 4.49Å; F231-T574 HydrophobicContact CB-CG2 4.15Å; F231-T574 HydrophobicContact CD1-CG2 3.76Å; F231-T574 HydrophobicContact CG-CG2 4.33Å
232	N	89.8	Confident	92.3	Very high	110 Å²	110	26.9 Å²	26.9	59%	0.588	12%	0.121	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.7	38.4	-178.5	-160.3	23.1	0	0	0	113.2	V228 R229	V228-N232 PolarHBondContact O-N 3.39Å; R229-N232 PolarHBondContact O-N 3.5Å; R229-N232 VanDerWaalsContact O-N 3.08Å
233	W	91	Very high	92	Very high	3 Å²	3	25.9 Å²	25.9	1%	0.011	12%	0.123	C	C	.	.			trans	-86	133	171.5	-64.4	-24.3	0	0	0	109.3	I227 V228 F231 L263 V296 V347 I349 W564 T574 P575 A577	I227-W233 HydrophobicContact CG2-CZ3 4.34Å; V228-W233 HydrophobicContact CG1-CB 3.93Å; V228-W233 WeakPolarHBondContact CG1-O 3.14Å; V228-W233 HydrophobicContact CG2-CE3 4.39Å; V228-W233 PolarHBondContact O-N 3.33Å; F231-W233 VanDerWaalsContact C-N 3.26Å; F231-W233 HydrophobicContact CB-CD2 3.7Å; F231-W233 HydrophobicContact CB-CE3 4.07Å; F231-W233 HydrophobicContact CB-CG 4.2Å; F231-W233 HydrophobicContact CB-CH2 4.07Å; F231-W233 HydrophobicContact CB-CZ2 3.72Å; F231-W233 HydrophobicContact CB-CZ3 4.22Å; F231-W233 HydrophobicContact CD2-CE3 4.44Å; F231-W233 AromaticContact CD2-CH2 3.65Å; F231-W233 HydrophobicContact CD2-CH2 3.65Å; F231-W233 HydrophobicContact CD2-CZ2 4.09Å; F231-W233 AromaticContact CD2-CZ3 3.84Å; F231-W233 HydrophobicContact CD2-CZ3 3.84Å; F231-W233 HydrophobicContact CE2-CH2 4.32Å; F231-W233 AromaticContact CG-CH2 3.97Å; F231-W233 HydrophobicContact CG-CH2 3.97Å; F231-W233 AromaticContact CG-CZ2 3.91Å; F231-W233 HydrophobicContact CG-CZ2 3.91Å; F231-W233 HydrophobicContact CG-CZ3 4.35Å; F231-W233 PolarHBondContact O-N 2.74Å; W233-L263 WeakPolarHBondContact O-CD2 3.28Å; W233-V296 HydrophobicContact CD2-CG1 4.39Å; W233-V296 HydrophobicContact CD2-CG2 3.73Å; W233-V296 HydrophobicContact CE3-CB 4.46Å; W233-V296 HydrophobicContact CE3-CG1 3.83Å; W233-V296 HydrophobicContact CE3-CG2 3.97Å; W233-V296 HydrophobicContact CG-CG2 4.22Å; W233-V296 HydrophobicContact CH2-CG2 4.31Å; W233-V296 HydrophobicContact CZ2-CG2 4.06Å; W233-V296 HydrophobicContact CZ3-CG1 4Å; W233-V296 HydrophobicContact CZ3-CG2 4.27Å; W233-V347 HydrophobicContact CH2-CB 4.26Å; W233-V347 HydrophobicContact CH2-CG1 4.02Å; W233-V347 HydrophobicContact CH2-CG2 4.02Å; W233-V347 HydrophobicContact CZ2-CG2 4.05Å; W233-I349 HydrophobicContact CZ3-CD1 4.1Å; W233-W564 HydrophobicContact CZ2-CZ3 4.4Å; W233-T574 HydrophobicContact CZ2-CG2 4.5Å; W233-P575 PolarHBondContact NE1-O 3.11Å; W233-A577 HydrophobicContact CB-CB 3.96Å; W233-A577 HydrophobicContact CG-CB 3.85Å
234	S	90.9	Very high	91.7	Very high	17 Å²	17	28.7 Å²	28.7	12%	0.119	14%	0.137	C	C	.	.			trans	-120.1	-15.3	-178.7	59.5	0	0	0	0	114.2	G262 C264 A577 K578	S234-G262 WeakPolarHBondContact CB-O 3.35Å; S234-C264 WeakPolarHBondContact O-CB 3.41Å; S234-C264 PolarHBondContact O-N 3.02Å; S234-A577 PolarHBondContact N-O 2.7Å; S234-K578 WeakPolarHBondContact OG-CA 2.91Å
235	Y	91.8	Very high	91.5	Very high	25 Å²	25	29.3 Å²	29.3	10%	0.098	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	104	-174.5	-164.9	-114.7	0	0	0	111.4	C264 G266 K293 I294 A577 C579 M594	Y235-C264 HydrophobicContact CD2-CB 3.89Å; Y235-C264 HydrophobicContact CE2-CB 4.47Å; Y235-G266 WeakPolarHBondContact OH-CA 3.37Å; Y235-K293 HydrophobicContact CD1-CB 4.33Å; Y235-K293 HydrophobicContact CE1-CB 4.29Å; Y235-I294 HydrophobicContact CD1-CD1 4.26Å; Y235-I294 HydrophobicContact CD1-CG1 3.58Å; Y235-I294 HydrophobicContact CE1-CD1 3.71Å; Y235-I294 HydrophobicContact CE1-CG1 3.38Å; Y235-A577 PolarHBondContact N-O 2.9Å; Y235-C579 HydrophobicContact CD1-CB 4.17Å; Y235-C579 HydrophobicContact CD2-CB 3.74Å; Y235-C579 HydrophobicContact CE2-CB 4.25Å; Y235-C579 HydrophobicContact CG-CB 3.7Å; Y235-M594 HydrophobicContact CE2-CE 4.27Å; Y235-M594 HydrophobicContact CE2-SD 4Å
236	V	93.5	Very high	91.3	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	157.4	-172.1	-55.8	0	0	0	0	112.4	V228 F257 C264 G266 V296 I298	V228-V236 HydrophobicContact CG1-CG1 4.45Å; V236-F257 HydrophobicContact CG2-CE1 3.64Å; V236-F257 HydrophobicContact CG2-CZ 3.51Å; V236-C264 PolarHBondContact N-O 2.82Å; V236-C264 VanDerWaalsContact N-O 3.15Å; V236-G266 PolarHBondContact O-N 3.4Å; V236-V296 HydrophobicContact CG1-CB 4.16Å; V236-V296 HydrophobicContact CG1-CG1 4.08Å; V236-I298 HydrophobicContact CG2-CD1 4Å; V236-I298 HydrophobicContact CG2-CG1 4.48Å
237	A	94.2	Very high	91.4	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	152.7	163.6	0	0	0	0	0	110.6	V267 L287 I294 V296 A297 I298 F345	A237-V267 CarbonylContact C-O 3.56Å; A237-V267 WeakPolarHBondContact CA-O 3.36Å; A237-V267 HydrophobicContact CB-CG1 3.59Å; A237-L287 HydrophobicContact CB-CD2 4.17Å; A237-I294 HydrophobicContact CB-CG2 3.63Å; A237-V296 PolarHBondContact N-O 3.08Å; A237-A297 HydrophobicContact CB-CB 4.23Å; A237-A297 CarbonylContact O-C 3.56Å; A237-A297 WeakPolarHBondContact O-CA 3.29Å; A237-I298 PolarHBondContact O-N 3.32Å; A237-F345 HydrophobicContact CB-CE1 4.27Å; A237-F345 HydrophobicContact CB-CZ 4.46Å
238	V	95.3	Very high	91.4	Very high	0 Å²	0	34 Å²	34	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	133	169.5	-174.4	0	0	0	0	110.6	Y240 F250 L253 I265 V267 S268 E269 I298	V238-Y240 HydrophobicContact CG1-CD1 4.47Å; V238-F250 HydrophobicContact CB-CD2 4.23Å; V238-F250 HydrophobicContact CB-CE2 4.09Å; V238-F250 HydrophobicContact CG1-CD2 3.6Å; V238-F250 HydrophobicContact CG1-CE2 3.98Å; V238-F250 HydrophobicContact CG2-CE2 4.48Å; V238-L253 HydrophobicContact CB-CD2 4.46Å; V238-L253 HydrophobicContact CG1-CD2 3.8Å; V238-L253 HydrophobicContact CG2-CD2 3.73Å; V238-I265 HydrophobicContact CB-CG2 4.34Å; V238-I265 HydrophobicContact CG2-CD1 4.12Å; V238-I265 HydrophobicContact CG2-CG1 4.01Å; V238-I265 HydrophobicContact CG2-CG2 3.8Å; V238-V267 PolarHBondContact N-O 2.65Å; V238-S268 CarbonylContact O-C 3.55Å; V238-S268 VanDerWaalsContact O-CA 3.28Å; V238-S268 WeakPolarHBondContact O-CA 3.47Å; V238-E269 PolarHBondContact O-N 3.16Å; V238-I298 CarbonylContact C-O 3.49Å; V238-I298 VanDerWaalsContact CA-O 3.26Å; V238-I298 WeakPolarHBondContact CA-O 3.35Å; V238-I298 HydrophobicContact CG2-CB 4.38Å
239	I	95	Very high	91.4	Very high	2 Å²	2	34 Å²	34	1%	0.01	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	132.4	174.6	-50.5	172.7	0	0	0	107.8	E269 I271 L283 L287 I298 C299 F300 I309 F345	I239-E269 WeakPolarHBondContact CA-O 3.47Å; I239-I271 HydrophobicContact CG2-CG2 4.28Å; I239-L283 HydrophobicContact CG2-CD2 4.09Å; I239-L287 HydrophobicContact CD1-CD1 3.5Å; I239-L287 HydrophobicContact CG1-CD1 4.12Å; I239-I298 PolarHBondContact N-O 3.13Å; I239-C299 CarbonylContact O-C 3.55Å; I239-C299 WeakPolarHBondContact O-CA 3.11Å; I239-F300 PolarHBondContact O-N 2.99Å; I239-I309 HydrophobicContact CG2-CD1 4.1Å; I239-F345 HydrophobicContact CD1-CE2 4.39Å
240	Y	94.8	Very high	91.6	Very high	33 Å²	33	27.5 Å²	27.5	13%	0.129	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	148.4	178.4	59.7	-79.6	0	0	0	112.2	V238 E247 F250 E269 K270 I271 F300	V238-Y240 HydrophobicContact CG1-CD1 4.47Å; Y240-E247 HydrophobicContact CD2-CG 4.21Å; Y240-E247 HydrophobicContact CE2-CG 4.07Å; Y240-F250 HydrophobicContact CD1-CB 3.95Å; Y240-F250 HydrophobicContact CD1-CD1 4.26Å; Y240-F250 AromaticContact CD1-CD2 3.93Å; Y240-F250 HydrophobicContact CD1-CD2 3.93Å; Y240-F250 AromaticContact CD1-CG 3.76Å; Y240-F250 HydrophobicContact CD1-CG 3.76Å; Y240-F250 HydrophobicContact CD2-CB 4.12Å; Y240-F250 HydrophobicContact CE1-CB 4.36Å; Y240-F250 AromaticContact CE1-CD1 3.81Å; Y240-F250 HydrophobicContact CE1-CD1 3.81Å; Y240-F250 HydrophobicContact CE1-CD2 4.05Å; Y240-F250 HydrophobicContact CE1-CE1 4.1Å; Y240-F250 HydrophobicContact CE1-CE2 4.31Å; Y240-F250 AromaticContact CE1-CG 3.78Å; Y240-F250 HydrophobicContact CE1-CG 3.78Å; Y240-F250 HydrophobicContact CE1-CZ 4.34Å; Y240-F250 HydrophobicContact CE2-CB 4.47Å; Y240-F250 HydrophobicContact CE2-CD1 4.28Å; Y240-F250 HydrophobicContact CE2-CG 4.49Å; Y240-F250 HydrophobicContact CG-CB 3.83Å; Y240-F250 HydrophobicContact CG-CG 4.15Å; Y240-F250 AromaticContact CZ-CD1 3.81Å; Y240-E269 PolarHBondContact N-O 3.18Å; Y240-K270 HydrophobicContact CD2-CB 4.43Å; Y240-K270 HydrophobicContact CD2-CD 4.32Å; Y240-K270 HydrophobicContact CD2-CG 4.15Å; Y240-K270 HydrophobicContact CE1-CB 4.31Å; Y240-K270 HydrophobicContact CE2-CB 3.84Å; Y240-K270 HydrophobicContact CE2-CD 3.62Å; Y240-K270 HydrophobicContact CE2-CG 3.74Å; Y240-K270 WeakPolarHBondContact O-CA 3.46Å; Y240-I271 PolarHBondContact O-N 3.24Å; Y240-F300 VanDerWaalsContact CA-O 3.26Å; Y240-F300 WeakPolarHBondContact CA-O 3.27Å
241	T	91.6	Very high	91.8	Very high	2 Å²	2	27.9 Å²	27.9	1%	0.012	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	142	178.5	-59.7	0	0	0	0	110.5	G243 G246 I271 F300 C301 E302 T305	T241-G243 PolarHBondContact O-N 2.53Å; T241-G246 WeakPolarHBondContact O-CA 3.28Å; T241-I271 CarbonylContact C-O 3.58Å; T241-I271 VanDerWaalsContact CA-O 3.27Å; T241-I271 WeakPolarHBondContact CA-O 3.19Å; T241-F300 PolarHBondContact N-O 3.13Å; T241-C301 VanDerWaalsContact OG1-CA 3.23Å; T241-C301 WeakPolarHBondContact OG1-CA 3.43Å; T241-C301 WeakPolarHBondContact OG1-CB 3.19Å; T241-C301 PolarHBondContact OG1-SG 3.49Å; T241-E302 HydrophobicContact CG2-CG 4.23Å; T241-E302 PolarHBondContact OG1-N 2.92Å; T241-T305 WeakPolarHBondContact OG1-CB 3.36Å; T241-T305 WeakPolarHBondContact OG1-CG2 3.32Å; T241-T305 PolarHBondContact OG1-OG1 3.25Å
242	D	89.5	Confident	92	Very high	60 Å²	60	28.3 Å²	28.3	32%	0.321	14%	0.143	S	C	.	.	S	Bend	trans	-61.2	122.3	169.4	-162.6	43.3	0	0	0	110.2	K270 I271 K272	D242-K270 HydrophobicContact CB-CD 4.43Å; D242-K270 HydrophobicContact CB-CG 4.44Å; D242-K270 WeakPolarHBondContact OD1-CE 3.21Å; D242-K270 IonicContact OD1-NZ 3.96Å; D242-K270 PolarHBondContact OD1-NZ 3.1Å; D242-I271 PolarHBondContact N-O 2.92Å; D242-K272 HydrophobicContact CB-CB 4.46Å; D242-K272 HydrophobicContact CB-CG 3.93Å
243	G	85.6	Confident	92.2	Very high	20 Å²	20	23 Å²	23	21%	0.206	12%	0.115	C	C	.	.	S	Bend	trans	138.5	164.3	-174.8	0	0	0	0	0	112.4	T241 Y245 G246 E247	T241-G243 PolarHBondContact O-N 2.53Å; G243-Y245 PolarHBondContact O-N 2.74Å; G243-G246 PolarHBondContact O-N 2.85Å; G243-E247 WeakPolarHBondContact O-CB 3.48Å; G243-E247 WeakPolarHBondContact O-CG 3.18Å; G243-E247 PolarHBondContact O-N 3.35Å
244	N	88.2	Confident	92.3	Very high	58 Å²	58	26.4 Å²	26.4	31%	0.31	13%	0.131	S	C	.	.	H	α-helix	trans	-63.8	-28.6	-173.7	-72	-74.2	0	0	0	112.7	D175 I178 T198 K248	D175-N244 VanDerWaalsContact OD1-CB 3.23Å; D175-N244 WeakPolarHBondContact OD1-CB 3.46Å; D175-N244 PolarHBondContact OD1-N 3.5Å; D175-N244 PolarHBondContact OD1-ND2 2.85Å; I178-N244 HydrophobicContact CD1-CB 3.93Å; T198-N244 PolarHBondContact OG1-O 3.07Å; N244-K248 WeakPolarHBondContact O-CB 3.45Å; N244-K248 VanDerWaalsContact O-CG 3.23Å; N244-K248 WeakPolarHBondContact O-CG 3.38Å; N244-K248 PolarHBondContact O-N 2.85Å
245	Y	87.8	Confident	92.5	Very high	13 Å²	13	32.2 Å²	32.2	5%	0.051	15%	0.15	C	C	.	.	H	α-helix	trans	-63.8	-56.4	175.4	173.8	-113.6	0	0	0	111.9	T197 D217 G243 G249 E302 S351 E352 S353	T197-Y245 WeakPolarHBondContact OG1-CE2 3.47Å; D217-Y245 WeakPolarHBondContact OD2-CD2 3.45Å; D217-Y245 VanDerWaalsContact OD2-CE2 3.3Å; D217-Y245 WeakPolarHBondContact OD2-CE2 3.44Å; G243-Y245 PolarHBondContact O-N 2.74Å; Y245-G249 PolarHBondContact O-N 3.12Å; Y245-E302 HydrophobicContact CD1-CG 4.45Å; Y245-S351 WeakPolarHBondContact OH-CB 3.33Å; Y245-S351 PolarHBondContact OH-OG 2.9Å; Y245-E352 VanDerWaalsContact OH-CD 3.32Å; Y245-E352 PolarHBondContact OH-OE1 3.27Å; Y245-E352 PolarHBondContact OH-OE2 2.81Å; Y245-E352 VanDerWaalsContact OH-OE2 3.13Å; Y245-S353 WeakPolarHBondContact CE1-OG 3.42Å; Y245-S353 PolarHBondContact OH-OG 3.21Å
246	G	90	Very high	92.6	Very high	1 Å²	1	31.9 Å²	31.9	1%	0.01	15%	0.151	C	C	.	.	H	α-helix	trans	-71.1	-41.7	-176	0	0	0	0	0	113.1	T241 G243 F250	T241-G246 WeakPolarHBondContact O-CA 3.28Å; G243-G246 PolarHBondContact O-N 2.85Å; G246-F250 WeakPolarHBondContact O-CB 3.38Å; G246-F250 PolarHBondContact O-N 2.95Å
247	E	93	Very high	92.5	Very high	61 Å²	61	32.2 Å²	32.2	29%	0.285	15%	0.152	S	C	.	.	H	α-helix	trans	-69	-45.9	-178.9	-64.5	-165.3	157.8	0	0	112.1	Y240 G243 F250 E251 K270	Y240-E247 HydrophobicContact CD2-CG 4.21Å; Y240-E247 HydrophobicContact CE2-CG 4.07Å; G243-E247 WeakPolarHBondContact O-CB 3.48Å; G243-E247 WeakPolarHBondContact O-CG 3.18Å; G243-E247 PolarHBondContact O-N 3.35Å; E247-F250 PolarHBondContact O-N 3.32Å; E247-E251 WeakPolarHBondContact O-CG 3.35Å; E247-E251 PolarHBondContact O-N 3.31Å; E247-K270 WeakPolarHBondContact OE1-CD 3.41Å; E247-K270 IonicContact OE1-NZ 2.68Å; E247-K270 PolarHBondContact OE1-NZ 3.3Å
248	K	92.9	Very high	92.3	Very high	59 Å²	59	38.8 Å²	38.8	26%	0.257	18%	0.183	S	C	.	.	H	α-helix	trans	-70.4	-33.9	177.1	-59.8	-53.6	-176.2	-168.5	0	112.7	K199 A200 N244 F250 E251 E252	K199-K248 HydrophobicContact CB-CB 4.49Å; A200-K248 HydrophobicContact CB-CG 4.44Å; N244-K248 WeakPolarHBondContact O-CB 3.45Å; N244-K248 VanDerWaalsContact O-CG 3.23Å; N244-K248 WeakPolarHBondContact O-CG 3.38Å; N244-K248 PolarHBondContact O-N 2.85Å; K248-F250 VanDerWaalsContact C-N 3.33Å; K248-E251 WeakPolarHBondContact CD-OE2 3.23Å; K248-E251 IonicContact NZ-OE1 3.61Å; K248-E251 PolarHBondContact NZ-OE1 2.93Å; K248-E251 IonicContact NZ-OE2 2.67Å; K248-E251 PolarHBondContact NZ-OE2 3.16Å; K248-E251 PolarHBondContact O-N 2.92Å; K248-E252 WeakPolarHBondContact O-CG 3.37Å; K248-E252 PolarHBondContact O-N 3.38Å; K248-E252 VanDerWaalsContact O-N 3.1Å
249	G	92.5	Very high	91.9	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-60.8	-42.3	170	0	0	0	0	0	112.1	Y245 L253	Y245-G249 PolarHBondContact O-N 3.12Å; G249-L253 WeakPolarHBondContact O-CB 3.3Å; G249-L253 PolarHBondContact O-N 3.31Å
250	F	94.8	Very high	91.5	Very high	20 Å²	20	46.2 Å²	46.2	9%	0.088	22%	0.217	C	C	.	.	H	α-helix	trans	-65.7	-45.7	175.3	174.3	-113.2	0	0	0	113	V238 Y240 G246 E247 K248 E252 L253 Q254 I265	V238-F250 HydrophobicContact CB-CD2 4.23Å; V238-F250 HydrophobicContact CB-CE2 4.09Å; V238-F250 HydrophobicContact CG1-CD2 3.6Å; V238-F250 HydrophobicContact CG1-CE2 3.98Å; V238-F250 HydrophobicContact CG2-CE2 4.48Å; Y240-F250 HydrophobicContact CD1-CB 3.95Å; Y240-F250 HydrophobicContact CD1-CD1 4.26Å; Y240-F250 AromaticContact CD1-CD2 3.93Å; Y240-F250 HydrophobicContact CD1-CD2 3.93Å; Y240-F250 AromaticContact CD1-CG 3.76Å; Y240-F250 HydrophobicContact CD1-CG 3.76Å; Y240-F250 HydrophobicContact CD2-CB 4.12Å; Y240-F250 HydrophobicContact CE1-CB 4.36Å; Y240-F250 AromaticContact CE1-CD1 3.81Å; Y240-F250 HydrophobicContact CE1-CD1 3.81Å; Y240-F250 HydrophobicContact CE1-CD2 4.05Å; Y240-F250 HydrophobicContact CE1-CE1 4.1Å; Y240-F250 HydrophobicContact CE1-CE2 4.31Å; Y240-F250 AromaticContact CE1-CG 3.78Å; Y240-F250 HydrophobicContact CE1-CG 3.78Å; Y240-F250 HydrophobicContact CE1-CZ 4.34Å; Y240-F250 HydrophobicContact CE2-CB 4.47Å; Y240-F250 HydrophobicContact CE2-CD1 4.28Å; Y240-F250 HydrophobicContact CE2-CG 4.49Å; Y240-F250 HydrophobicContact CG-CB 3.83Å; Y240-F250 HydrophobicContact CG-CG 4.15Å; Y240-F250 AromaticContact CZ-CD1 3.81Å; G246-F250 WeakPolarHBondContact O-CB 3.38Å; G246-F250 PolarHBondContact O-N 2.95Å; E247-F250 PolarHBondContact O-N 3.32Å; K248-F250 VanDerWaalsContact C-N 3.33Å; F250-E252 VanDerWaalsContact C-N 3.29Å; F250-E252 PolarHBondContact O-N 2.93Å; F250-L253 WeakPolarHBondContact O-CB 3.21Å; F250-L253 PolarHBondContact O-N 3.39Å; F250-L253 VanDerWaalsContact O-N 3.17Å; F250-Q254 WeakPolarHBondContact O-CB 3.45Å; F250-Q254 PolarHBondContact O-N 2.78Å; F250-I265 HydrophobicContact CE2-CD1 4.19Å
251	E	95.3	Very high	90.8	Very high	90 Å²	90	54 Å²	54	42%	0.421	26%	0.255	S	S	.	.	H	α-helix	trans	-55.8	-44.8	176.3	-74.5	173.7	-161.7	0	0	111.3	E247 K248 Q254 R255	E247-E251 WeakPolarHBondContact O-CG 3.35Å; E247-E251 PolarHBondContact O-N 3.31Å; K248-E251 WeakPolarHBondContact CD-OE2 3.23Å; K248-E251 IonicContact NZ-OE1 3.61Å; K248-E251 PolarHBondContact NZ-OE1 2.93Å; K248-E251 IonicContact NZ-OE2 2.67Å; K248-E251 PolarHBondContact NZ-OE2 3.16Å; K248-E251 PolarHBondContact O-N 2.92Å; E251-Q254 PolarHBondContact O-N 2.64Å; E251-R255 PolarHBondContact O-N 2.77Å
252	E	93.7	Very high	90.4	Very high	20 Å²	20	55.8 Å²	55.8	9%	0.093	27%	0.274	C	S	.	.	H	α-helix	trans	-67.5	-39.8	176.7	-72	-60.6	97.6	0	0	113	K199 S218 A221 K248 F250 R255 N256	K199-E252 HydrophobicContact CB-CG 4.36Å; K199-E252 HydrophobicContact CD-CG 3.49Å; K199-E252 VanDerWaalsContact CD-CG 3.49Å; K199-E252 VanDerWaalsContact CD-OE1 3.29Å; K199-E252 WeakPolarHBondContact CD-OE1 3.2Å; K199-E252 WeakPolarHBondContact CD-OE2 3.49Å; K199-E252 WeakPolarHBondContact CE-OE1 3.38Å; K199-E252 IonicContact NZ-OE1 2.72Å; K199-E252 PolarHBondContact NZ-OE1 3.14Å; K199-E252 IonicContact NZ-OE2 3.65Å; K199-E252 PolarHBondContact NZ-OE2 3.18Å; S218-E252 WeakPolarHBondContact CB-OE2 3.4Å; S218-E252 PolarHBondContact OG-OE2 2.99Å; A221-E252 HydrophobicContact CB-CB 3.85Å; K248-E252 WeakPolarHBondContact O-CG 3.37Å; K248-E252 PolarHBondContact O-N 3.38Å; K248-E252 VanDerWaalsContact O-N 3.1Å; F250-E252 VanDerWaalsContact C-N 3.29Å; F250-E252 PolarHBondContact O-N 2.93Å; E252-R255 PolarHBondContact O-N 3.07Å; E252-N256 PolarHBondContact O-N 3.38Å; E252-N256 PolarHBondContact O-ND2 2.79Å
253	L	94.4	Very high	90.4	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-61.8	-48.2	175.4	-172.3	70.8	0	0	0	110.3	A221 M224 V225 V238 G249 F250 R255 N256 F257 I298 F300	A221-L253 HydrophobicContact CB-CB 4.35Å; A221-L253 HydrophobicContact CB-CD1 4.43Å; M224-L253 HydrophobicContact CB-CD1 4.12Å; V225-L253 HydrophobicContact CG2-CD1 3.93Å; V238-L253 HydrophobicContact CB-CD2 4.46Å; V238-L253 HydrophobicContact CG1-CD2 3.8Å; V238-L253 HydrophobicContact CG2-CD2 3.73Å; G249-L253 WeakPolarHBondContact O-CB 3.3Å; G249-L253 PolarHBondContact O-N 3.31Å; F250-L253 WeakPolarHBondContact O-CB 3.21Å; F250-L253 PolarHBondContact O-N 3.39Å; F250-L253 VanDerWaalsContact O-N 3.17Å; L253-R255 VanDerWaalsContact C-N 3.34Å; L253-R255 PolarHBondContact O-N 2.95Å; L253-N256 PolarHBondContact O-N 3.47Å; L253-F257 HydrophobicContact CD1-CD2 4.06Å; L253-F257 HydrophobicContact CD1-CE2 3.77Å; L253-F257 HydrophobicContact CD2-CE2 4.45Å; L253-F257 HydrophobicContact CG-CD2 3.94Å; L253-F257 HydrophobicContact CG-CE2 3.91Å; L253-F257 VanDerWaalsContact O-CD2 3.31Å; L253-F257 WeakPolarHBondContact O-CD2 3.36Å; L253-F257 PolarHBondContact O-N 2.94Å; L253-I298 HydrophobicContact CD1-CD1 4.32Å; L253-I298 HydrophobicContact CD1-CG2 4.41Å; L253-I298 HydrophobicContact CD2-CB 4.1Å; L253-I298 HydrophobicContact CD2-CD1 4.16Å; L253-I298 HydrophobicContact CD2-CG2 3.63Å; L253-F300 HydrophobicContact CB-CE2 4.12Å; L253-F300 HydrophobicContact CD1-CE2 4.31Å; L253-F300 HydrophobicContact CD2-CD2 4.33Å; L253-F300 HydrophobicContact CD2-CE2 4.25Å; L253-F300 HydrophobicContact CG-CE2 4.47Å
254	Q	94.5	Very high	90.7	Very high	74 Å²	74	53.8 Å²	53.8	35%	0.346	26%	0.259	S	S	.	.	H	α-helix	trans	-57.8	-46.7	178.6	-178.9	176.8	-10.7	0	0	111.3	F250 E251 N256 F257 E258 I265	F250-Q254 WeakPolarHBondContact O-CB 3.45Å; F250-Q254 PolarHBondContact O-N 2.78Å; E251-Q254 PolarHBondContact O-N 2.64Å; Q254-N256 PolarHBondContact O-N 2.94Å; Q254-F257 WeakPolarHBondContact O-CB 3.26Å; Q254-F257 PolarHBondContact O-N 2.87Å; Q254-F257 VanDerWaalsContact O-N 3.14Å; Q254-E258 WeakPolarHBondContact CG-OE1 3.38Å; Q254-E258 PolarHBondContact NE2-OE1 3.01Å; Q254-E258 WeakPolarHBondContact O-CG 3.22Å; Q254-E258 PolarHBondContact O-N 3.06Å; Q254-I265 HydrophobicContact CB-CD1 4.13Å; Q254-I265 HydrophobicContact CG-CD1 4.34Å
255	R	94.2	Very high	90.9	Very high	138 Å²	138	52.4 Å²	52.4	52%	0.521	25%	0.251	S	S	.	.	H	α-helix	trans	-57.4	-48.2	176.1	-178.8	-178.4	173.5	155.5	2.2	112.3	E251 E252 L253 F257 E258 E259	E251-R255 PolarHBondContact O-N 2.77Å; E252-R255 PolarHBondContact O-N 3.07Å; L253-R255 VanDerWaalsContact C-N 3.34Å; L253-R255 PolarHBondContact O-N 2.95Å; R255-F257 VanDerWaalsContact C-N 3.26Å; R255-F257 PolarHBondContact O-N 3.15Å; R255-E258 PolarHBondContact O-N 3.4Å; R255-E259 IonicContact CZ-OE1 2.77Å; R255-E259 IonicContact NE-OE1 2.83Å; R255-E259 PolarHBondContact NE-OE1 2.85Å; R255-E259 IonicContact NH2-OE1 2.79Å; R255-E259 WeakPolarHBondContact O-CG 3.45Å; R255-E259 PolarHBondContact O-N 2.66Å; R255-E259 VanDerWaalsContact O-N 3.11Å
256	N	92.8	Very high	91	Very high	19 Å²	19	52.7 Å²	52.7	10%	0.102	26%	0.258	C	S	.	.	H	α-helix	trans	-64.7	-30.7	178.5	-75.5	-72.1	0	0	0	112.4	V225 E252 L253 Q254 E260	V225-N256 HydrophobicContact CB-CB 4.42Å; V225-N256 HydrophobicContact CG2-CB 3.72Å; E252-N256 PolarHBondContact O-N 3.38Å; E252-N256 PolarHBondContact O-ND2 2.79Å; L253-N256 PolarHBondContact O-N 3.47Å; Q254-N256 PolarHBondContact O-N 2.94Å; N256-E260 WeakPolarHBondContact O-CG 3.33Å
257	F	92.1	Very high	91.1	Very high	7 Å²	7	53.3 Å²	53.3	3%	0.031	26%	0.261	C	S	.	.	H	α-helix	trans	-70.2	-36.5	173.4	-95.8	-101.2	0	0	0	112.6	V225 V228 V236 L253 Q254 R255 L263 I265 I298	V225-F257 HydrophobicContact CG2-CD2 3.58Å; V225-F257 HydrophobicContact CG2-CE2 3.61Å; V228-F257 HydrophobicContact CG1-CE1 4.45Å; V228-F257 HydrophobicContact CG1-CZ 4.18Å; V228-F257 HydrophobicContact CG2-CZ 4.23Å; V236-F257 HydrophobicContact CG2-CE1 3.64Å; V236-F257 HydrophobicContact CG2-CZ 3.51Å; L253-F257 HydrophobicContact CD1-CD2 4.06Å; L253-F257 HydrophobicContact CD1-CE2 3.77Å; L253-F257 HydrophobicContact CD2-CE2 4.45Å; L253-F257 HydrophobicContact CG-CD2 3.94Å; L253-F257 HydrophobicContact CG-CE2 3.91Å; L253-F257 VanDerWaalsContact O-CD2 3.31Å; L253-F257 WeakPolarHBondContact O-CD2 3.36Å; L253-F257 PolarHBondContact O-N 2.94Å; Q254-F257 WeakPolarHBondContact O-CB 3.26Å; Q254-F257 PolarHBondContact O-N 2.87Å; Q254-F257 VanDerWaalsContact O-N 3.14Å; R255-F257 VanDerWaalsContact C-N 3.26Å; R255-F257 PolarHBondContact O-N 3.15Å; F257-L263 HydrophobicContact CD1-CB 3.67Å; F257-L263 HydrophobicContact CE1-CB 3.98Å; F257-I265 HydrophobicContact CB-CD1 4.27Å; F257-I265 HydrophobicContact CB-CG1 4.37Å; F257-I265 HydrophobicContact CD1-CG1 3.9Å; F257-I265 HydrophobicContact CD2-CD1 4.41Å; F257-I265 HydrophobicContact CD2-CG1 4.39Å; F257-I265 HydrophobicContact CE1-CG1 4.28Å; F257-I265 HydrophobicContact CG-CD1 4.19Å; F257-I265 HydrophobicContact CG-CG1 3.97Å; F257-I298 HydrophobicContact CE2-CD1 3.79Å; F257-I298 HydrophobicContact CZ-CD1 3.74Å
258	E	90	Very high	91.1	Very high	138 Å²	138	53 Å²	53	65%	0.645	27%	0.266	S	S	*	.	H	α-helix	trans	-72.5	-29.8	178.7	-72	173.9	-171.3	0	0	113	Q254 R255	Q254-E258 WeakPolarHBondContact CG-OE1 3.38Å; Q254-E258 PolarHBondContact NE2-OE1 3.01Å; Q254-E258 WeakPolarHBondContact O-CG 3.22Å; Q254-E258 PolarHBondContact O-N 3.06Å; R255-E258 PolarHBondContact O-N 3.4Å
259	E	87.7	Confident	91.2	Very high	122 Å²	122	52.5 Å²	52.5	57%	0.57	26%	0.264	S	S	*	.	H	α-helix	trans	-74.3	-22	175.9	-71.6	177.3	-169.6	0	0	113.1	R255	R255-E259 IonicContact CZ-OE1 2.77Å; R255-E259 IonicContact NE-OE1 2.83Å; R255-E259 PolarHBondContact NE-OE1 2.85Å; R255-E259 IonicContact NH2-OE1 2.79Å; R255-E259 WeakPolarHBondContact O-CG 3.45Å; R255-E259 PolarHBondContact O-N 2.66Å; R255-E259 VanDerWaalsContact O-N 3.11Å
260	E	85.7	Confident	91.3	Very high	36 Å²	36	57 Å²	57	17%	0.168	28%	0.284	C	S	.	.	S	Bend	trans	-98.5	121.9	-178.6	-65.7	-80.9	172.3	0	0	111.7	K222 V225 R229 N256 G262 L263	K222-E260 IonicContact NZ-OE1 2.74Å; K222-E260 PolarHBondContact NZ-OE1 3.26Å; V225-E260 HydrophobicContact CG1-CG 3.9Å; R229-E260 IonicContact CZ-OE2 3.02Å; R229-E260 IonicContact NH1-OE1 2.93Å; R229-E260 IonicContact NH1-OE2 2.98Å; R229-E260 PolarHBondContact NH1-OE2 2.83Å; N256-E260 WeakPolarHBondContact O-CG 3.33Å; E260-G262 PolarHBondContact O-N 3.44Å; E260-L263 HydrophobicContact CB-CD1 3.7Å; E260-L263 HydrophobicContact CB-CG 4.04Å; E260-L263 HydrophobicContact CG-CD1 4.2Å
261	E	80.6	Confident	91.2	Very high	196 Å²	196	56.3 Å²	56.3	92%	0.916	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.3	129.9	177.7	-67.6	-166.3	158.4	0	0	112.1
262	G	82.3	Confident	91	Very high	40 Å²	40	57.8 Å²	57.8	41%	0.412	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	90.8	0.5	174.7	0	0	0	0	0	115.4	S234 E260	S234-G262 WeakPolarHBondContact CB-O 3.35Å; E260-G262 PolarHBondContact O-N 3.44Å
263	L	90.4	Very high	90.5	Very high	27 Å²	27	57.8 Å²	57.8	14%	0.141	29%	0.289	C	S	.	.			trans	-98.5	147.1	173.4	-56.3	-171.7	0	0	0	111.8	V225 V228 W233 F257 E260	V225-L263 HydrophobicContact CG1-CD1 3.85Å; V228-L263 HydrophobicContact CG1-CD1 4.27Å; V228-L263 HydrophobicContact CG1-CD2 4.05Å; W233-L263 WeakPolarHBondContact O-CD2 3.28Å; F257-L263 HydrophobicContact CD1-CB 3.67Å; F257-L263 HydrophobicContact CE1-CB 3.98Å; E260-L263 HydrophobicContact CB-CD1 3.7Å; E260-L263 HydrophobicContact CB-CG 4.04Å; E260-L263 HydrophobicContact CG-CD1 4.2Å
264	C	92.3	Very high	89.9	Confident	10 Å²	10	63.1 Å²	63.1	7%	0.068	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	140.5	-178	-76.6	0	0	0	0	112.8	S234 Y235 V236 M594 C596	S234-C264 WeakPolarHBondContact O-CB 3.41Å; S234-C264 PolarHBondContact O-N 3.02Å; Y235-C264 HydrophobicContact CD2-CB 3.89Å; Y235-C264 HydrophobicContact CE2-CB 4.47Å; V236-C264 PolarHBondContact N-O 2.82Å; V236-C264 VanDerWaalsContact N-O 3.15Å; C264-M594 HydrophobicContact CB-CE 3.54Å; C264-C596 HydrophobicContact CB-CB 3.95Å; C264-C596 WeakPolarHBondContact CB-SG 3.33Å; C264-C596 WeakPolarHBondContact SG-CB 3.45Å; C264-C596 CovalentContact SG-SG 2Å; C264-C596 PolarHBondContact SG-SG 3.05Å
265	I	92.8	Very high	89.6	Confident	30 Å²	30	60 Å²	60	15%	0.154	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	109.1	165.5	-61	170.4	0	0	0	107.7	V238 F250 Q254 F257 M594	V238-I265 HydrophobicContact CB-CG2 4.34Å; V238-I265 HydrophobicContact CG2-CD1 4.12Å; V238-I265 HydrophobicContact CG2-CG1 4.01Å; V238-I265 HydrophobicContact CG2-CG2 3.8Å; F250-I265 HydrophobicContact CE2-CD1 4.19Å; Q254-I265 HydrophobicContact CB-CD1 4.13Å; Q254-I265 HydrophobicContact CG-CD1 4.34Å; F257-I265 HydrophobicContact CB-CD1 4.27Å; F257-I265 HydrophobicContact CB-CG1 4.37Å; F257-I265 HydrophobicContact CD1-CG1 3.9Å; F257-I265 HydrophobicContact CD2-CD1 4.41Å; F257-I265 HydrophobicContact CD2-CG1 4.39Å; F257-I265 HydrophobicContact CE1-CG1 4.28Å; F257-I265 HydrophobicContact CG-CD1 4.19Å; F257-I265 HydrophobicContact CG-CG1 3.97Å; I265-M594 WeakPolarHBondContact O-CE 3.48Å
266	G	89.1	Confident	89.5	Confident	18 Å²	18	56.6 Å²	56.6	19%	0.186	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	-36.7	-176.9	0	0	0	0	0	114	Y235 V236	Y235-G266 WeakPolarHBondContact OH-CA 3.37Å; V236-G266 PolarHBondContact O-N 3.4Å
267	V	92.1	Very high	89.4	Confident	14 Å²	14	58.9 Å²	58.9	9%	0.085	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	141	175	65	0	0	0	0	108.8	A237 V238 E269 L287 Y290 I294	A237-V267 CarbonylContact C-O 3.56Å; A237-V267 WeakPolarHBondContact CA-O 3.36Å; A237-V267 HydrophobicContact CB-CG1 3.59Å; V238-V267 PolarHBondContact N-O 2.65Å; V267-E269 HydrophobicContact CG2-CG 4.14Å; V267-L287 HydrophobicContact CG1-CD2 3.88Å; V267-Y290 HydrophobicContact CB-CD2 4.42Å; V267-Y290 HydrophobicContact CB-CE1 4.35Å; V267-Y290 HydrophobicContact CB-CE2 4.06Å; V267-Y290 HydrophobicContact CG1-CD2 4.22Å; V267-Y290 HydrophobicContact CG1-CE2 4.3Å; V267-Y290 HydrophobicContact CG2-CD2 4.48Å; V267-Y290 HydrophobicContact CG2-CE2 3.76Å; V267-I294 HydrophobicContact CB-CD1 4.36Å; V267-I294 HydrophobicContact CG1-CD1 3.73Å
268	S	93.9	Very high	89.4	Confident	55 Å²	55	64 Å²	64	39%	0.385	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	129.6	171	54.1	0	0	0	0	109.3	V238	V238-S268 CarbonylContact O-C 3.55Å; V238-S268 VanDerWaalsContact O-CA 3.28Å; V238-S268 WeakPolarHBondContact O-CA 3.47Å
269	E	94.3	Very high	89.6	Confident	48 Å²	48	61.1 Å²	61.1	22%	0.224	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	129.1	-177.7	-68.3	-75.1	-173.9	0	0	110.1	V238 I239 Y240 V267 L283 S286 L287	V238-E269 PolarHBondContact O-N 3.16Å; I239-E269 WeakPolarHBondContact CA-O 3.47Å; Y240-E269 PolarHBondContact N-O 3.18Å; V267-E269 HydrophobicContact CG2-CG 4.14Å; E269-L283 HydrophobicContact CB-CD1 3.36Å; E269-L283 HydrophobicContact CG-CD1 3.65Å; E269-S286 PolarHBondContact OE1-OG 3.42Å; E269-L287 HydrophobicContact CG-CD2 4.01Å
270	K	94.5	Very high	89.9	Confident	96 Å²	96	55.4 Å²	55.4	42%	0.417	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	135.4	176.5	-174.3	165.6	76.9	151.5	0	110.3	Y240 D242 E247	Y240-K270 HydrophobicContact CD2-CB 4.43Å; Y240-K270 HydrophobicContact CD2-CD 4.32Å; Y240-K270 HydrophobicContact CD2-CG 4.15Å; Y240-K270 HydrophobicContact CE1-CB 4.31Å; Y240-K270 HydrophobicContact CE2-CB 3.84Å; Y240-K270 HydrophobicContact CE2-CD 3.62Å; Y240-K270 HydrophobicContact CE2-CG 3.74Å; Y240-K270 WeakPolarHBondContact O-CA 3.46Å; D242-K270 HydrophobicContact CB-CD 4.43Å; D242-K270 HydrophobicContact CB-CG 4.44Å; D242-K270 WeakPolarHBondContact OD1-CE 3.21Å; D242-K270 IonicContact OD1-NZ 3.96Å; D242-K270 PolarHBondContact OD1-NZ 3.1Å; E247-K270 WeakPolarHBondContact OE1-CD 3.41Å; E247-K270 IonicContact OE1-NZ 2.68Å; E247-K270 PolarHBondContact OE1-NZ 3.3Å
271	I	93.2	Very high	90.2	Very high	4 Å²	4	54.4 Å²	54.4	2%	0.021	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	141.4	177.3	-168.5	154.7	0	0	0	112.9	I239 Y240 T241 D242 A275 Y280 L283 T305	I239-I271 HydrophobicContact CG2-CG2 4.28Å; Y240-I271 PolarHBondContact O-N 3.24Å; T241-I271 CarbonylContact C-O 3.58Å; T241-I271 VanDerWaalsContact CA-O 3.27Å; T241-I271 WeakPolarHBondContact CA-O 3.19Å; D242-I271 PolarHBondContact N-O 2.92Å; I271-A275 HydrophobicContact CG1-CB 4.32Å; I271-Y280 HydrophobicContact CD1-CD1 3.31Å; I271-Y280 HydrophobicContact CD1-CD2 4.02Å; I271-Y280 HydrophobicContact CD1-CE1 3.39Å; I271-Y280 HydrophobicContact CD1-CE2 4.09Å; I271-Y280 HydrophobicContact CD1-CG 3.63Å; I271-Y280 HydrophobicContact CG1-CD1 4.37Å; I271-Y280 HydrophobicContact CG1-CE1 3.98Å; I271-Y280 HydrophobicContact CG1-CE2 4.46Å; I271-L283 HydrophobicContact CB-CD2 4.31Å; I271-L283 HydrophobicContact CD1-CB 4.28Å; I271-L283 HydrophobicContact CD1-CD2 3.58Å; I271-L283 HydrophobicContact CG2-CD2 4.32Å; I271-T305 HydrophobicContact CG2-CG2 3.69Å
272	K	89.9	Confident	90.8	Very high	121 Å²	121	53.6 Å²	53.6	53%	0.526	28%	0.283	S	S	.	.			trans	-79.9	135.2	176.5	-61.3	-177.1	175.9	-179.3	0	110.7	D242 L274 A275 Y280	D242-K272 HydrophobicContact CB-CB 4.46Å; D242-K272 HydrophobicContact CB-CG 3.93Å; K272-L274 PolarHBondContact O-N 2.99Å; K272-L274 VanDerWaalsContact O-N 3.12Å; K272-A275 HydrophobicContact CB-CB 4.19Å; K272-A275 VanDerWaalsContact O-CB 3.24Å; K272-A275 WeakPolarHBondContact O-CB 3.44Å; K272-A275 PolarHBondContact O-N 3.49Å; K272-Y280 PolarHBondContact O-OH 2.65Å; K272-Y280 VanDerWaalsContact O-OH 3.05Å
273	S	84.9	Confident	91.3	Very high	21 Å²	21	52.3 Å²	52.3	15%	0.147	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.5	-32.5	178.2	-171.6	0	0	0	0	113	Y280 E302 T305 K308	S273-Y280 PolarHBondContact O-OH 3.1Å; S273-E302 VanDerWaalsContact CB-OE2 3.31Å; S273-E302 WeakPolarHBondContact CB-OE2 3.45Å; S273-E302 PolarHBondContact OG-OE2 2.97Å; S273-T305 WeakPolarHBondContact CA-OG1 3.4Å; S273-T305 PolarHBondContact OG-OG1 3.05Å; S273-K308 PolarHBondContact O-NZ 3.17Å
274	L	81.9	Confident	91.3	Very high	112 Å²	112	51 Å²	51	59%	0.586	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.1	13.4	179.5	-63.3	177.9	0	0	0	114.4	A67 K272	A67-L274 HydrophobicContact CB-CD2 3.88Å; K272-L274 PolarHBondContact O-N 2.99Å; K272-L274 VanDerWaalsContact O-N 3.12Å
275	A	87.8	Confident	91.1	Very high	7 Å²	7	54.7 Å²	54.7	6%	0.058	28%	0.279	C	S	.	.			trans	-59.3	149.7	177.8	0	0	0	0	0	112.2	I271 K272 E279 Y280	I271-A275 HydrophobicContact CG1-CB 4.32Å; K272-A275 HydrophobicContact CB-CB 4.19Å; K272-A275 VanDerWaalsContact O-CB 3.24Å; K272-A275 WeakPolarHBondContact O-CB 3.44Å; K272-A275 PolarHBondContact O-N 3.49Å; A275-E279 HydrophobicContact CB-CB 4.16Å; A275-E279 HydrophobicContact CB-CG 4.34Å; A275-E279 WeakPolarHBondContact CB-OE2 2.83Å; A275-Y280 HydrophobicContact CB-CD2 4.23Å; A275-Y280 HydrophobicContact CB-CE2 3.72Å; A275-Y280 WeakPolarHBondContact O-CE2 3.43Å
276	P	91.1	Very high	90.9	Very high	67 Å²	67	55.1 Å²	55.1	44%	0.435	28%	0.284	S	S	.	.			trans	-69.7	155.9	176.2	32.7	-37.3	0	0	0	111.1	E278 E279	P276-E278 WeakPolarHBondContact CB-OE2 3.34Å; P276-E278 PolarHBondContact O-N 3.22Å; P276-E278 VanDerWaalsContact O-N 3.08Å; P276-E279 HydrophobicContact CG-CB 4.35Å; P276-E279 PolarHBondContact O-N 2.95Å
277	P	91.6	Very high	90.8	Very high	68 Å²	68	54.3 Å²	54.3	44%	0.442	28%	0.276	S	S	.	.	H	α-helix	trans	-55.4	-30	-175	-26.4	35.5	0	0	0	114.8	E279 Y280 D281 R315	P277-E279 VanDerWaalsContact C-N 3.31Å; P277-E279 PolarHBondContact O-N 3.13Å; P277-Y280 PolarHBondContact O-N 2.96Å; P277-D281 PolarHBondContact O-N 3.44Å; P277-R315 PolarHBondContact O-NH2 3.13Å
278	E	91.8	Very high	90.4	Very high	114 Å²	114	55.6 Å²	55.6	53%	0.533	28%	0.282	S	S	.	.	H	α-helix	trans	-66.6	-32.1	-179.7	-61.5	70.8	-152.3	0	0	112.4	P276 D281 R282	P276-E278 WeakPolarHBondContact CB-OE2 3.34Å; P276-E278 PolarHBondContact O-N 3.22Å; P276-E278 VanDerWaalsContact O-N 3.08Å; E278-D281 PolarHBondContact O-N 3.16Å; E278-R282 WeakPolarHBondContact O-CG 3.43Å; E278-R282 PolarHBondContact O-N 3.5Å
279	E	93.4	Very high	90	Very high	77 Å²	77	57.1 Å²	57.1	36%	0.36	29%	0.292	S	S	.	.	H	α-helix	trans	-72.5	-39.5	178.1	-167.8	173.4	164.2	0	0	110.9	A275 P276 P277 D281 R282 L283	A275-E279 HydrophobicContact CB-CB 4.16Å; A275-E279 HydrophobicContact CB-CG 4.34Å; A275-E279 WeakPolarHBondContact CB-OE2 2.83Å; P276-E279 HydrophobicContact CG-CB 4.35Å; P276-E279 PolarHBondContact O-N 2.95Å; P277-E279 VanDerWaalsContact C-N 3.31Å; P277-E279 PolarHBondContact O-N 3.13Å; E279-D281 VanDerWaalsContact C-N 3.34Å; E279-D281 PolarHBondContact O-N 3.21Å; E279-R282 PolarHBondContact O-N 2.9Å; E279-L283 PolarHBondContact O-N 3.49Å
280	Y	93.7	Very high	89.5	Confident	2 Å²	2	59.1 Å²	59.1	1%	0.008	30%	0.298	C	S	.	.	H	α-helix	trans	-63.8	-38.5	171.1	-73.7	-90.5	0	0	0	112.1	I271 K272 S273 A275 P277 L283 I284 T305 K308 I309	I271-Y280 HydrophobicContact CD1-CD1 3.31Å; I271-Y280 HydrophobicContact CD1-CD2 4.02Å; I271-Y280 HydrophobicContact CD1-CE1 3.39Å; I271-Y280 HydrophobicContact CD1-CE2 4.09Å; I271-Y280 HydrophobicContact CD1-CG 3.63Å; I271-Y280 HydrophobicContact CG1-CD1 4.37Å; I271-Y280 HydrophobicContact CG1-CE1 3.98Å; I271-Y280 HydrophobicContact CG1-CE2 4.46Å; K272-Y280 PolarHBondContact O-OH 2.65Å; K272-Y280 VanDerWaalsContact O-OH 3.05Å; S273-Y280 PolarHBondContact O-OH 3.1Å; A275-Y280 HydrophobicContact CB-CD2 4.23Å; A275-Y280 HydrophobicContact CB-CE2 3.72Å; A275-Y280 WeakPolarHBondContact O-CE2 3.43Å; P277-Y280 PolarHBondContact O-N 2.96Å; Y280-L283 WeakPolarHBondContact O-CB 3.48Å; Y280-L283 PolarHBondContact O-N 3.23Å; Y280-I284 WeakPolarHBondContact O-CG1 3.47Å; Y280-I284 PolarHBondContact O-N 3.1Å; Y280-I284 VanDerWaalsContact O-N 3.13Å; Y280-T305 HydrophobicContact CE1-CG2 3.93Å; Y280-K308 HydrophobicContact CD1-CB 3.8Å; Y280-K308 HydrophobicContact CD2-CB 4.17Å; Y280-K308 HydrophobicContact CD2-CD 4.32Å; Y280-K308 HydrophobicContact CE1-CB 3.52Å; Y280-K308 HydrophobicContact CE1-CD 4.35Å; Y280-K308 HydrophobicContact CE2-CB 3.9Å; Y280-K308 HydrophobicContact CE2-CD 3.5Å; Y280-K308 HydrophobicContact CE2-CG 4.33Å; Y280-K308 HydrophobicContact CG-CB 4.12Å; Y280-K308 WeakPolarHBondContact OH-CD 3.36Å; Y280-I309 HydrophobicContact CD1-CG1 3.94Å; Y280-I309 HydrophobicContact CE1-CG1 3.99Å
281	D	92.8	Very high	88.7	Confident	16 Å²	16	57.2 Å²	57.2	9%	0.086	29%	0.288	C	S	.	.	H	α-helix	trans	-62.1	-43.1	175.1	-78.3	18.6	0	0	0	110.9	P277 E278 E279 I284 D285 R315 V316 K319	P277-D281 PolarHBondContact O-N 3.44Å; E278-D281 PolarHBondContact O-N 3.16Å; E279-D281 VanDerWaalsContact C-N 3.34Å; E279-D281 PolarHBondContact O-N 3.21Å; D281-I284 PolarHBondContact O-N 3.36Å; D281-D285 PolarHBondContact O-N 2.71Å; D281-R315 IonicContact OD1-CZ 3.11Å; D281-R315 VanDerWaalsContact OD1-CZ 3.28Å; D281-R315 IonicContact OD1-NE 3.53Å; D281-R315 PolarHBondContact OD1-NE 3.42Å; D281-R315 IonicContact OD1-NH2 3.07Å; D281-R315 PolarHBondContact OD1-NH2 3.38Å; D281-R315 IonicContact OD2-NE 3.32Å; D281-V316 HydrophobicContact CB-CG2 4.3Å; D281-K319 IonicContact OD2-NZ 2.64Å; D281-K319 PolarHBondContact OD2-NZ 3.28Å
282	R	92.9	Very high	88	Confident	179 Å²	179	62.2 Å²	62.2	68%	0.675	32%	0.321	S	S	*	.	H	α-helix	trans	-64.3	-39.1	175.8	-70.9	176.5	-163.3	164.7	5.3	113	E278 E279 I284 D285 S286	E278-R282 WeakPolarHBondContact O-CG 3.43Å; E278-R282 PolarHBondContact O-N 3.5Å; E279-R282 PolarHBondContact O-N 2.9Å; R282-I284 VanDerWaalsContact C-N 3.31Å; R282-I284 PolarHBondContact O-N 2.85Å; R282-D285 PolarHBondContact O-N 3.17Å; R282-S286 WeakPolarHBondContact O-CB 3.38Å; R282-S286 PolarHBondContact O-N 3.22Å
283	L	92.2	Very high	87.5	Confident	12 Å²	12	61.9 Å²	61.9	6%	0.063	32%	0.32	C	S	.	.	H	α-helix	trans	-55.7	-49.1	173.5	170.5	65.3	0	0	0	110.2	I239 E269 I271 E279 Y280 S286 L287 I309	I239-L283 HydrophobicContact CG2-CD2 4.09Å; E269-L283 HydrophobicContact CB-CD1 3.36Å; E269-L283 HydrophobicContact CG-CD1 3.65Å; I271-L283 HydrophobicContact CB-CD2 4.31Å; I271-L283 HydrophobicContact CD1-CB 4.28Å; I271-L283 HydrophobicContact CD1-CD2 3.58Å; I271-L283 HydrophobicContact CG2-CD2 4.32Å; E279-L283 PolarHBondContact O-N 3.49Å; Y280-L283 WeakPolarHBondContact O-CB 3.48Å; Y280-L283 PolarHBondContact O-N 3.23Å; L283-S286 WeakPolarHBondContact O-CB 3.44Å; L283-S286 PolarHBondContact O-N 2.73Å; L283-L287 HydrophobicContact CD1-CD1 3.79Å; L283-L287 HydrophobicContact CD1-CG 4.26Å; L283-L287 HydrophobicContact CG-CD1 3.9Å; L283-L287 WeakPolarHBondContact O-CD1 3.34Å; L283-L287 VanDerWaalsContact O-CG 3.23Å; L283-L287 WeakPolarHBondContact O-CG 2.93Å; L283-L287 PolarHBondContact O-N 2.87Å; L283-I309 HydrophobicContact CD2-CG1 4.44Å
284	I	91	Very high	87.5	Confident	1 Å²	1	61 Å²	61	1%	0.005	31%	0.313	C	S	.	.	H	α-helix	trans	-64.2	-41.9	178.4	-63.3	-55	0	0	0	111.7	Y280 D281 R282 L287 M288 I309 A312 T313 V316 V344	Y280-I284 WeakPolarHBondContact O-CG1 3.47Å; Y280-I284 PolarHBondContact O-N 3.1Å; Y280-I284 VanDerWaalsContact O-N 3.13Å; D281-I284 PolarHBondContact O-N 3.36Å; R282-I284 VanDerWaalsContact C-N 3.31Å; R282-I284 PolarHBondContact O-N 2.85Å; I284-L287 PolarHBondContact O-N 2.67Å; I284-M288 VanDerWaalsContact O-CG 3.28Å; I284-M288 WeakPolarHBondContact O-CG 3.44Å; I284-M288 PolarHBondContact O-N 3.38Å; I284-I309 HydrophobicContact CD1-CG2 4.29Å; I284-A312 HydrophobicContact CG1-CB 3.95Å; I284-T313 VanDerWaalsContact CD1-OG1 3.31Å; I284-T313 WeakPolarHBondContact CD1-OG1 3.21Å; I284-V316 HydrophobicContact CB-CG2 4.1Å; I284-V316 HydrophobicContact CG2-CB 3.84Å; I284-V316 HydrophobicContact CG2-CG1 3.91Å; I284-V316 HydrophobicContact CG2-CG2 3.87Å; I284-V344 HydrophobicContact CD1-CG1 4.35Å; I284-V344 HydrophobicContact CG2-CB 4.42Å; I284-V344 HydrophobicContact CG2-CG1 3.87Å; I284-V344 HydrophobicContact CG2-CG2 3.69Å
285	D	88.4	Confident	87.7	Confident	86 Å²	86	56.1 Å²	56.1	46%	0.46	29%	0.288	S	S	.	.	H	α-helix	trans	-63.4	-40	176.6	-73.9	-26.7	0	0	0	112.3	D281 R282 M288 S289 V316	D281-D285 PolarHBondContact O-N 2.71Å; R282-D285 PolarHBondContact O-N 3.17Å; D285-M288 PolarHBondContact O-N 2.99Å; D285-S289 PolarHBondContact O-N 3.14Å; D285-V316 WeakPolarHBondContact OD1-CG1 3.44Å
286	S	87.6	Confident	87.9	Confident	39 Å²	39	55.8 Å²	55.8	27%	0.273	29%	0.286	S	S	.	.	H	α-helix	trans	-59.3	-51.2	173.7	-179.6	0	0	0	0	110.7	E269 R282 L283 M288 S289 Y290	E269-S286 PolarHBondContact OE1-OG 3.42Å; R282-S286 WeakPolarHBondContact O-CB 3.38Å; R282-S286 PolarHBondContact O-N 3.22Å; L283-S286 WeakPolarHBondContact O-CB 3.44Å; L283-S286 PolarHBondContact O-N 2.73Å; S286-M288 VanDerWaalsContact C-N 3.29Å; S286-M288 PolarHBondContact O-N 3.28Å; S286-S289 VanDerWaalsContact O-CB 3.28Å; S286-S289 WeakPolarHBondContact O-CB 3.44Å; S286-S289 PolarHBondContact O-N 2.82Å; S286-S289 PolarHBondContact O-OG 3.48Å; S286-Y290 WeakPolarHBondContact O-CD2 3.41Å
287	L	87.7	Confident	87.9	Confident	2 Å²	2	52.6 Å²	52.6	1%	0.01	27%	0.265	C	S	.	.	H	α-helix	trans	-63.6	-34.1	-178.6	-68.1	167.1	0	0	0	112.6	A237 I239 V267 E269 L283 I284 S289 Y290 F345	A237-L287 HydrophobicContact CB-CD2 4.17Å; I239-L287 HydrophobicContact CD1-CD1 3.5Å; I239-L287 HydrophobicContact CG1-CD1 4.12Å; V267-L287 HydrophobicContact CG1-CD2 3.88Å; E269-L287 HydrophobicContact CG-CD2 4.01Å; L283-L287 HydrophobicContact CD1-CD1 3.79Å; L283-L287 HydrophobicContact CD1-CG 4.26Å; L283-L287 HydrophobicContact CG-CD1 3.9Å; L283-L287 WeakPolarHBondContact O-CD1 3.34Å; L283-L287 VanDerWaalsContact O-CG 3.23Å; L283-L287 WeakPolarHBondContact O-CG 2.93Å; L283-L287 PolarHBondContact O-N 2.87Å; I284-L287 PolarHBondContact O-N 2.67Å; L287-S289 PolarHBondContact O-N 2.93Å; L287-Y290 PolarHBondContact O-N 2.99Å; L287-F345 HydrophobicContact CB-CE2 4.29Å; L287-F345 HydrophobicContact CB-CZ 3.73Å; L287-F345 HydrophobicContact CD1-CE2 3.86Å; L287-F345 HydrophobicContact CD1-CZ 3.75Å; L287-F345 HydrophobicContact CD2-CZ 4.06Å; L287-F345 HydrophobicContact CG-CZ 4.04Å
288	M	84.1	Confident	88.1	Confident	41 Å²	41	49.4 Å²	49.4	20%	0.202	24%	0.244	C	C	.	.	H	α-helix	trans	-63.2	-28.4	173.6	-77.8	-62.9	-71.5	0	0	113.3	I284 D285 S286 Y290 R291 L320 V344	I284-M288 VanDerWaalsContact O-CG 3.28Å; I284-M288 WeakPolarHBondContact O-CG 3.44Å; I284-M288 PolarHBondContact O-N 3.38Å; D285-M288 PolarHBondContact O-N 2.99Å; S286-M288 VanDerWaalsContact C-N 3.29Å; S286-M288 PolarHBondContact O-N 3.28Å; M288-Y290 PolarHBondContact O-N 3.4Å; M288-R291 WeakPolarHBondContact O-CB 3.24Å; M288-R291 PolarHBondContact O-N 2.9Å; M288-R291 HydrophobicContact SD-CG 4.35Å; M288-L320 HydrophobicContact CE-CD1 4.3Å; M288-V344 HydrophobicContact CG-CG1 4.13Å; M288-V344 HydrophobicContact CG-CG2 4.12Å; M288-V344 WeakPolarHBondContact SD-CA 3.32Å; M288-V344 HydrophobicContact SD-CB 3.89Å; M288-V344 HydrophobicContact SD-CG1 3.94Å; M288-V344 HydrophobicContact SD-CG2 3.73Å
289	S	84.7	Confident	88.2	Confident	86 Å²	86	44 Å²	44	60%	0.601	22%	0.219	S	C	*	.	H	α-helix	trans	-65.7	-22.4	179.8	78.4	0	0	0	0	113.4	D285 S286 L287	D285-S289 PolarHBondContact O-N 3.14Å; S286-S289 VanDerWaalsContact O-CB 3.28Å; S286-S289 WeakPolarHBondContact O-CB 3.44Å; S286-S289 PolarHBondContact O-N 2.82Å; S286-S289 PolarHBondContact O-OG 3.48Å; L287-S289 PolarHBondContact O-N 2.93Å
290	Y	85	Confident	88.1	Confident	91 Å²	91	40.3 Å²	40.3	36%	0.357	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.8	-2.5	178.4	-64.9	-85.5	0	0	0	114	V267 S286 L287 M288 K293 I294	V267-Y290 HydrophobicContact CB-CD2 4.42Å; V267-Y290 HydrophobicContact CB-CE1 4.35Å; V267-Y290 HydrophobicContact CB-CE2 4.06Å; V267-Y290 HydrophobicContact CG1-CD2 4.22Å; V267-Y290 HydrophobicContact CG1-CE2 4.3Å; V267-Y290 HydrophobicContact CG2-CD2 4.48Å; V267-Y290 HydrophobicContact CG2-CE2 3.76Å; S286-Y290 WeakPolarHBondContact O-CD2 3.41Å; L287-Y290 PolarHBondContact O-N 2.99Å; M288-Y290 PolarHBondContact O-N 3.4Å; Y290-K293 PolarHBondContact O-N 3.15Å; Y290-K293 VanDerWaalsContact O-N 3.1Å; Y290-I294 HydrophobicContact CD1-CD1 4.1Å; Y290-I294 HydrophobicContact CG-CD1 3.99Å; Y290-I294 PolarHBondContact O-N 2.64Å
291	R	77.6	Confident	88	Confident	55 Å²	55	40.2 Å²	40.2	21%	0.208	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.4	145.4	171.4	-78.2	-71.4	-145.3	-105.8	12.3	110.7	M288 I294 T295 F343 V344 F345 D346	M288-R291 WeakPolarHBondContact O-CB 3.24Å; M288-R291 PolarHBondContact O-N 2.9Å; M288-R291 HydrophobicContact SD-CG 4.35Å; R291-I294 WeakPolarHBondContact CD-O 3.43Å; R291-I294 PolarHBondContact NH1-O 3.45Å; R291-T295 VanDerWaalsContact NH1-CA 3.34Å; R291-F343 PolarHBondContact NE-O 3.32Å; R291-F343 PolarHBondContact NH2-O 3.47Å; R291-V344 VanDerWaalsContact CZ-C 3.45Å; R291-V344 PolarHBondContact NH1-O 3.34Å; R291-V344 PolarHBondContact NH2-O 3.1Å; R291-F345 VanDerWaalsContact NH2-C 3.25Å; R291-D346 IonicContact NH2-OD1 3.12Å; R291-D346 PolarHBondContact NH2-OD1 3.06Å
292	P	77.3	Confident	87.7	Confident	110 Å²	110	41.9 Å²	41.9	71%	0.714	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	cis	-90.5	5.8	5.5	35.9	-36.2	0	0	0	115.2
293	K	80.3	Confident	87.2	Confident	113 Å²	113	33.5 Å²	33.5	49%	0.491	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-43.2	-172.1	-64.4	-174.3	179.2	-174.6	0	113.3	Y235 Y290	Y235-K293 HydrophobicContact CD1-CB 4.33Å; Y235-K293 HydrophobicContact CE1-CB 4.29Å; Y290-K293 PolarHBondContact O-N 3.15Å; Y290-K293 VanDerWaalsContact O-N 3.1Å
294	I	85.4	Confident	86.8	Confident	2 Å²	2	37 Å²	37	1%	0.01	20%	0.197	C	C	.	.			trans	-95.5	108.2	179	-58.4	-174.2	0	0	0	109	Y235 A237 V267 Y290 R291 F345	Y235-I294 HydrophobicContact CD1-CD1 4.26Å; Y235-I294 HydrophobicContact CD1-CG1 3.58Å; Y235-I294 HydrophobicContact CE1-CD1 3.71Å; Y235-I294 HydrophobicContact CE1-CG1 3.38Å; A237-I294 HydrophobicContact CB-CG2 3.63Å; V267-I294 HydrophobicContact CB-CD1 4.36Å; V267-I294 HydrophobicContact CG1-CD1 3.73Å; Y290-I294 HydrophobicContact CD1-CD1 4.1Å; Y290-I294 HydrophobicContact CG-CD1 3.99Å; Y290-I294 PolarHBondContact O-N 2.64Å; R291-I294 WeakPolarHBondContact CD-O 3.43Å; R291-I294 PolarHBondContact NH1-O 3.45Å; I294-F345 HydrophobicContact CG2-CE1 4.29Å
295	T	86.1	Confident	86.8	Confident	11 Å²	11	36.9 Å²	36.9	7%	0.067	20%	0.196	C	C	.	.			trans	-109.4	-19.3	178.8	54.5	0	0	0	0	113.7	R291 D346 V347 V576 A577	R291-T295 VanDerWaalsContact NH1-CA 3.34Å; T295-D346 PolarHBondContact O-N 2.78Å; T295-V347 PolarHBondContact O-N 3.09Å; T295-V576 PolarHBondContact OG1-O 3.48Å; T295-A577 WeakPolarHBondContact OG1-CB 3.2Å
296	V	90.8	Very high	86.9	Confident	0 Å²	0	32.8 Å²	32.8	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	132.2	-175.9	177.2	0	0	0	0	109.7	W233 V236 A237 V347 A577	W233-V296 HydrophobicContact CD2-CG1 4.39Å; W233-V296 HydrophobicContact CD2-CG2 3.73Å; W233-V296 HydrophobicContact CE3-CB 4.46Å; W233-V296 HydrophobicContact CE3-CG1 3.83Å; W233-V296 HydrophobicContact CE3-CG2 3.97Å; W233-V296 HydrophobicContact CG-CG2 4.22Å; W233-V296 HydrophobicContact CH2-CG2 4.31Å; W233-V296 HydrophobicContact CZ2-CG2 4.06Å; W233-V296 HydrophobicContact CZ3-CG1 4Å; W233-V296 HydrophobicContact CZ3-CG2 4.27Å; V236-V296 HydrophobicContact CG1-CB 4.16Å; V236-V296 HydrophobicContact CG1-CG1 4.08Å; A237-V296 PolarHBondContact N-O 3.08Å; V296-V347 WeakPolarHBondContact CA-O 3.43Å; V296-V347 HydrophobicContact CG2-CB 4.22Å; V296-V347 HydrophobicContact CG2-CG2 4.44Å; V296-A577 HydrophobicContact CB-CB 4.14Å; V296-A577 HydrophobicContact CG2-CB 3.71Å
297	A	92.7	Very high	87.1	Confident	0 Å²	0	34 Å²	34	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	137.2	172	0	0	0	0	0	111.5	A237 F345 V347 C348 I349	A237-A297 HydrophobicContact CB-CB 4.23Å; A237-A297 CarbonylContact O-C 3.56Å; A237-A297 WeakPolarHBondContact O-CA 3.29Å; A297-F345 HydrophobicContact CB-CD1 3.74Å; A297-F345 HydrophobicContact CB-CD2 4.01Å; A297-F345 HydrophobicContact CB-CE1 3.64Å; A297-F345 HydrophobicContact CB-CE2 3.9Å; A297-F345 HydrophobicContact CB-CG 3.92Å; A297-F345 HydrophobicContact CB-CZ 3.7Å; A297-V347 PolarHBondContact N-O 3.25Å; A297-C348 CarbonylContact O-C 3.56Å; A297-C348 WeakPolarHBondContact O-CA 3.36Å; A297-I349 PolarHBondContact O-N 3.25Å
298	I	94.7	Very high	87.3	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	132.8	170.8	-55.6	176.1	0	0	0	108	M224 V228 V236 A237 V238 I239 L253 F257 I349	M224-I298 HydrophobicContact CG-CG2 4.48Å; M224-I298 HydrophobicContact SD-CG2 3.44Å; M224-I298 WeakPolarHBondContact SD-CG2 3.27Å; V228-I298 HydrophobicContact CG2-CD1 3.83Å; V236-I298 HydrophobicContact CG2-CD1 4Å; V236-I298 HydrophobicContact CG2-CG1 4.48Å; A237-I298 PolarHBondContact O-N 3.32Å; V238-I298 CarbonylContact C-O 3.49Å; V238-I298 VanDerWaalsContact CA-O 3.26Å; V238-I298 WeakPolarHBondContact CA-O 3.35Å; V238-I298 HydrophobicContact CG2-CB 4.38Å; I239-I298 PolarHBondContact N-O 3.13Å; L253-I298 HydrophobicContact CD1-CD1 4.32Å; L253-I298 HydrophobicContact CD1-CG2 4.41Å; L253-I298 HydrophobicContact CD2-CB 4.1Å; L253-I298 HydrophobicContact CD2-CD1 4.16Å; L253-I298 HydrophobicContact CD2-CG2 3.63Å; F257-I298 HydrophobicContact CE2-CD1 3.79Å; F257-I298 HydrophobicContact CZ-CD1 3.74Å; I298-I349 CarbonylContact C-O 3.52Å; I298-I349 WeakPolarHBondContact CA-O 3.2Å; I298-I349 HydrophobicContact CG1-CD1 4.46Å
299	C	94	Very high	87.7	Confident	1 Å²	1	35 Å²	35	1%	0.007	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	109.8	-170.8	-64.3	0	0	0	0	111.4	I239 I349 F350 S351	I239-C299 CarbonylContact O-C 3.55Å; I239-C299 WeakPolarHBondContact O-CA 3.11Å; C299-I349 PolarHBondContact N-O 3.12Å; C299-F350 HydrophobicContact CB-CD1 3.16Å; C299-F350 HydrophobicContact CB-CE1 3.44Å; C299-F350 VanDerWaalsContact CB-CE1 3.44Å; C299-F350 HydrophobicContact CB-CG 3.99Å; C299-F350 HydrophobicContact CB-CZ 4.47Å; C299-F350 WeakPolarHBondContact O-CA 3.32Å; C299-F350 WeakPolarHBondContact SG-CE1 3.46Å; C299-S351 PolarHBondContact O-N 3.06Å
300	F	92.4	Very high	88	Confident	0 Å²	0	31.2 Å²	31.2	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	80.2	168.4	-90.6	-80.2	0	0	0	109.2	D217 Q220 A221 M224 I239 Y240 T241 L253	D217-F300 HydrophobicContact CB-CE1 4.36Å; Q220-F300 HydrophobicContact CG-CZ 4.5Å; A221-F300 HydrophobicContact CB-CE2 4.39Å; A221-F300 HydrophobicContact CB-CZ 4.05Å; M224-F300 HydrophobicContact CE-CE1 4.3Å; M224-F300 HydrophobicContact CE-CE2 4.04Å; M224-F300 HydrophobicContact CE-CZ 3.91Å; M224-F300 HydrophobicContact SD-CD2 4.1Å; M224-F300 HydrophobicContact SD-CE2 3.36Å; M224-F300 WeakPolarHBondContact SD-CE2 3.43Å; M224-F300 HydrophobicContact SD-CZ 3.63Å; I239-F300 PolarHBondContact O-N 2.99Å; Y240-F300 VanDerWaalsContact CA-O 3.26Å; Y240-F300 WeakPolarHBondContact CA-O 3.27Å; T241-F300 PolarHBondContact N-O 3.13Å; L253-F300 HydrophobicContact CB-CE2 4.12Å; L253-F300 HydrophobicContact CD1-CE2 4.31Å; L253-F300 HydrophobicContact CD2-CD2 4.33Å; L253-F300 HydrophobicContact CD2-CE2 4.25Å; L253-F300 HydrophobicContact CG-CE2 4.47Å
301	C	90.8	Very high	88.4	Confident	0 Å²	0	30 Å²	30	0%	0	15%	0.148	C	C	.	.			trans	-133.6	148.4	-169.5	-70.2	0	0	0	0	112.2	T241 T305 I306 S351 S353	T241-C301 VanDerWaalsContact OG1-CA 3.23Å; T241-C301 WeakPolarHBondContact OG1-CA 3.43Å; T241-C301 WeakPolarHBondContact OG1-CB 3.19Å; T241-C301 PolarHBondContact OG1-SG 3.49Å; C301-T305 HydrophobicContact CB-CG2 4.08Å; C301-I306 HydrophobicContact CB-CD1 4.35Å; C301-I306 HydrophobicContact CB-CG1 3.75Å; C301-I306 WeakPolarHBondContact O-CD1 3.37Å; C301-S351 PolarHBondContact O-OG 2.96Å; C301-S353 VanDerWaalsContact O-CB 3.24Å; C301-S353 WeakPolarHBondContact O-CB 3.31Å
302	E	85.7	Confident	89.1	Confident	50 Å²	50	27.4 Å²	27.4	23%	0.234	14%	0.139	C	C	.	.			trans	-65.8	154.6	169.5	-60.5	-176.3	146.4	0	0	111.1	T241 Y245 S273 D304 T305 I306	T241-E302 HydrophobicContact CG2-CG 4.23Å; T241-E302 PolarHBondContact OG1-N 2.92Å; Y245-E302 HydrophobicContact CD1-CG 4.45Å; S273-E302 VanDerWaalsContact CB-OE2 3.31Å; S273-E302 WeakPolarHBondContact CB-OE2 3.45Å; S273-E302 PolarHBondContact OG-OE2 2.97Å; E302-D304 VanDerWaalsContact C-N 3.25Å; E302-D304 PolarHBondContact O-N 2.81Å; E302-T305 WeakPolarHBondContact O-CB 3.47Å; E302-T305 PolarHBondContact O-N 2.73Å; E302-T305 VanDerWaalsContact O-N 3.08Å; E302-I306 WeakPolarHBondContact O-CG1 3.37Å; E302-I306 PolarHBondContact O-N 2.99Å
303	G	84	Confident	89.7	Confident	4 Å²	4	23 Å²	23	4%	0.041	11%	0.11	C	C	.	.	H	α-helix	trans	-58.6	-33	-176.3	0	0	0	0	0	114.4	I306 K307	G303-I306 PolarHBondContact O-N 3.32Å; G303-K307 PolarHBondContact O-N 2.9Å; G303-K307 VanDerWaalsContact O-N 3.08Å
304	D	83.5	Confident	90.2	Very high	84 Å²	84	20.2 Å²	20.2	45%	0.449	10%	0.098	S	C	.	.	H	α-helix	trans	-72.9	-37.7	178	-70.3	-2.3	0	0	0	111.7	E302 K307 K308 R357	E302-D304 VanDerWaalsContact C-N 3.25Å; E302-D304 PolarHBondContact O-N 2.81Å; D304-K307 PolarHBondContact O-N 3.4Å; D304-K308 WeakPolarHBondContact O-CG 3.23Å; D304-K308 PolarHBondContact O-N 2.89Å; D304-K308 VanDerWaalsContact O-N 3.11Å; D304-R357 IonicContact OD1-NH2 3.95Å; D304-R357 PolarHBondContact OD1-NH2 3.13Å
305	T	90.2	Very high	90.4	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-60.4	-45.4	170.3	-55	0	0	0	0	110.7	T241 I271 S273 Y280 C301 E302 K307 K308 I309	T241-T305 WeakPolarHBondContact OG1-CB 3.36Å; T241-T305 WeakPolarHBondContact OG1-CG2 3.32Å; T241-T305 PolarHBondContact OG1-OG1 3.25Å; I271-T305 HydrophobicContact CG2-CG2 3.69Å; S273-T305 WeakPolarHBondContact CA-OG1 3.4Å; S273-T305 PolarHBondContact OG-OG1 3.05Å; Y280-T305 HydrophobicContact CE1-CG2 3.93Å; C301-T305 HydrophobicContact CB-CG2 4.08Å; E302-T305 WeakPolarHBondContact O-CB 3.47Å; E302-T305 PolarHBondContact O-N 2.73Å; E302-T305 VanDerWaalsContact O-N 3.08Å; T305-K307 VanDerWaalsContact C-N 3.34Å; T305-K307 PolarHBondContact O-N 3.1Å; T305-K308 PolarHBondContact O-N 2.73Å; T305-I309 HydrophobicContact CG2-CD1 3.95Å; T305-I309 HydrophobicContact CG2-CG1 4.41Å; T305-I309 WeakPolarHBondContact O-CG1 3.37Å; T305-I309 PolarHBondContact O-N 3.48Å
306	I	91.6	Very high	90.4	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-59.1	-45.5	179.3	-65.6	172.8	0	0	0	110.8	C301 E302 G303 K308 I309 F310 F350 W354 V360	C301-I306 HydrophobicContact CB-CD1 4.35Å; C301-I306 HydrophobicContact CB-CG1 3.75Å; C301-I306 WeakPolarHBondContact O-CD1 3.37Å; E302-I306 WeakPolarHBondContact O-CG1 3.37Å; E302-I306 PolarHBondContact O-N 2.99Å; G303-I306 PolarHBondContact O-N 3.32Å; I306-K308 PolarHBondContact O-N 3.02Å; I306-I309 WeakPolarHBondContact O-CB 3.5Å; I306-I309 PolarHBondContact O-N 3.08Å; I306-F310 HydrophobicContact CG2-CD2 3.93Å; I306-F310 HydrophobicContact CG2-CE2 3.46Å; I306-F310 VanDerWaalsContact CG2-CE2 3.46Å; I306-F310 HydrophobicContact CG2-CZ 4.06Å; I306-F310 WeakPolarHBondContact O-CD2 3.45Å; I306-F310 PolarHBondContact O-N 2.76Å; I306-F350 HydrophobicContact CB-CD1 4.37Å; I306-F350 HydrophobicContact CB-CE1 4.34Å; I306-F350 HydrophobicContact CD1-CB 4.12Å; I306-F350 HydrophobicContact CD1-CD1 3.65Å; I306-F350 HydrophobicContact CD1-CE1 4.43Å; I306-F350 HydrophobicContact CD1-CG 4.15Å; I306-F350 HydrophobicContact CG1-CD1 3.59Å; I306-F350 HydrophobicContact CG1-CE1 3.9Å; I306-F350 HydrophobicContact CG1-CG 4.49Å; I306-F350 HydrophobicContact CG2-CD1 3.94Å; I306-F350 HydrophobicContact CG2-CE1 3.83Å; I306-F350 HydrophobicContact CG2-CG 4.41Å; I306-F350 HydrophobicContact CG2-CZ 4.16Å; I306-W354 HydrophobicContact CD1-CB 3.99Å; I306-W354 HydrophobicContact CD1-CG 3.88Å; I306-W354 HydrophobicContact CG2-CG 4.44Å; I306-V360 HydrophobicContact CB-CG1 4.12Å; I306-V360 HydrophobicContact CG2-CG1 3.72Å
307	K	91	Very high	90	Very high	65 Å²	65	24.8 Å²	24.8	28%	0.283	11%	0.114	S	C	.	.	H	α-helix	trans	-57.6	-48.6	175.9	179.8	172.7	179.6	167.8	0	111.6	G303 D304 T305 I309 F310 E311 D359 V360	G303-K307 PolarHBondContact O-N 2.9Å; G303-K307 VanDerWaalsContact O-N 3.08Å; D304-K307 PolarHBondContact O-N 3.4Å; T305-K307 VanDerWaalsContact C-N 3.34Å; T305-K307 PolarHBondContact O-N 3.1Å; K307-I309 VanDerWaalsContact C-N 3.32Å; K307-I309 PolarHBondContact O-N 3.17Å; K307-F310 PolarHBondContact O-N 2.94Å; K307-F310 VanDerWaalsContact O-N 3.15Å; K307-E311 WeakPolarHBondContact CE-OE1 3.16Å; K307-E311 HydrophobicContact CG-CG 4.47Å; K307-E311 WeakPolarHBondContact O-CG 3.23Å; K307-E311 PolarHBondContact O-N 3.24Å; K307-D359 PolarHBondContact NZ-O 3.31Å; K307-V360 HydrophobicContact CB-CG1 4.11Å
308	K	92	Very high	89.5	Confident	58 Å²	58	29.9 Å²	29.9	25%	0.252	14%	0.138	S	C	.	.	H	α-helix	trans	-64.1	-35.6	179.5	-70.4	177.2	-179.4	-177.6	0	112.6	S273 Y280 D304 T305 I306 E311 A312	S273-K308 PolarHBondContact O-NZ 3.17Å; Y280-K308 HydrophobicContact CD1-CB 3.8Å; Y280-K308 HydrophobicContact CD2-CB 4.17Å; Y280-K308 HydrophobicContact CD2-CD 4.32Å; Y280-K308 HydrophobicContact CE1-CB 3.52Å; Y280-K308 HydrophobicContact CE1-CD 4.35Å; Y280-K308 HydrophobicContact CE2-CB 3.9Å; Y280-K308 HydrophobicContact CE2-CD 3.5Å; Y280-K308 HydrophobicContact CE2-CG 4.33Å; Y280-K308 HydrophobicContact CG-CB 4.12Å; Y280-K308 WeakPolarHBondContact OH-CD 3.36Å; D304-K308 WeakPolarHBondContact O-CG 3.23Å; D304-K308 PolarHBondContact O-N 2.89Å; D304-K308 VanDerWaalsContact O-N 3.11Å; T305-K308 PolarHBondContact O-N 2.73Å; I306-K308 PolarHBondContact O-N 3.02Å; K308-E311 PolarHBondContact O-N 2.85Å; K308-A312 VanDerWaalsContact O-CB 3.3Å; K308-A312 WeakPolarHBondContact O-CB 3.3Å; K308-A312 PolarHBondContact O-N 2.78Å
309	I	92.4	Very high	88.9	Confident	6 Å²	6	35.6 Å²	35.6	3%	0.031	16%	0.162	C	C	.	.	H	α-helix	trans	-60.5	-46.1	171.7	-71.8	169.1	0	0	0	110.4	I239 Y280 L283 I284 T305 I306 K307 A312 T313	I239-I309 HydrophobicContact CG2-CD1 4.1Å; Y280-I309 HydrophobicContact CD1-CG1 3.94Å; Y280-I309 HydrophobicContact CE1-CG1 3.99Å; L283-I309 HydrophobicContact CD2-CG1 4.44Å; I284-I309 HydrophobicContact CD1-CG2 4.29Å; T305-I309 HydrophobicContact CG2-CD1 3.95Å; T305-I309 HydrophobicContact CG2-CG1 4.41Å; T305-I309 WeakPolarHBondContact O-CG1 3.37Å; T305-I309 PolarHBondContact O-N 3.48Å; I306-I309 WeakPolarHBondContact O-CB 3.5Å; I306-I309 PolarHBondContact O-N 3.08Å; K307-I309 VanDerWaalsContact C-N 3.32Å; K307-I309 PolarHBondContact O-N 3.17Å; I309-A312 PolarHBondContact O-N 3.43Å; I309-T313 VanDerWaalsContact O-CB 3.32Å; I309-T313 WeakPolarHBondContact O-CB 3.36Å; I309-T313 PolarHBondContact O-N 2.98Å; I309-T313 PolarHBondContact O-OG1 3.45Å
310	F	91.7	Very high	87.9	Confident	5 Å²	5	38.3 Å²	38.3	2%	0.022	18%	0.176	C	C	.	.	H	α-helix	trans	-65.5	-40.6	176.9	-70	-42.1	0	0	0	112.7	I306 K307 T313 K314 F350 W354 V360 V364 V367 A368 A371	I306-F310 HydrophobicContact CG2-CD2 3.93Å; I306-F310 HydrophobicContact CG2-CE2 3.46Å; I306-F310 VanDerWaalsContact CG2-CE2 3.46Å; I306-F310 HydrophobicContact CG2-CZ 4.06Å; I306-F310 WeakPolarHBondContact O-CD2 3.45Å; I306-F310 PolarHBondContact O-N 2.76Å; K307-F310 PolarHBondContact O-N 2.94Å; K307-F310 VanDerWaalsContact O-N 3.15Å; F310-T313 PolarHBondContact O-N 2.74Å; F310-K314 WeakPolarHBondContact O-CB 3.49Å; F310-K314 PolarHBondContact O-N 2.88Å; F310-F350 AromaticContact CE1-CE2 3.72Å; F310-F350 HydrophobicContact CE1-CE2 3.72Å; F310-F350 AromaticContact CE1-CZ 3.79Å; F310-F350 HydrophobicContact CE1-CZ 3.79Å; F310-F350 HydrophobicContact CE2-CE2 4.44Å; F310-F350 HydrophobicContact CZ-CD2 4.26Å; F310-F350 AromaticContact CZ-CE2 3.42Å; F310-F350 HydrophobicContact CZ-CE2 3.42Å; F310-F350 VanDerWaalsContact CZ-CE2 3.42Å; F310-F350 AromaticContact CZ-CZ 3.74Å; F310-F350 HydrophobicContact CZ-CZ 3.74Å; F310-W354 HydrophobicContact CE2-CZ3 4.46Å; F310-V360 HydrophobicContact CE2-CG1 4.48Å; F310-V364 HydrophobicContact CB-CB 3.85Å; F310-V364 HydrophobicContact CB-CG1 4.21Å; F310-V364 HydrophobicContact CB-CG2 3.64Å; F310-V364 HydrophobicContact CD2-CG2 4.16Å; F310-V364 HydrophobicContact CG-CG2 4.24Å; F310-V367 HydrophobicContact CD1-CG1 3.93Å; F310-A368 HydrophobicContact CD1-CB 4.45Å; F310-A368 HydrophobicContact CD2-CB 4.2Å; F310-A368 HydrophobicContact CE1-CB 4.11Å; F310-A368 HydrophobicContact CE2-CB 3.83Å; F310-A368 HydrophobicContact CZ-CB 3.78Å; F310-A371 HydrophobicContact CZ-CB 4.4Å
311	E	93	Very high	86.8	Confident	66 Å²	66	42.5 Å²	42.5	31%	0.308	20%	0.195	S	C	.	.	H	α-helix	trans	-63.3	-44.2	175.3	-71	175.3	174.9	0	0	111.7	K307 K308 K314 R315 V364	K307-E311 WeakPolarHBondContact CE-OE1 3.16Å; K307-E311 HydrophobicContact CG-CG 4.47Å; K307-E311 WeakPolarHBondContact O-CG 3.23Å; K307-E311 PolarHBondContact O-N 3.24Å; K308-E311 PolarHBondContact O-N 2.85Å; E311-K314 WeakPolarHBondContact O-CB 3.47Å; E311-K314 PolarHBondContact O-N 3.37Å; E311-R315 WeakPolarHBondContact O-CG 3.18Å; E311-R315 PolarHBondContact O-N 3.12Å; E311-V364 HydrophobicContact CG-CG1 3.81Å
312	A	92.3	Very high	85.7	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-63.1	-44.4	175.3	0	0	0	0	0	111.8	I284 K308 I309 K314 R315 V316	I284-A312 HydrophobicContact CG1-CB 3.95Å; K308-A312 VanDerWaalsContact O-CB 3.3Å; K308-A312 WeakPolarHBondContact O-CB 3.3Å; K308-A312 PolarHBondContact O-N 2.78Å; I309-A312 PolarHBondContact O-N 3.43Å; A312-K314 VanDerWaalsContact C-N 3.27Å; A312-K314 PolarHBondContact O-N 3.22Å; A312-R315 PolarHBondContact O-N 2.79Å; A312-R315 VanDerWaalsContact O-N 3.14Å; A312-V316 WeakPolarHBondContact O-CG2 3.47Å; A312-V316 PolarHBondContact O-N 3.37Å
313	T	90.2	Very high	84.7	Confident	17 Å²	17	54.2 Å²	54.2	10%	0.104	25%	0.247	C	C	.	.	H	α-helix	trans	-57.5	-42.4	174.4	-60.3	0	0	0	0	111.1	I284 I309 F310 R317 V344 V367	I284-T313 VanDerWaalsContact CD1-OG1 3.31Å; I284-T313 WeakPolarHBondContact CD1-OG1 3.21Å; I309-T313 VanDerWaalsContact O-CB 3.32Å; I309-T313 WeakPolarHBondContact O-CB 3.36Å; I309-T313 PolarHBondContact O-N 2.98Å; I309-T313 PolarHBondContact O-OG1 3.45Å; F310-T313 PolarHBondContact O-N 2.74Å; T313-R317 WeakPolarHBondContact O-CB 3.2Å; T313-R317 PolarHBondContact O-N 2.99Å; T313-V344 HydrophobicContact CG2-CB 4.08Å; T313-V344 HydrophobicContact CG2-CG2 3.77Å; T313-V367 HydrophobicContact CG2-CG1 3.39Å
314	K	89.2	Confident	83.4	Confident	55 Å²	55	55.1 Å²	55.1	24%	0.239	25%	0.253	C	S	.	.	H	α-helix	trans	-62.6	-46.4	175.2	-171.3	165.7	-178.3	150.4	0	111.9	F310 E311 A312 R317 Q318 G363 V364 D366 V367	F310-K314 WeakPolarHBondContact O-CB 3.49Å; F310-K314 PolarHBondContact O-N 2.88Å; E311-K314 WeakPolarHBondContact O-CB 3.47Å; E311-K314 PolarHBondContact O-N 3.37Å; A312-K314 VanDerWaalsContact C-N 3.27Å; A312-K314 PolarHBondContact O-N 3.22Å; K314-R317 PolarHBondContact O-N 3.37Å; K314-Q318 VanDerWaalsContact O-CG 3.29Å; K314-Q318 WeakPolarHBondContact O-CG 3.42Å; K314-Q318 PolarHBondContact O-N 3.28Å; K314-G363 PolarHBondContact NZ-O 3.45Å; K314-V364 HydrophobicContact CD-CG1 4.15Å; K314-D366 IonicContact NZ-OD1 2.73Å; K314-D366 PolarHBondContact NZ-OD1 2.93Å; K314-V367 HydrophobicContact CB-CG2 3.94Å; K314-V367 HydrophobicContact CG-CG2 4.36Å
315	R	90.4	Very high	82.2	Confident	68 Å²	68	60.1 Å²	60.1	26%	0.257	27%	0.265	S	S	.	.	H	α-helix	trans	-62	-49.4	178	-71.7	-172.1	-58.2	-96.7	4.2	112	P277 D281 E311 A312 R317 Q318 K319	P277-R315 PolarHBondContact O-NH2 3.13Å; D281-R315 IonicContact OD1-CZ 3.11Å; D281-R315 VanDerWaalsContact OD1-CZ 3.28Å; D281-R315 IonicContact OD1-NE 3.53Å; D281-R315 PolarHBondContact OD1-NE 3.42Å; D281-R315 IonicContact OD1-NH2 3.07Å; D281-R315 PolarHBondContact OD1-NH2 3.38Å; D281-R315 IonicContact OD2-NE 3.32Å; E311-R315 WeakPolarHBondContact O-CG 3.18Å; E311-R315 PolarHBondContact O-N 3.12Å; A312-R315 PolarHBondContact O-N 2.79Å; A312-R315 VanDerWaalsContact O-N 3.14Å; R315-R317 PolarHBondContact O-N 2.91Å; R315-Q318 WeakPolarHBondContact O-CB 3.48Å; R315-Q318 PolarHBondContact O-N 3.04Å; R315-K319 WeakPolarHBondContact O-CG 3.25Å; R315-K319 PolarHBondContact O-N 3.18Å
316	V	86.2	Confident	80.5	Confident	1 Å²	1	67.5 Å²	67.5	1%	0.006	30%	0.3	C	S	.	.	H	α-helix	trans	-63	-43.1	178.7	174.8	0	0	0	0	110.9	D281 I284 D285 A312 Q318 K319 L320	D281-V316 HydrophobicContact CB-CG2 4.3Å; I284-V316 HydrophobicContact CB-CG2 4.1Å; I284-V316 HydrophobicContact CG2-CB 3.84Å; I284-V316 HydrophobicContact CG2-CG1 3.91Å; I284-V316 HydrophobicContact CG2-CG2 3.87Å; D285-V316 WeakPolarHBondContact OD1-CG1 3.44Å; A312-V316 WeakPolarHBondContact O-CG2 3.47Å; A312-V316 PolarHBondContact O-N 3.37Å; V316-Q318 VanDerWaalsContact C-N 3.29Å; V316-Q318 PolarHBondContact O-N 3.2Å; V316-K319 WeakPolarHBondContact O-CB 3.34Å; V316-K319 PolarHBondContact O-N 2.69Å; V316-L320 HydrophobicContact CG1-CD1 4.2Å; V316-L320 HydrophobicContact CG1-CG 4.49Å; V316-L320 WeakPolarHBondContact O-CG 3.16Å; V316-L320 PolarHBondContact O-N 3.4Å
317	R	82	Confident	78.7	Confident	41 Å²	41	70.2 Å²	70.2	16%	0.155	32%	0.322	C	S	.	.	H	α-helix	trans	-58.8	-39.6	174.8	-176	177.5	-177.3	-166	1.3	112.5	T313 K314 R315 K321 F343 D366	T313-R317 WeakPolarHBondContact O-CB 3.2Å; T313-R317 PolarHBondContact O-N 2.99Å; K314-R317 PolarHBondContact O-N 3.37Å; R315-R317 PolarHBondContact O-N 2.91Å; R317-K321 WeakPolarHBondContact O-CG 3.05Å; R317-K321 PolarHBondContact O-N 3.45Å; R317-K321 VanDerWaalsContact O-N 3.12Å; R317-F343 VanDerWaalsContact CZ-CE1 3.48Å; R317-D366 IonicContact NH1-OD2 3.57Å
318	Q	82.9	Confident	76.7	Confident	107 Å²	107	71.3 Å²	71.3	50%	0.5	33%	0.328	S	S	.	.	H	α-helix	trans	-67.3	-44.9	175.5	-73.8	171.2	-18.5	0	0	111.8	K314 R315 V316 L320 K321 V322	K314-Q318 VanDerWaalsContact O-CG 3.29Å; K314-Q318 WeakPolarHBondContact O-CG 3.42Å; K314-Q318 PolarHBondContact O-N 3.28Å; R315-Q318 WeakPolarHBondContact O-CB 3.48Å; R315-Q318 PolarHBondContact O-N 3.04Å; V316-Q318 VanDerWaalsContact C-N 3.29Å; V316-Q318 PolarHBondContact O-N 3.2Å; Q318-L320 VanDerWaalsContact C-N 3.29Å; Q318-L320 PolarHBondContact O-N 3.37Å; Q318-K321 PolarHBondContact O-N 3.15Å; Q318-V322 WeakPolarHBondContact O-CG2 3.44Å; Q318-V322 PolarHBondContact O-N 3.18Å
319	K	81	Confident	74.7	Confident	120 Å²	120	76 Å²	76	52%	0.522	36%	0.356	S	S	.	.	H	α-helix	trans	-55.4	-43.4	174.9	-71.3	171.3	177.7	172.4	0	111.5	D281 R315 V316 V322 R323	D281-K319 IonicContact OD2-NZ 2.64Å; D281-K319 PolarHBondContact OD2-NZ 3.28Å; R315-K319 WeakPolarHBondContact O-CG 3.25Å; R315-K319 PolarHBondContact O-N 3.18Å; V316-K319 WeakPolarHBondContact O-CB 3.34Å; V316-K319 PolarHBondContact O-N 2.69Å; K319-V322 PolarHBondContact O-N 3.23Å; K319-R323 PolarHBondContact O-N 2.91Å
320	L	73.2	Confident	72.7	Confident	57 Å²	57	80 Å²	80	30%	0.298	38%	0.384	S	S	.	.	H	α-helix	trans	-68.2	-38.9	178.4	-69	174	0	0	0	113.4	M288 V316 Q318 V322 R323 S324 Y342	M288-L320 HydrophobicContact CE-CD1 4.3Å; V316-L320 HydrophobicContact CG1-CD1 4.2Å; V316-L320 HydrophobicContact CG1-CG 4.49Å; V316-L320 WeakPolarHBondContact O-CG 3.16Å; V316-L320 PolarHBondContact O-N 3.4Å; Q318-L320 VanDerWaalsContact C-N 3.29Å; Q318-L320 PolarHBondContact O-N 3.37Å; L320-V322 VanDerWaalsContact C-N 3.31Å; L320-V322 PolarHBondContact O-N 3.17Å; L320-R323 PolarHBondContact O-N 3.36Å; L320-S324 PolarHBondContact O-N 2.89Å; L320-S324 PolarHBondContact O-OG 3.39Å; L320-Y342 HydrophobicContact CB-CD1 4.12Å; L320-Y342 HydrophobicContact CB-CE1 4.35Å
321	K	68.7	Low	70.6	Confident	89 Å²	89	84.8 Å²	84.8	39%	0.387	41%	0.41	S	S	.	.	H	α-helix	trans	-63.1	-34.8	175.9	-78.5	-179	-179.6	-178.5	0	113.1	R317 Q318 S324 R325 Y342	R317-K321 WeakPolarHBondContact O-CG 3.05Å; R317-K321 PolarHBondContact O-N 3.45Å; R317-K321 VanDerWaalsContact O-N 3.12Å; Q318-K321 PolarHBondContact O-N 3.15Å; K321-S324 WeakPolarHBondContact CA-OG 3.11Å; K321-S324 PolarHBondContact O-OG 3.1Å; K321-S324 VanDerWaalsContact O-OG 3.09Å; K321-R325 WeakPolarHBondContact O-CG 3.5Å; K321-R325 PolarHBondContact O-N 3.3Å; K321-R325 VanDerWaalsContact O-N 3.11Å; K321-Y342 HydrophobicContact CG-CD1 4.23Å; K321-Y342 HydrophobicContact CG-CE1 4.41Å
322	V	68.9	Low	68.2	Low	96 Å²	96	90.3 Å²	90.3	58%	0.582	44%	0.436	S	S	*	.	H	α-helix	trans	-69.6	-45.8	176.7	174.9	0	0	0	0	110	Q318 K319 L320 S324 R325 Q326	Q318-V322 WeakPolarHBondContact O-CG2 3.44Å; Q318-V322 PolarHBondContact O-N 3.18Å; K319-V322 PolarHBondContact O-N 3.23Å; L320-V322 VanDerWaalsContact C-N 3.31Å; L320-V322 PolarHBondContact O-N 3.17Å; V322-S324 VanDerWaalsContact C-N 3.29Å; V322-S324 PolarHBondContact O-N 2.97Å; V322-R325 PolarHBondContact O-N 3.31Å; V322-Q326 PolarHBondContact O-N 3.49Å
323	R	64.3	Low	65.9	Low	200 Å²	200	101.8 Å²	101.8	76%	0.755	48%	0.479	S	S	*	.	H	α-helix	trans	-63	-36.3	179.4	-156.8	175.5	-170.1	168.6	2.7	112.4	K319 L320 A327	K319-R323 PolarHBondContact O-N 2.91Å; L320-R323 PolarHBondContact O-N 3.36Å; R323-A327 PolarHBondContact O-N 3.41Å
324	S	57.4	Low	63.7	Low	22 Å²	22	105 Å²	105	15%	0.154	50%	0.495	C	S	.	.	H	α-helix	trans	-76.4	-37.8	177.9	64.9	0	0	0	0	113.5	L320 K321 V322 Q326 A327 Q328 Y342	L320-S324 PolarHBondContact O-N 2.89Å; L320-S324 PolarHBondContact O-OG 3.39Å; K321-S324 WeakPolarHBondContact CA-OG 3.11Å; K321-S324 PolarHBondContact O-OG 3.1Å; K321-S324 VanDerWaalsContact O-OG 3.09Å; V322-S324 VanDerWaalsContact C-N 3.29Å; V322-S324 PolarHBondContact O-N 2.97Å; S324-Q326 PolarHBondContact O-N 2.94Å; S324-A327 CarbonylContact O-C 3.58Å; S324-A327 PolarHBondContact O-N 2.83Å; S324-Q328 WeakPolarHBondContact O-CB 3.26Å; S324-Q328 PolarHBondContact O-N 3.48Å; S324-Y342 WeakPolarHBondContact CB-OH 3.27Å; S324-Y342 PolarHBondContact OG-OH 3.49Å
325	R	57.9	Low	61.1	Low	190 Å²	190	105 Å²	105	72%	0.717	51%	0.51	S	S	*	.	H	α-helix	trans	-55.8	-41.7	171.9	-80.9	-179.7	177.7	-173.4	-2.1	111.6	K321 V322 A327 Q328 D329	K321-R325 WeakPolarHBondContact O-CG 3.5Å; K321-R325 PolarHBondContact O-N 3.3Å; K321-R325 VanDerWaalsContact O-N 3.11Å; V322-R325 PolarHBondContact O-N 3.31Å; R325-A327 VanDerWaalsContact C-N 3.31Å; R325-A327 PolarHBondContact O-N 3.14Å; R325-Q328 PolarHBondContact O-N 2.82Å; R325-D329 PolarHBondContact O-N 3.3Å
326	Q	54.4	Low	58.9	Low	155 Å²	155	107 Å²	107	72%	0.724	54%	0.535	S	S	*	.	H	α-helix	trans	-71.1	-24.3	178.1	-161.9	157.5	-1.2	0	0	113.7	V322 S324	V322-Q326 PolarHBondContact O-N 3.49Å; S324-Q326 PolarHBondContact O-N 2.94Å
327	A	53	Low	56.9	Low	56 Å²	56	113.3 Å²	113.3	46%	0.463	57%	0.568	S	S	.	*	H	α-helix	trans	-84.2	-29.4	171.5	0	0	0	0	0	112.7	R323 S324 R325 D329 S330	R323-A327 PolarHBondContact O-N 3.41Å; S324-A327 CarbonylContact O-C 3.58Å; S324-A327 PolarHBondContact O-N 2.83Å; R325-A327 VanDerWaalsContact C-N 3.31Å; R325-A327 PolarHBondContact O-N 3.14Å; A327-D329 VanDerWaalsContact C-N 3.34Å; A327-D329 PolarHBondContact O-N 2.9Å; A327-S330 PolarHBondContact O-N 3.49Å; A327-S330 VanDerWaalsContact O-N 3.1Å; A327-S330 PolarHBondContact O-OG 3.43Å
328	Q	49.8	Very low	54.9	Low	88 Å²	88	113.3 Å²	113.3	41%	0.411	57%	0.571	S	S	.	*	H	α-helix	trans	-75.4	-22.6	-174	-160	156.1	-2.2	0	0	112.8	S324 R325 S330 L331 L338	S324-Q328 WeakPolarHBondContact O-CB 3.26Å; S324-Q328 PolarHBondContact O-N 3.48Å; R325-Q328 PolarHBondContact O-N 2.82Å; Q328-S330 PolarHBondContact O-N 3.06Å; Q328-S330 VanDerWaalsContact O-N 3.14Å; Q328-L331 PolarHBondContact O-N 3.1Å; Q328-L338 VanDerWaalsContact CD-CD2 3.47Å
329	D	50.2	Low	52.9	Low	156 Å²	156	116.4 Å²	116.4	83%	0.834	58%	0.583	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64	-10.5	167.4	-72.3	-17.5	0	0	0	113.2	R325 A327	R325-D329 PolarHBondContact O-N 3.3Å; A327-D329 VanDerWaalsContact C-N 3.34Å; A327-D329 PolarHBondContact O-N 2.9Å
330	S	50.6	Low	51.1	Low	90 Å²	90	117.1 Å²	117.1	63%	0.629	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.3	-6.3	179.4	64.8	0	0	0	0	115.6	A327 Q328	A327-S330 PolarHBondContact O-N 3.49Å; A327-S330 VanDerWaalsContact O-N 3.1Å; A327-S330 PolarHBondContact O-OG 3.43Å; Q328-S330 PolarHBondContact O-N 3.06Å; Q328-S330 VanDerWaalsContact O-N 3.14Å
331	L	47.1	Very low	50	Low	106 Å²	106	120.8 Å²	120.8	56%	0.555	61%	0.606	S	S	*	*			trans	-143.6	85.6	-179.7	-113.7	102.7	0	0	0	111.8	Q328 W333 I334	Q328-L331 PolarHBondContact O-N 3.1Å; L331-W333 PolarHBondContact O-N 3.3Å; L331-W333 VanDerWaalsContact O-N 3.15Å; L331-I334 HydrophobicContact CD2-CD1 3.58Å; L331-I334 HydrophobicContact CD2-CG1 4.15Å
332	Q	42.8	Very low	49.4	Very low	183 Å²	183	118.3 Å²	118.3	86%	0.855	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.9	4.8	-175.1	-161.2	147	27.9	0	0	115.1
333	W	43.4	Very low	48.8	Very low	241 Å²	241	116.2 Å²	116.2	91%	0.913	58%	0.578	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.1	8.9	-168.1	-72.4	92.1	0	0	0	116.4	L331	L331-W333 PolarHBondContact O-N 3.3Å; L331-W333 VanDerWaalsContact O-N 3.15Å
334	I	44	Very low	48.7	Very low	85 Å²	85	107 Å²	107	44%	0.436	54%	0.544	S	S	.	.			trans	-114.8	51.7	177.6	-48.4	177.9	0	0	0	110.4	L331 S336 L337	L331-I334 HydrophobicContact CD2-CD1 3.58Å; L331-I334 HydrophobicContact CD2-CG1 4.15Å; I334-S336 VanDerWaalsContact C-N 3.35Å; I334-S336 PolarHBondContact O-N 2.61Å; I334-L337 HydrophobicContact CG2-CB 3.97Å
335	G	36	Very low	49.2	Very low	55 Å²	55	107 Å²	107	57%	0.567	54%	0.541	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.6	-15.8	-169.6	0	0	0	0	0	116.6
336	S	43.5	Very low	49.8	Very low	110 Å²	110	99.5 Å²	99.5	77%	0.769	52%	0.515	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118.6	-12.7	-172.9	-56.9	0	0	0	0	115.2	I334	I334-S336 VanDerWaalsContact C-N 3.35Å; I334-S336 PolarHBondContact O-N 2.61Å
337	L	43.5	Very low	51.1	Low	133 Å²	133	92.2 Å²	92.2	70%	0.696	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.3	-20.1	179	-91.5	117.1	0	0	0	113.9	I334 F339	I334-L337 HydrophobicContact CG2-CB 3.97Å; L337-F339 VanDerWaalsContact C-N 3.35Å; L337-F339 PolarHBondContact O-N 2.68Å
338	L	40.4	Very low	52.8	Low	41 Å²	41	90.5 Å²	90.5	22%	0.215	47%	0.466	C	S	.	.	G	3₁₀ helix	trans	-76.1	-19.9	-172	-148.6	79.2	0	0	0	114	Q328 I340 Y342	Q328-L338 VanDerWaalsContact CD-CD2 3.47Å; L338-I340 VanDerWaalsContact C-N 3.29Å; L338-I340 PolarHBondContact O-N 2.77Å; L338-Y342 WeakPolarHBondContact CD2-OH 3.4Å; L338-Y342 HydrophobicContact CG-CE2 4.47Å; L338-Y342 WeakPolarHBondContact O-CE2 3.38Å
339	F	40.1	Very low	54.8	Low	171 Å²	171	86.3 Å²	86.3	75%	0.75	45%	0.446	S	S	*	.	G	3₁₀ helix	trans	-72.6	-18.2	-177.1	-94.3	-86.1	0	0	0	114.3	L337 Q341	L337-F339 VanDerWaalsContact C-N 3.35Å; L337-F339 PolarHBondContact O-N 2.68Å; F339-Q341 VanDerWaalsContact C-N 3.34Å
340	I	44.1	Very low	56.7	Low	136 Å²	136	78.9 Å²	78.9	70%	0.697	41%	0.407	S	S	*	.	G	3₁₀ helix	trans	-82.4	-15.6	-177.2	-58.2	176.2	0	0	0	111.3	L338 Y342	L338-I340 VanDerWaalsContact C-N 3.29Å; L338-I340 PolarHBondContact O-N 2.77Å; I340-Y342 PolarHBondContact O-N 2.9Å
341	Q	50.6	Low	58.7	Low	134 Å²	134	74.6 Å²	74.6	63%	0.626	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.1	7.5	-158.7	-150.8	163.2	-1.3	0	0	116.3	F339	F339-Q341 VanDerWaalsContact C-N 3.34Å
342	Y	54.8	Low	60.6	Low	37 Å²	37	70 Å²	70	15%	0.145	35%	0.352	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.6	13.1	-174.8	-58.3	-75.9	0	0	0	115.3	L320 K321 S324 L338 I340	L320-Y342 HydrophobicContact CB-CD1 4.12Å; L320-Y342 HydrophobicContact CB-CE1 4.35Å; K321-Y342 HydrophobicContact CG-CD1 4.23Å; K321-Y342 HydrophobicContact CG-CE1 4.41Å; S324-Y342 WeakPolarHBondContact CB-OH 3.27Å; S324-Y342 PolarHBondContact OG-OH 3.49Å; L338-Y342 WeakPolarHBondContact CD2-OH 3.4Å; L338-Y342 HydrophobicContact CG-CE2 4.47Å; L338-Y342 WeakPolarHBondContact O-CE2 3.38Å; I340-Y342 PolarHBondContact O-N 2.9Å
343	F	56.2	Low	62.5	Low	52 Å²	52	62.5 Å²	62.5	23%	0.228	32%	0.32	C	S	.	.			trans	-105.8	127.3	179.2	-60.1	-62.2	0	0	0	110.3	R291 R317 H565	R291-F343 PolarHBondContact NE-O 3.32Å; R291-F343 PolarHBondContact NH2-O 3.47Å; R317-F343 VanDerWaalsContact CZ-CE1 3.48Å; F343-H565 AromaticContact CD1-CD2 3.22Å; F343-H565 WeakPolarHBondContact CD1-CD2 3.47Å; F343-H565 AromaticContact CD1-NE2 2.88Å; F343-H565 WeakPolarHBondContact CD1-NE2 3.32Å; F343-H565 AromaticContact CE1-CD2 3.26Å; F343-H565 WeakPolarHBondContact CE1-CD2 3.29Å; F343-H565 AromaticContact CE1-NE2 2.82Å; F343-H565 WeakPolarHBondContact CE1-NE2 3.47Å; F343-H565 AromaticContact CG-CD2 3.61Å; F343-H565 AromaticContact CG-NE2 3.77Å; F343-H565 AromaticContact CZ-CD2 3.7Å; F343-H565 AromaticContact CZ-NE2 3.69Å
344	V	62.9	Low	64.5	Low	6 Å²	6	51 Å²	51	4%	0.036	28%	0.277	C	S	.	.	S	Bend	trans	-75.3	-36.5	-179.2	-178.9	0	0	0	0	111.9	I284 M288 R291 T313	I284-V344 HydrophobicContact CD1-CG1 4.35Å; I284-V344 HydrophobicContact CG2-CB 4.42Å; I284-V344 HydrophobicContact CG2-CG1 3.87Å; I284-V344 HydrophobicContact CG2-CG2 3.69Å; M288-V344 HydrophobicContact CG-CG1 4.13Å; M288-V344 HydrophobicContact CG-CG2 4.12Å; M288-V344 WeakPolarHBondContact SD-CA 3.32Å; M288-V344 HydrophobicContact SD-CB 3.89Å; M288-V344 HydrophobicContact SD-CG1 3.94Å; M288-V344 HydrophobicContact SD-CG2 3.73Å; R291-V344 VanDerWaalsContact CZ-C 3.45Å; R291-V344 PolarHBondContact NH1-O 3.34Å; R291-V344 PolarHBondContact NH2-O 3.1Å; T313-V344 HydrophobicContact CG2-CB 4.08Å; T313-V344 HydrophobicContact CG2-CG2 3.77Å
345	F	68.3	Low	66.3	Low	21 Å²	21	47.5 Å²	47.5	9%	0.092	26%	0.26	C	S	.	.			trans	-139.1	145	170.5	-67.1	-67.7	0	0	0	109.4	A237 I239 L287 R291 I294 A297 C348	A237-F345 HydrophobicContact CB-CE1 4.27Å; A237-F345 HydrophobicContact CB-CZ 4.46Å; I239-F345 HydrophobicContact CD1-CE2 4.39Å; L287-F345 HydrophobicContact CB-CE2 4.29Å; L287-F345 HydrophobicContact CB-CZ 3.73Å; L287-F345 HydrophobicContact CD1-CE2 3.86Å; L287-F345 HydrophobicContact CD1-CZ 3.75Å; L287-F345 HydrophobicContact CD2-CZ 4.06Å; L287-F345 HydrophobicContact CG-CZ 4.04Å; R291-F345 VanDerWaalsContact NH2-C 3.25Å; I294-F345 HydrophobicContact CG2-CE1 4.29Å; A297-F345 HydrophobicContact CB-CD1 3.74Å; A297-F345 HydrophobicContact CB-CD2 4.01Å; A297-F345 HydrophobicContact CB-CE1 3.64Å; A297-F345 HydrophobicContact CB-CE2 3.9Å; A297-F345 HydrophobicContact CB-CG 3.92Å; A297-F345 HydrophobicContact CB-CZ 3.7Å; F345-C348 VanDerWaalsContact CB-SG 3.58Å
346	D	70.2	Confident	68.4	Low	34 Å²	34	47.5 Å²	47.5	18%	0.182	25%	0.247	C	C	.	.	S	Bend	trans	-81.4	-30.8	171.7	-65.8	-11.3	0	0	0	109.9	R291 T295 P575	R291-D346 IonicContact NH2-OD1 3.12Å; R291-D346 PolarHBondContact NH2-OD1 3.06Å; T295-D346 PolarHBondContact O-N 2.78Å; D346-P575 HydrophobicContact CB-CB 3.87Å; D346-P575 HydrophobicContact CB-CG 3.91Å
347	V	82.5	Confident	70.2	Confident	2 Å²	2	43.3 Å²	43.3	1%	0.012	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	134.6	175.8	-169.2	0	0	0	0	110	W233 T295 V296 A297 I349 Y372 W564 P575	W233-V347 HydrophobicContact CH2-CB 4.26Å; W233-V347 HydrophobicContact CH2-CG1 4.02Å; W233-V347 HydrophobicContact CH2-CG2 4.02Å; W233-V347 HydrophobicContact CZ2-CG2 4.05Å; T295-V347 PolarHBondContact O-N 3.09Å; V296-V347 WeakPolarHBondContact CA-O 3.43Å; V296-V347 HydrophobicContact CG2-CB 4.22Å; V296-V347 HydrophobicContact CG2-CG2 4.44Å; A297-V347 PolarHBondContact N-O 3.25Å; V347-I349 HydrophobicContact CG1-CG1 4.47Å; V347-Y372 HydrophobicContact CG1-CD2 3.55Å; V347-Y372 HydrophobicContact CG1-CE2 3.7Å; V347-W564 HydrophobicContact CG2-CE3 4.19Å; V347-W564 HydrophobicContact CG2-CZ3 3.87Å; V347-P575 HydrophobicContact CG2-CB 4.26Å; V347-P575 HydrophobicContact CG2-CG 3.69Å
348	C	89	Confident	72.1	Confident	20 Å²	20	42.8 Å²	42.8	14%	0.135	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	130.2	164.3	-65.2	0	0	0	0	108.9	A297 F345 F350 A371 Y372	A297-C348 CarbonylContact O-C 3.56Å; A297-C348 WeakPolarHBondContact O-CA 3.36Å; F345-C348 VanDerWaalsContact CB-SG 3.58Å; C348-F350 HydrophobicContact CB-CD2 3.82Å; C348-F350 HydrophobicContact CB-CE2 3.2Å; C348-F350 HydrophobicContact CB-CZ 3.71Å; C348-A371 HydrophobicContact CB-CB 4.41Å; C348-A371 WeakPolarHBondContact O-CA 2.98Å; C348-Y372 PolarHBondContact O-N 3.42Å
349	I	91.4	Very high	74.1	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	111.1	170.4	-56.4	174.2	0	0	0	107.2	M224 I227 V228 W233 A297 I298 C299 V347 F374	M224-I349 HydrophobicContact CE-CG2 4.35Å; M224-I349 HydrophobicContact CG-CG2 4Å; M224-I349 HydrophobicContact SD-CG2 4.44Å; I227-I349 HydrophobicContact CB-CD1 4.47Å; I227-I349 HydrophobicContact CG2-CD1 3.85Å; V228-I349 HydrophobicContact CG2-CD1 4.46Å; W233-I349 HydrophobicContact CZ3-CD1 4.1Å; A297-I349 PolarHBondContact O-N 3.25Å; I298-I349 CarbonylContact C-O 3.52Å; I298-I349 WeakPolarHBondContact CA-O 3.2Å; I298-I349 HydrophobicContact CG1-CD1 4.46Å; C299-I349 PolarHBondContact N-O 3.12Å; V347-I349 HydrophobicContact CG1-CG1 4.47Å; I349-F374 HydrophobicContact CG2-CE2 3.63Å; I349-F374 HydrophobicContact CG2-CZ 4.35Å
350	F	90.5	Very high	76.4	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	147.3	179.1	-69.1	-81.9	0	0	0	110.3	C299 I306 F310 C348 W354 A371 Y372 F374	C299-F350 HydrophobicContact CB-CD1 3.16Å; C299-F350 HydrophobicContact CB-CE1 3.44Å; C299-F350 VanDerWaalsContact CB-CE1 3.44Å; C299-F350 HydrophobicContact CB-CG 3.99Å; C299-F350 HydrophobicContact CB-CZ 4.47Å; C299-F350 WeakPolarHBondContact O-CA 3.32Å; C299-F350 WeakPolarHBondContact SG-CE1 3.46Å; I306-F350 HydrophobicContact CB-CD1 4.37Å; I306-F350 HydrophobicContact CB-CE1 4.34Å; I306-F350 HydrophobicContact CD1-CB 4.12Å; I306-F350 HydrophobicContact CD1-CD1 3.65Å; I306-F350 HydrophobicContact CD1-CE1 4.43Å; I306-F350 HydrophobicContact CD1-CG 4.15Å; I306-F350 HydrophobicContact CG1-CD1 3.59Å; I306-F350 HydrophobicContact CG1-CE1 3.9Å; I306-F350 HydrophobicContact CG1-CG 4.49Å; I306-F350 HydrophobicContact CG2-CD1 3.94Å; I306-F350 HydrophobicContact CG2-CE1 3.83Å; I306-F350 HydrophobicContact CG2-CG 4.41Å; I306-F350 HydrophobicContact CG2-CZ 4.16Å; F310-F350 AromaticContact CE1-CE2 3.72Å; F310-F350 HydrophobicContact CE1-CE2 3.72Å; F310-F350 AromaticContact CE1-CZ 3.79Å; F310-F350 HydrophobicContact CE1-CZ 3.79Å; F310-F350 HydrophobicContact CE2-CE2 4.44Å; F310-F350 HydrophobicContact CZ-CD2 4.26Å; F310-F350 AromaticContact CZ-CE2 3.42Å; F310-F350 HydrophobicContact CZ-CE2 3.42Å; F310-F350 VanDerWaalsContact CZ-CE2 3.42Å; F310-F350 AromaticContact CZ-CZ 3.74Å; F310-F350 HydrophobicContact CZ-CZ 3.74Å; C348-F350 HydrophobicContact CB-CD2 3.82Å; C348-F350 HydrophobicContact CB-CE2 3.2Å; C348-F350 HydrophobicContact CB-CZ 3.71Å; F350-W354 HydrophobicContact CB-CZ2 4.14Å; F350-W354 AromaticContact CD2-CZ2 3.89Å; F350-W354 HydrophobicContact CD2-CZ2 3.89Å; F350-W354 HydrophobicContact CG-CZ2 4.4Å; F350-W354 AromaticContact CG-NE1 3.91Å; F350-A371 HydrophobicContact CD2-CB 4.1Å; F350-A371 HydrophobicContact CE2-CB 4Å; F350-Y372 PolarHBondContact N-O 2.9Å; F350-F374 WeakPolarHBondContact O-CD2 3.23Å
351	S	91.2	Very high	78.5	Confident	0 Å²	0	28.4 Å²	28.4	0%	0	14%	0.138	C	C	.	.			trans	-61.2	179.6	171.1	64.2	0	0	0	0	112.7	Y245 C299 C301 S353 W354	Y245-S351 WeakPolarHBondContact OH-CB 3.33Å; Y245-S351 PolarHBondContact OH-OG 2.9Å; C299-S351 PolarHBondContact O-N 3.06Å; C301-S351 PolarHBondContact O-OG 2.96Å; S351-S353 PolarHBondContact O-N 3.32Å; S351-W354 PolarHBondContact O-NE1 2.91Å
352	E	87.7	Confident	80.3	Confident	10 Å²	10	25.9 Å²	25.9	5%	0.047	13%	0.133	C	C	.	.	G	3₁₀ helix	trans	-71.8	-8.4	-172.4	80.1	-58.8	147.7	0	0	114.5	Q220 Y245 W354 S355 F374 I376	Q220-E352 VanDerWaalsContact NE2-N 3.11Å; Q220-E352 PolarHBondContact NE2-OE2 3.45Å; Q220-E352 PolarHBondContact OE1-OE2 3.41Å; Y245-E352 VanDerWaalsContact OH-CD 3.32Å; Y245-E352 PolarHBondContact OH-OE1 3.27Å; Y245-E352 PolarHBondContact OH-OE2 2.81Å; Y245-E352 VanDerWaalsContact OH-OE2 3.13Å; E352-W354 PolarHBondContact O-N 3.13Å; E352-S355 VanDerWaalsContact O-CB 3.24Å; E352-S355 WeakPolarHBondContact O-CB 3.42Å; E352-S355 PolarHBondContact O-N 3.21Å; E352-F374 WeakPolarHBondContact CA-O 3.48Å; E352-F374 HydrophobicContact CB-CB 4.23Å; E352-I376 HydrophobicContact CG-CD1 3.86Å; E352-I376 HydrophobicContact CG-CG1 4.2Å
353	S	82.2	Confident	81.9	Confident	25 Å²	25	26 Å²	26	18%	0.175	15%	0.145	C	C	.	.	G	3₁₀ helix	trans	-59.6	-16.5	-174.7	-82.4	0	0	0	0	115.7	Y245 C301 S351	Y245-S353 WeakPolarHBondContact CE1-OG 3.42Å; Y245-S353 PolarHBondContact OH-OG 3.21Å; C301-S353 VanDerWaalsContact O-CB 3.24Å; C301-S353 WeakPolarHBondContact O-CB 3.31Å; S351-S353 PolarHBondContact O-N 3.32Å
354	W	85.8	Confident	83.5	Confident	0 Å²	0	23.8 Å²	23.8	0%	0	14%	0.136	C	C	.	.	G	3₁₀ helix	trans	-120.1	9.5	177.5	73.4	-60.1	0	0	0	113.3	I306 F310 F350 S351 E352 D356 R357 V360 V361 A371 Y372 S373 Y525	I306-W354 HydrophobicContact CD1-CB 3.99Å; I306-W354 HydrophobicContact CD1-CG 3.88Å; I306-W354 HydrophobicContact CG2-CG 4.44Å; F310-W354 HydrophobicContact CE2-CZ3 4.46Å; F350-W354 HydrophobicContact CB-CZ2 4.14Å; F350-W354 AromaticContact CD2-CZ2 3.89Å; F350-W354 HydrophobicContact CD2-CZ2 3.89Å; F350-W354 HydrophobicContact CG-CZ2 4.4Å; F350-W354 AromaticContact CG-NE1 3.91Å; S351-W354 PolarHBondContact O-NE1 2.91Å; E352-W354 PolarHBondContact O-N 3.13Å; W354-D356 PolarHBondContact O-N 3Å; W354-R357 WeakPolarHBondContact O-CB 3.11Å; W354-R357 PolarHBondContact O-N 3.08Å; W354-V360 HydrophobicContact CB-CB 4.29Å; W354-V360 HydrophobicContact CB-CG1 4.02Å; W354-V360 HydrophobicContact CB-CG2 4.09Å; W354-V360 HydrophobicContact CE3-CG1 4.48Å; W354-V361 HydrophobicContact CE3-CG1 3.98Å; W354-V361 HydrophobicContact CZ3-CG1 3.74Å; W354-A371 HydrophobicContact CH2-CB 3.84Å; W354-A371 HydrophobicContact CZ2-CB 4.18Å; W354-Y372 WeakPolarHBondContact CZ2-O 3.3Å; W354-S373 VanDerWaalsContact CE2-CB 3.42Å; W354-S373 VanDerWaalsContact CZ2-CB 3.43Å; W354-S373 PolarHBondContact NE1-OG 3.45Å; W354-Y525 HydrophobicContact CD2-CE1 4.3Å; W354-Y525 AromaticContact CE3-CE1 3.66Å; W354-Y525 HydrophobicContact CE3-CE1 3.66Å; W354-Y525 AromaticContact CE3-CZ 3.77Å; W354-Y525 AromaticContact CH2-CE1 3.78Å; W354-Y525 HydrophobicContact CH2-CE1 3.78Å; W354-Y525 HydrophobicContact CZ2-CE1 4.42Å; W354-Y525 AromaticContact CZ3-CE1 3.35Å; W354-Y525 HydrophobicContact CZ3-CE1 3.35Å; W354-Y525 AromaticContact CZ3-CZ 3.75Å; W354-Y525 VanDerWaalsContact CZ3-OH 3.31Å; W354-Y525 WeakPolarHBondContact CZ3-OH 3.41Å; W354-Y525 PolarHBondContact O-OH 2.79Å
355	S	81.8	Confident	84.7	Confident	11 Å²	11	25.4 Å²	25.4	8%	0.077	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56	124.6	-179.3	-156.8	0	0	0	0	111.6	E352 R357 S373 F374 R375	E352-S355 VanDerWaalsContact O-CB 3.24Å; E352-S355 WeakPolarHBondContact O-CB 3.42Å; E352-S355 PolarHBondContact O-N 3.21Å; S355-R357 PolarHBondContact O-N 2.83Å; S355-S373 WeakPolarHBondContact CA-OG 3.5Å; S355-F374 WeakPolarHBondContact CB-O 3.4Å; S355-F374 PolarHBondContact OG-O 3.15Å; S355-R375 VanDerWaalsContact OG-CA 3.29Å; S355-R375 WeakPolarHBondContact OG-CA 3.44Å; S355-R375 WeakPolarHBondContact OG-CB 3.39Å
356	D	79.3	Confident	85.3	Confident	55 Å²	55	27.5 Å²	27.5	29%	0.294	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.5	7.9	-177.1	-64.8	-38.3	0	0	0	115.3	W354 K358 R375	W354-D356 PolarHBondContact O-N 3Å; D356-K358 PolarHBondContact O-N 3.49Å; D356-R375 WeakPolarHBondContact OD2-CD 3.47Å; D356-R375 IonicContact OD2-CZ 3.56Å; D356-R375 IonicContact OD2-NH1 3.41Å; D356-R375 PolarHBondContact OD2-NH1 3.43Å; D356-R375 VanDerWaalsContact OD2-NH1 3.1Å
357	R	82.8	Confident	86	Confident	21 Å²	21	26.7 Å²	26.7	8%	0.079	15%	0.151	C	C	.	.			trans	-81	101.1	179.3	-83.5	-171.2	54.8	-172	-5.1	111.2	D304 W354 S355 D359 V360 Y525	D304-R357 IonicContact OD1-NH2 3.95Å; D304-R357 PolarHBondContact OD1-NH2 3.13Å; W354-R357 WeakPolarHBondContact O-CB 3.11Å; W354-R357 PolarHBondContact O-N 3.08Å; S355-R357 PolarHBondContact O-N 2.83Å; R357-D359 VanDerWaalsContact C-N 3.29Å; R357-D359 VanDerWaalsContact CB-OD1 3.23Å; R357-D359 WeakPolarHBondContact CB-OD1 3.41Å; R357-D359 IonicContact CZ-OD1 3.69Å; R357-D359 IonicContact CZ-OD2 3.36Å; R357-D359 IonicContact NE-OD1 2.88Å; R357-D359 PolarHBondContact NE-OD1 3.49Å; R357-D359 VanDerWaalsContact NE-OD1 3.1Å; R357-D359 IonicContact NE-OD2 3.7Å; R357-D359 PolarHBondContact NE-OD2 2.91Å; R357-D359 IonicContact NH2-OD1 3.2Å; R357-D359 IonicContact NH2-OD2 2.74Å; R357-D359 PolarHBondContact NH2-OD2 3.07Å; R357-D359 PolarHBondContact O-N 3.35Å; R357-V360 HydrophobicContact CB-CB 4.47Å; R357-V360 HydrophobicContact CB-CG2 3.89Å; R357-V360 VanDerWaalsContact CZ-CG2 3.5Å; R357-Y525 PolarHBondContact O-OH 3.31Å
358	K	83	Confident	86.3	Confident	123 Å²	123	26.6 Å²	26.6	54%	0.535	15%	0.151	S	C	.	.	H	α-helix	trans	-69.2	-26.6	175.9	-66.5	-175.9	-179.1	177.8	0	112.8	D356 V360 V361 T362	D356-K358 PolarHBondContact O-N 3.49Å; K358-V360 VanDerWaalsContact C-N 3.29Å; K358-V360 PolarHBondContact O-N 3.29Å; K358-V361 VanDerWaalsContact O-CG2 3.3Å; K358-V361 WeakPolarHBondContact O-CG2 3.35Å; K358-V361 PolarHBondContact O-N 3.43Å; K358-T362 PolarHBondContact O-N 3.04Å; K358-T362 PolarHBondContact O-OG1 3.49Å
359	D	82.4	Confident	86.2	Confident	41 Å²	41	26.6 Å²	26.6	22%	0.219	15%	0.15	C	C	.	.	H	α-helix	trans	-67.7	-26.3	-179	62.9	-51.3	0	0	0	113.6	K307 R357	K307-D359 PolarHBondContact NZ-O 3.31Å; R357-D359 VanDerWaalsContact C-N 3.29Å; R357-D359 VanDerWaalsContact CB-OD1 3.23Å; R357-D359 WeakPolarHBondContact CB-OD1 3.41Å; R357-D359 IonicContact CZ-OD1 3.69Å; R357-D359 IonicContact CZ-OD2 3.36Å; R357-D359 IonicContact NE-OD1 2.88Å; R357-D359 PolarHBondContact NE-OD1 3.49Å; R357-D359 VanDerWaalsContact NE-OD1 3.1Å; R357-D359 IonicContact NE-OD2 3.7Å; R357-D359 PolarHBondContact NE-OD2 2.91Å; R357-D359 IonicContact NH2-OD1 3.2Å; R357-D359 IonicContact NH2-OD2 2.74Å; R357-D359 PolarHBondContact NH2-OD2 3.07Å; R357-D359 PolarHBondContact O-N 3.35Å
360	V	87.4	Confident	86	Confident	0 Å²	0	26.8 Å²	26.8	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-73.6	-36.4	175.7	177.1	0	0	0	0	111.7	I306 K307 F310 W354 R357 K358	I306-V360 HydrophobicContact CB-CG1 4.12Å; I306-V360 HydrophobicContact CG2-CG1 3.72Å; K307-V360 HydrophobicContact CB-CG1 4.11Å; F310-V360 HydrophobicContact CE2-CG1 4.48Å; W354-V360 HydrophobicContact CB-CB 4.29Å; W354-V360 HydrophobicContact CB-CG1 4.02Å; W354-V360 HydrophobicContact CB-CG2 4.09Å; W354-V360 HydrophobicContact CE3-CG1 4.48Å; R357-V360 HydrophobicContact CB-CB 4.47Å; R357-V360 HydrophobicContact CB-CG2 3.89Å; R357-V360 VanDerWaalsContact CZ-CG2 3.5Å; K358-V360 VanDerWaalsContact C-N 3.29Å; K358-V360 PolarHBondContact O-N 3.29Å
361	V	88.8	Confident	85.9	Confident	4 Å²	4	27 Å²	27	2%	0.024	15%	0.154	C	C	.	.	H	α-helix	trans	-95.2	-13.7	-176	-64.3	0	0	0	0	114	W354 K358 G363 V364 E365 A368 Y518 Y525	W354-V361 HydrophobicContact CE3-CG1 3.98Å; W354-V361 HydrophobicContact CZ3-CG1 3.74Å; K358-V361 VanDerWaalsContact O-CG2 3.3Å; K358-V361 WeakPolarHBondContact O-CG2 3.35Å; K358-V361 PolarHBondContact O-N 3.43Å; V361-G363 PolarHBondContact O-N 3.38Å; V361-V364 CarbonylContact O-C 3.38Å; V361-V364 WeakPolarHBondContact O-CG2 3.37Å; V361-V364 PolarHBondContact O-N 3.11Å; V361-E365 WeakPolarHBondContact O-CG 3.31Å; V361-E365 PolarHBondContact O-N 2.78Å; V361-A368 HydrophobicContact CB-CB 4.42Å; V361-A368 HydrophobicContact CG1-CB 3.88Å; V361-Y518 HydrophobicContact CB-CE1 4.36Å; V361-Y518 HydrophobicContact CB-CE2 4.1Å; V361-Y518 HydrophobicContact CG1-CD2 4.29Å; V361-Y518 HydrophobicContact CG1-CE1 4.37Å; V361-Y518 HydrophobicContact CG1-CE2 4.06Å; V361-Y518 HydrophobicContact CG2-CE2 3.75Å; V361-Y525 WeakPolarHBondContact CG1-OH 3.42Å
362	T	88.7	Confident	86	Confident	82 Å²	82	27.1 Å²	27.1	50%	0.503	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.4	121.6	-177.7	-64	0	0	0	0	110.6	K358 V364	K358-T362 PolarHBondContact O-N 3.04Å; K358-T362 PolarHBondContact O-OG1 3.49Å; T362-V364 VanDerWaalsContact C-N 3.32Å
363	G	88.1	Confident	86.1	Confident	40 Å²	40	26.6 Å²	26.6	41%	0.412	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	86	-6.8	-179.3	0	0	0	0	0	115.1	K314 V361 E365	K314-G363 PolarHBondContact NZ-O 3.45Å; V361-G363 PolarHBondContact O-N 3.38Å; G363-E365 VanDerWaalsContact C-OE2 3.28Å; G363-E365 VanDerWaalsContact CA-OE2 3.31Å; G363-E365 WeakPolarHBondContact CA-OE2 3.46Å; G363-E365 PolarHBondContact N-OE1 3.3Å; G363-E365 PolarHBondContact N-OE2 3.39Å; G363-E365 VanDerWaalsContact N-OE2 3.09Å
364	V	88.8	Confident	86.6	Confident	4 Å²	4	25.4 Å²	25.4	2%	0.024	14%	0.144	C	C	.	.			trans	-129.5	22.6	179.3	-66.1	0	0	0	0	112.2	F310 E311 K314 V361 T362 D366 V367 A368	F310-V364 HydrophobicContact CB-CB 3.85Å; F310-V364 HydrophobicContact CB-CG1 4.21Å; F310-V364 HydrophobicContact CB-CG2 3.64Å; F310-V364 HydrophobicContact CD2-CG2 4.16Å; F310-V364 HydrophobicContact CG-CG2 4.24Å; E311-V364 HydrophobicContact CG-CG1 3.81Å; K314-V364 HydrophobicContact CD-CG1 4.15Å; V361-V364 CarbonylContact O-C 3.38Å; V361-V364 WeakPolarHBondContact O-CG2 3.37Å; V361-V364 PolarHBondContact O-N 3.11Å; T362-V364 VanDerWaalsContact C-N 3.32Å; V364-D366 PolarHBondContact O-N 3.24Å; V364-V367 PolarHBondContact O-N 3.38Å; V364-A368 PolarHBondContact O-N 3.04Å
365	E	88.5	Confident	86.8	Confident	40 Å²	40	28.3 Å²	28.3	19%	0.187	16%	0.155	C	C	.	.	H	α-helix	trans	-59.8	-34.2	-174.2	-58.4	86.4	164.7	0	0	112.1	V361 G363 V367 T369 Y518 K521	V361-E365 WeakPolarHBondContact O-CG 3.31Å; V361-E365 PolarHBondContact O-N 2.78Å; G363-E365 VanDerWaalsContact C-OE2 3.28Å; G363-E365 VanDerWaalsContact CA-OE2 3.31Å; G363-E365 WeakPolarHBondContact CA-OE2 3.46Å; G363-E365 PolarHBondContact N-OE1 3.3Å; G363-E365 PolarHBondContact N-OE2 3.39Å; G363-E365 VanDerWaalsContact N-OE2 3.09Å; E365-V367 VanDerWaalsContact C-N 3.25Å; E365-V367 PolarHBondContact O-N 2.95Å; E365-T369 PolarHBondContact O-N 2.58Å; E365-T369 VanDerWaalsContact O-N 3.16Å; E365-T369 PolarHBondContact O-OG1 2.96Å; E365-Y518 HydrophobicContact CB-CE1 4.29Å; E365-Y518 VanDerWaalsContact CG-OH 3.23Å; E365-Y518 WeakPolarHBondContact CG-OH 3.41Å; E365-K521 HydrophobicContact CG-CB 4.36Å
366	D	81.5	Confident	87.2	Confident	65 Å²	65	28.3 Å²	28.3	35%	0.348	15%	0.154	S	C	.	.	H	α-helix	trans	-68.3	-24.6	179	68.9	-69	0	0	0	113.5	K314 R317 V364	K314-D366 IonicContact NZ-OD1 2.73Å; K314-D366 PolarHBondContact NZ-OD1 2.93Å; R317-D366 IonicContact NH1-OD2 3.57Å; V364-D366 PolarHBondContact O-N 3.24Å
367	V	85.3	Confident	87.5	Confident	18 Å²	18	28.5 Å²	28.5	11%	0.109	15%	0.151	C	C	.	.	H	α-helix	trans	-92	-39	177.2	-179.9	0	0	0	0	110.9	F310 T313 K314 V364 E365 T369	F310-V367 HydrophobicContact CD1-CG1 3.93Å; T313-V367 HydrophobicContact CG2-CG1 3.39Å; K314-V367 HydrophobicContact CB-CG2 3.94Å; K314-V367 HydrophobicContact CG-CG2 4.36Å; V364-V367 PolarHBondContact O-N 3.38Å; E365-V367 VanDerWaalsContact C-N 3.25Å; E365-V367 PolarHBondContact O-N 2.95Å; V367-T369 VanDerWaalsContact C-N 3.25Å; V367-T369 PolarHBondContact O-N 3.13Å
368	A	87.9	Confident	87.7	Confident	0 Å²	0	28.7 Å²	28.7	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-71.1	-17.8	179.9	0	0	0	0	0	113.7	F310 V361 V364 G370 A371 Y518	F310-A368 HydrophobicContact CD1-CB 4.45Å; F310-A368 HydrophobicContact CD2-CB 4.2Å; F310-A368 HydrophobicContact CE1-CB 4.11Å; F310-A368 HydrophobicContact CE2-CB 3.83Å; F310-A368 HydrophobicContact CZ-CB 3.78Å; V361-A368 HydrophobicContact CB-CB 4.42Å; V361-A368 HydrophobicContact CG1-CB 3.88Å; V364-A368 PolarHBondContact O-N 3.04Å; A368-G370 PolarHBondContact O-N 2.89Å; A368-A371 VanDerWaalsContact O-CB 3.25Å; A368-A371 WeakPolarHBondContact O-CB 3.32Å; A368-A371 PolarHBondContact O-N 3.27Å; A368-A371 VanDerWaalsContact O-N 3.11Å; A368-Y518 HydrophobicContact CB-CD1 3.72Å; A368-Y518 HydrophobicContact CB-CE1 3.84Å; A368-Y518 WeakPolarHBondContact O-CD1 3.34Å
369	T	87.2	Confident	87.8	Confident	20 Å²	20	23.3 Å²	23.3	12%	0.123	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.4	126.9	-178.5	-63.5	0	0	0	0	111.5	E365 V367 Y518 L563 H565	E365-T369 PolarHBondContact O-N 2.58Å; E365-T369 VanDerWaalsContact O-N 3.16Å; E365-T369 PolarHBondContact O-OG1 2.96Å; V367-T369 VanDerWaalsContact C-N 3.25Å; V367-T369 PolarHBondContact O-N 3.13Å; T369-Y518 CarbonylContact C-O 3.5Å; T369-Y518 WeakPolarHBondContact CA-O 3.23Å; T369-L563 HydrophobicContact CG2-CD2 3.76Å; T369-H565 PolarHBondContact O-ND1 3.43Å
370	G	86.5	Confident	88	Confident	4 Å²	4	26.9 Å²	26.9	4%	0.041	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	92.2	-7.6	-178.5	0	0	0	0	0	114.8	A368 N517 Y518 L563	A368-G370 PolarHBondContact O-N 2.89Å; G370-N517 PolarHBondContact O-ND2 3.43Å; G370-Y518 PolarHBondContact N-O 2.8Å; G370-L563 WeakPolarHBondContact CA-O 3.22Å
371	A	90	Very high	88.1	Confident	5 Å²	5	28.3 Å²	28.3	4%	0.041	17%	0.167	C	C	.	.			trans	-70.2	145.7	176.4	0	0	0	0	0	112	F310 C348 F350 W354 A368 N517 Y518	F310-A371 HydrophobicContact CZ-CB 4.4Å; C348-A371 HydrophobicContact CB-CB 4.41Å; C348-A371 WeakPolarHBondContact O-CA 2.98Å; F350-A371 HydrophobicContact CD2-CB 4.1Å; F350-A371 HydrophobicContact CE2-CB 4Å; W354-A371 HydrophobicContact CH2-CB 3.84Å; W354-A371 HydrophobicContact CZ2-CB 4.18Å; A368-A371 VanDerWaalsContact O-CB 3.25Å; A368-A371 WeakPolarHBondContact O-CB 3.32Å; A368-A371 PolarHBondContact O-N 3.27Å; A368-A371 VanDerWaalsContact O-N 3.11Å; A371-N517 WeakPolarHBondContact O-CA 3.42Å; A371-Y518 PolarHBondContact O-N 3.2Å
372	Y	92.1	Very high	87.9	Confident	1 Å²	1	31.7 Å²	31.7	0%	0.004	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	136.1	176.4	-75.8	-101.1	0	0	0	110.8	V347 C348 F350 W354 I515 L516 V528 I562 W564	V347-Y372 HydrophobicContact CG1-CD2 3.55Å; V347-Y372 HydrophobicContact CG1-CE2 3.7Å; C348-Y372 PolarHBondContact O-N 3.42Å; F350-Y372 PolarHBondContact N-O 2.9Å; W354-Y372 WeakPolarHBondContact CZ2-O 3.3Å; Y372-I515 HydrophobicContact CD1-CG2 3.67Å; Y372-I515 HydrophobicContact CE1-CG2 4.19Å; Y372-L516 CarbonylContact C-O 3.58Å; Y372-L516 VanDerWaalsContact CA-O 3.29Å; Y372-L516 WeakPolarHBondContact CA-O 3.4Å; Y372-V528 HydrophobicContact CD1-CG2 4.38Å; Y372-V528 HydrophobicContact CE1-CG2 3.96Å; Y372-I562 WeakPolarHBondContact OH-CD1 3.38Å; Y372-I562 VanDerWaalsContact OH-CG2 3.27Å; Y372-I562 WeakPolarHBondContact OH-CG2 3.48Å; Y372-W564 HydrophobicContact CE2-CZ3 4.34Å
373	S	90.6	Very high	87.8	Confident	0 Å²	0	34.9 Å²	34.9	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	149.3	171.7	-169.2	0	0	0	0	109.6	W354 S355 L516	W354-S373 VanDerWaalsContact CE2-CB 3.42Å; W354-S373 VanDerWaalsContact CZ2-CB 3.43Å; W354-S373 PolarHBondContact NE1-OG 3.45Å; S355-S373 WeakPolarHBondContact CA-OG 3.5Å; S373-L516 PolarHBondContact N-O 3.2Å; S373-L516 PolarHBondContact O-N 3.11Å
374	F	91.2	Very high	88	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	149.9	163.1	-69	-92.9	0	0	0	110.3	Q220 A223 M224 I227 I349 F350 E352 S355 Y513 D514 I515	Q220-F374 HydrophobicContact CG-CD2 4.29Å; Q220-F374 HydrophobicContact CG-CG 4.27Å; A223-F374 HydrophobicContact CB-CE1 3.78Å; A223-F374 HydrophobicContact CB-CZ 4.29Å; M224-F374 HydrophobicContact CE-CD2 3.93Å; M224-F374 HydrophobicContact CE-CE2 3.67Å; M224-F374 HydrophobicContact CG-CE2 3.49Å; M224-F374 VanDerWaalsContact CG-CE2 3.49Å; M224-F374 HydrophobicContact CG-CZ 3.61Å; M224-F374 HydrophobicContact SD-CE2 4.41Å; I227-F374 HydrophobicContact CD1-CE1 4.04Å; I227-F374 HydrophobicContact CD1-CE2 4.42Å; I227-F374 HydrophobicContact CD1-CZ 3.53Å; I349-F374 HydrophobicContact CG2-CE2 3.63Å; I349-F374 HydrophobicContact CG2-CZ 4.35Å; F350-F374 WeakPolarHBondContact O-CD2 3.23Å; E352-F374 WeakPolarHBondContact CA-O 3.48Å; E352-F374 HydrophobicContact CB-CB 4.23Å; S355-F374 WeakPolarHBondContact CB-O 3.4Å; S355-F374 PolarHBondContact OG-O 3.15Å; F374-Y513 HydrophobicContact CD1-CG 4.18Å; F374-D514 CarbonylContact C-O 3.56Å; F374-I515 HydrophobicContact CD1-CG1 4.44Å; F374-I515 HydrophobicContact CE1-CG1 4.22Å
375	R	90.3	Very high	88.1	Confident	61 Å²	61	37.3 Å²	37.3	23%	0.23	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	122.7	164.9	-176.1	170	63.8	-167.7	0.6	107.8	S355 D356 Y377 Y513 D514 L516 T527	S355-R375 VanDerWaalsContact OG-CA 3.29Å; S355-R375 WeakPolarHBondContact OG-CA 3.44Å; S355-R375 WeakPolarHBondContact OG-CB 3.39Å; D356-R375 WeakPolarHBondContact OD2-CD 3.47Å; D356-R375 IonicContact OD2-CZ 3.56Å; D356-R375 IonicContact OD2-NH1 3.41Å; D356-R375 PolarHBondContact OD2-NH1 3.43Å; D356-R375 VanDerWaalsContact OD2-NH1 3.1Å; R375-Y377 PolarHBondContact O-N 3.08Å; R375-Y513 CarbonylContact O-C 3.59Å; R375-Y513 VanDerWaalsContact O-CA 3.29Å; R375-Y513 WeakPolarHBondContact O-CA 3.37Å; R375-D514 HydrophobicContact CB-CB 4.19Å; R375-D514 IonicContact CZ-OD2 3.32Å; R375-D514 PolarHBondContact N-O 3.41Å; R375-D514 IonicContact NE-OD2 3.13Å; R375-D514 PolarHBondContact NE-OD2 3.26Å; R375-D514 VanDerWaalsContact NE-OD2 3.11Å; R375-D514 IonicContact NH2-OD2 2.69Å; R375-D514 PolarHBondContact NH2-OD2 2.65Å; R375-D514 PolarHBondContact O-N 3.42Å; R375-L516 HydrophobicContact CB-CD1 4Å; R375-L516 HydrophobicContact CB-CG 4.34Å; R375-T527 PolarHBondContact NH2-OG1 2.83Å
376	I	90.6	Very high	88.3	Confident	11 Å²	11	43.2 Å²	43.2	6%	0.056	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.2	134.3	169.6	-65.1	163.7	0	0	0	107.3	T197 V214 P215 E352 S378 Y513	T197-I376 HydrophobicContact CG2-CD1 4.08Å; V214-I376 HydrophobicContact CB-CD1 4.25Å; V214-I376 HydrophobicContact CG1-CD1 4.31Å; V214-I376 HydrophobicContact CG1-CG2 4.34Å; P215-I376 HydrophobicContact CG-CG2 4.34Å; E352-I376 HydrophobicContact CG-CD1 3.86Å; E352-I376 HydrophobicContact CG-CG1 4.2Å; I376-S378 PolarHBondContact O-N 3.1Å; I376-S378 VanDerWaalsContact O-N 3.09Å; I376-Y513 HydrophobicContact CG1-CD1 4.18Å; I376-Y513 HydrophobicContact CG1-CE1 3.84Å
377	Y	86.6	Confident	88.8	Confident	58 Å²	58	42.3 Å²	42.3	23%	0.227	22%	0.216	C	C	.	.			trans	-50.1	121.6	175.5	176.3	-100.6	0	0	0	110.2	R375 P379 Q444 D495 S497 Q499 R512	R375-Y377 PolarHBondContact O-N 3.08Å; Y377-P379 HydrophobicContact CE1-CG 4.26Å; Y377-Q444 PolarHBondContact O-NE2 3.42Å; Y377-D495 WeakPolarHBondContact CE1-OD2 3.09Å; Y377-S497 WeakPolarHBondContact OH-CB 3.49Å; Y377-Q499 HydrophobicContact CE1-CG 4.23Å; Y377-Q499 VanDerWaalsContact CZ-OE1 3.28Å; Y377-Q499 VanDerWaalsContact OH-CD 3.24Å; Y377-Q499 PolarHBondContact OH-NE2 2.75Å; Y377-R512 WeakPolarHBondContact CB-O 3.46Å; Y377-R512 HydrophobicContact CG-CB 4.38Å; Y377-R512 PolarHBondContact N-O 3.25Å
378	S	85.5	Confident	89.2	Confident	26 Å²	26	41.5 Å²	41.5	18%	0.182	21%	0.21	C	C	.	.			trans	-146.7	103.4	-176.2	-174.1	0	0	0	0	108.7	I376 P440 S443	I376-S378 PolarHBondContact O-N 3.1Å; I376-S378 VanDerWaalsContact O-N 3.09Å; S378-P440 WeakPolarHBondContact CB-O 3.44Å; S378-P440 PolarHBondContact OG-O 2.86Å; S378-S443 PolarHBondContact OG-OG 3.48Å
379	P	85.6	Confident	89.5	Confident	9 Å²	9	45 Å²	45	6%	0.058	23%	0.226	C	C	.	.			trans	-68.5	143.9	178	27.2	-34.3	0	0	0	111	Y377 V381 S443 S497	Y377-P379 HydrophobicContact CE1-CG 4.26Å; P379-V381 PolarHBondContact O-N 3.42Å; P379-S443 WeakPolarHBondContact CD-OG 3.46Å; P379-S443 VanDerWaalsContact O-CB 3.29Å; P379-S443 WeakPolarHBondContact O-CB 3.41Å; P379-S497 WeakPolarHBondContact CB-OG 3.36Å
380	P	86.1	Confident	89.8	Confident	117 Å²	117	47.1 Å²	47.1	76%	0.76	24%	0.242	S	C	*	.			trans	-57.5	136.7	169.8	-22.4	33.1	0	0	0	110.7	P382	P380-P382 VanDerWaalsContact O-CD 3.3Å; P380-P382 WeakPolarHBondContact O-CD 3.26Å
381	V	89.5	Confident	90.1	Very high	29 Å²	29	47.4 Å²	47.4	18%	0.176	24%	0.242	C	C	.	.			trans	-85.2	110.4	176.8	-177	0	0	0	0	108.7	I86 P379 F384 L442 V446 L496	I86-V381 HydrophobicContact CD1-CG1 3.93Å; P379-V381 PolarHBondContact O-N 3.42Å; V381-F384 HydrophobicContact CB-CB 4.18Å; V381-F384 HydrophobicContact CG1-CB 4Å; V381-L442 HydrophobicContact CG2-CB 4Å; V381-V446 HydrophobicContact CG2-CG2 4.43Å; V381-L496 HydrophobicContact CB-CD1 4.33Å; V381-L496 HydrophobicContact CG1-CD1 4Å; V381-L496 HydrophobicContact CG2-CD1 4.03Å
382	P	85.3	Confident	90.2	Very high	76 Å²	76	49.1 Å²	49.1	49%	0.494	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.1	146.8	-179.2	26.5	-32.9	0	0	0	110.5	P380 F384	P380-P382 VanDerWaalsContact O-CD 3.3Å; P380-P382 WeakPolarHBondContact O-CD 3.26Å; P382-F384 PolarHBondContact O-N 3.38Å
383	H	86.5	Confident	90.2	Very high	148 Å²	148	49.3 Å²	49.3	69%	0.685	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.2	-11.1	177.8	-49.2	-57.3	0	0	0	117.5	E385 K386 Y387	H383-E385 VanDerWaalsContact C-N 3.33Å; H383-E385 PolarHBondContact O-N 3Å; H383-K386 PolarHBondContact O-N 3.27Å; H383-Y387 PolarHBondContact O-N 3.21Å
384	F	92.1	Very high	90.2	Very high	3 Å²	3	55.3 Å²	55.3	1%	0.013	28%	0.282	C	S	.	.	H	α-helix	trans	-59	-42.9	178.2	178.8	-107.7	0	0	0	112.2	Q82 E85 I86 V381 P382 K386 Y387 Y388 L442	Q82-F384 HydrophobicContact CB-CE1 4.21Å; Q82-F384 HydrophobicContact CB-CZ 4.06Å; Q82-F384 HydrophobicContact CG-CE1 4.37Å; Q82-F384 HydrophobicContact CG-CZ 4.46Å; Q82-F384 WeakPolarHBondContact O-CZ 3.24Å; E85-F384 HydrophobicContact CB-CE2 4.17Å; E85-F384 HydrophobicContact CB-CZ 4.37Å; I86-F384 HydrophobicContact CB-CD2 4Å; I86-F384 HydrophobicContact CB-CE2 3.63Å; I86-F384 HydrophobicContact CB-CZ 4.21Å; I86-F384 HydrophobicContact CD1-CB 4.38Å; I86-F384 HydrophobicContact CD1-CD2 3.51Å; I86-F384 HydrophobicContact CD1-CE2 4.07Å; I86-F384 HydrophobicContact CD1-CG 4.14Å; I86-F384 HydrophobicContact CG1-CD2 4.23Å; I86-F384 HydrophobicContact CG1-CE2 4.36Å; V381-F384 HydrophobicContact CB-CB 4.18Å; V381-F384 HydrophobicContact CG1-CB 4Å; P382-F384 PolarHBondContact O-N 3.38Å; F384-K386 VanDerWaalsContact C-N 3.35Å; F384-K386 PolarHBondContact O-N 3.42Å; F384-Y387 HydrophobicContact CD2-CD1 4.13Å; F384-Y387 HydrophobicContact CE2-CD1 4.17Å; F384-Y387 HydrophobicContact CE2-CE1 4.49Å; F384-Y387 WeakPolarHBondContact O-CB 3.21Å; F384-Y387 PolarHBondContact O-N 3.32Å; F384-Y388 HydrophobicContact CE1-CG 4.47Å; F384-Y388 HydrophobicContact CZ-CD2 4.07Å; F384-Y388 HydrophobicContact CZ-CG 4.39Å; F384-Y388 VanDerWaalsContact O-CB 3.32Å; F384-Y388 WeakPolarHBondContact O-CB 3.44Å; F384-Y388 PolarHBondContact O-N 3.03Å; F384-L442 HydrophobicContact CD1-CD1 3.57Å; F384-L442 HydrophobicContact CE1-CD1 3.48Å; F384-L442 VanDerWaalsContact CE1-CD1 3.48Å; F384-L442 HydrophobicContact CE1-CD2 4.39Å; F384-L442 HydrophobicContact CG-CD1 4.46Å; F384-L442 HydrophobicContact CZ-CD1 4.32Å
385	E	91.2	Very high	90.2	Very high	93 Å²	93	59.6 Å²	59.6	44%	0.435	31%	0.305	S	S	.	.	H	α-helix	trans	-61	-44.2	178.2	-62.6	-168.1	149.2	0	0	111.8	H383 Y387 Y388 F389 Y436	H383-E385 VanDerWaalsContact C-N 3.33Å; H383-E385 PolarHBondContact O-N 3Å; E385-Y387 VanDerWaalsContact C-N 3.32Å; E385-Y387 PolarHBondContact O-N 3.06Å; E385-Y388 PolarHBondContact O-N 2.95Å; E385-F389 HydrophobicContact CB-CD2 4.42Å; E385-F389 HydrophobicContact CB-CE2 3.92Å; E385-F389 HydrophobicContact CB-CZ 4.09Å; E385-F389 VanDerWaalsContact O-CB 3.27Å; E385-F389 WeakPolarHBondContact O-CB 3.24Å; E385-F389 WeakPolarHBondContact O-CD1 3.17Å; E385-F389 VanDerWaalsContact O-CD2 3.22Å; E385-F389 WeakPolarHBondContact O-CD2 3.03Å; E385-F389 WeakPolarHBondContact O-CG 3.37Å; E385-F389 PolarHBondContact O-N 3.47Å; E385-Y436 HydrophobicContact CG-CE1 4.17Å
386	K	92.2	Very high	90.4	Very high	164 Å²	164	57 Å²	57	71%	0.713	30%	0.295	S	S	*	.	H	α-helix	trans	-62.2	-41.6	177.7	-174.3	-178.7	177.7	-175.9	0	111.2	H383 F384 S390	H383-K386 PolarHBondContact O-N 3.27Å; F384-K386 VanDerWaalsContact C-N 3.35Å; F384-K386 PolarHBondContact O-N 3.42Å; K386-S390 PolarHBondContact O-N 3.02Å
387	Y	93.5	Very high	90.3	Very high	46 Å²	46	65 Å²	65	18%	0.18	33%	0.329	C	S	.	.	H	α-helix	trans	-62.9	-55.5	174.5	165.3	-106.7	0	0	0	110.8	E85 Q89 H383 F384 E385 F389 S390 L391	E85-Y387 HydrophobicContact CB-CE1 4.16Å; E85-Y387 PolarHBondContact OE2-OH 2.91Å; Q89-Y387 HydrophobicContact CB-CE1 4.19Å; Q89-Y387 HydrophobicContact CG-CE1 4.48Å; Q89-Y387 VanDerWaalsContact OE1-CD1 3.28Å; H383-Y387 PolarHBondContact O-N 3.21Å; F384-Y387 HydrophobicContact CD2-CD1 4.13Å; F384-Y387 HydrophobicContact CE2-CD1 4.17Å; F384-Y387 HydrophobicContact CE2-CE1 4.49Å; F384-Y387 WeakPolarHBondContact O-CB 3.21Å; F384-Y387 PolarHBondContact O-N 3.32Å; E385-Y387 VanDerWaalsContact C-N 3.32Å; E385-Y387 PolarHBondContact O-N 3.06Å; Y387-F389 VanDerWaalsContact C-N 3.26Å; Y387-F389 PolarHBondContact O-N 2.73Å; Y387-S390 WeakPolarHBondContact O-CB 3.24Å; Y387-S390 PolarHBondContact O-N 3.03Å; Y387-S390 PolarHBondContact O-OG 3.01Å; Y387-L391 HydrophobicContact CE1-CD1 4.14Å; Y387-L391 HydrophobicContact CE2-CD2 3.91Å
388	Y	93.4	Very high	90.6	Very high	0 Å²	0	66 Å²	66	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-58.4	-37.8	-178.2	-172.7	-101.9	0	0	0	112.4	E77 I81 Q82 E85 F384 E385 S390 L391 F405 V432 Y436	E77-Y388 WeakPolarHBondContact CG-OH 3.44Å; E77-Y388 PolarHBondContact OE1-OH 3.32Å; I81-Y388 HydrophobicContact CG2-CE2 4.2Å; Q82-Y388 HydrophobicContact CG-CD2 4.46Å; Q82-Y388 HydrophobicContact CG-CE2 3.92Å; E85-Y388 HydrophobicContact CB-CD2 4.47Å; E85-Y388 HydrophobicContact CG-CD2 4.29Å; E85-Y388 HydrophobicContact CG-CE2 4.32Å; F384-Y388 HydrophobicContact CE1-CG 4.47Å; F384-Y388 HydrophobicContact CZ-CD2 4.07Å; F384-Y388 HydrophobicContact CZ-CG 4.39Å; F384-Y388 VanDerWaalsContact O-CB 3.32Å; F384-Y388 WeakPolarHBondContact O-CB 3.44Å; F384-Y388 PolarHBondContact O-N 3.03Å; E385-Y388 PolarHBondContact O-N 2.95Å; Y388-S390 VanDerWaalsContact C-N 3.26Å; Y388-S390 PolarHBondContact O-N 3.2Å; Y388-L391 HydrophobicContact CD2-CD1 4Å; Y388-L391 WeakPolarHBondContact O-CB 3.38Å; Y388-L391 PolarHBondContact O-N 3.06Å; Y388-F405 VanDerWaalsContact OH-CZ 3.28Å; Y388-F405 WeakPolarHBondContact OH-CZ 3.43Å; Y388-V432 HydrophobicContact CD1-CG2 4.49Å; Y388-V432 HydrophobicContact CE1-CG2 3.9Å; Y388-Y436 AromaticContact CD1-CD2 3.84Å; Y388-Y436 HydrophobicContact CD1-CD2 3.84Å; Y388-Y436 AromaticContact CD1-CE2 3.55Å; Y388-Y436 HydrophobicContact CD1-CE2 3.55Å; Y388-Y436 AromaticContact CE1-CD2 3.6Å; Y388-Y436 HydrophobicContact CE1-CD2 3.6Å; Y388-Y436 AromaticContact CE1-CE2 3.63Å; Y388-Y436 HydrophobicContact CE1-CE2 3.63Å; Y388-Y436 HydrophobicContact CG-CE2 4.42Å
389	F	93.3	Very high	91	Very high	73 Å²	73	65 Å²	65	32%	0.32	33%	0.325	S	S	.	.	H	α-helix	trans	-72	-18.5	177.1	-60.9	-16.4	0	0	0	114.2	E385 Y387 L391 V432 T433 Y436	E385-F389 HydrophobicContact CB-CD2 4.42Å; E385-F389 HydrophobicContact CB-CE2 3.92Å; E385-F389 HydrophobicContact CB-CZ 4.09Å; E385-F389 VanDerWaalsContact O-CB 3.27Å; E385-F389 WeakPolarHBondContact O-CB 3.24Å; E385-F389 WeakPolarHBondContact O-CD1 3.17Å; E385-F389 VanDerWaalsContact O-CD2 3.22Å; E385-F389 WeakPolarHBondContact O-CD2 3.03Å; E385-F389 WeakPolarHBondContact O-CG 3.37Å; E385-F389 PolarHBondContact O-N 3.47Å; Y387-F389 VanDerWaalsContact C-N 3.26Å; Y387-F389 PolarHBondContact O-N 2.73Å; F389-L391 VanDerWaalsContact C-N 3.33Å; F389-V432 HydrophobicContact CB-CG1 4.33Å; F389-V432 HydrophobicContact CD1-CG1 4.15Å; F389-T433 HydrophobicContact CB-CG2 4.21Å; F389-T433 HydrophobicContact CD1-CG2 3.69Å; F389-T433 HydrophobicContact CD2-CG2 3.72Å; F389-T433 HydrophobicContact CE1-CG2 3.94Å; F389-T433 HydrophobicContact CE2-CG2 3.96Å; F389-T433 HydrophobicContact CG-CG2 3.59Å; F389-T433 HydrophobicContact CZ-CG2 4.07Å; F389-Y436 AromaticContact CE1-CD1 3.61Å; F389-Y436 HydrophobicContact CE1-CD1 3.61Å; F389-Y436 AromaticContact CE1-CD2 3.82Å; F389-Y436 HydrophobicContact CE1-CD2 3.82Å; F389-Y436 AromaticContact CE1-CE1 3.83Å; F389-Y436 HydrophobicContact CE1-CE1 3.83Å; F389-Y436 HydrophobicContact CE1-CE2 4.02Å; F389-Y436 AromaticContact CE1-CG 3.59Å; F389-Y436 HydrophobicContact CE1-CG 3.59Å; F389-Y436 AromaticContact CZ-CD1 3.5Å; F389-Y436 HydrophobicContact CZ-CD1 3.5Å; F389-Y436 AromaticContact CZ-CE1 3.65Å; F389-Y436 HydrophobicContact CZ-CE1 3.65Å; F389-Y436 AromaticContact CZ-CG 3.98Å; F389-Y436 HydrophobicContact CZ-CG 3.98Å
390	S	93.1	Very high	91.4	Very high	66 Å²	66	66 Å²	66	46%	0.462	33%	0.332	S	S	.	.	H	α-helix	trans	-82.7	-11.3	174.6	76.5	0	0	0	0	113.1	K386 Y387 Y388 N395	K386-S390 PolarHBondContact O-N 3.02Å; Y387-S390 WeakPolarHBondContact O-CB 3.24Å; Y387-S390 PolarHBondContact O-N 3.03Å; Y387-S390 PolarHBondContact O-OG 3.01Å; Y388-S390 VanDerWaalsContact C-N 3.26Å; Y388-S390 PolarHBondContact O-N 3.2Å; S390-N395 PolarHBondContact O-ND2 2.88Å
391	L	93.3	Very high	91.8	Very high	10 Å²	10	60.9 Å²	60.9	5%	0.052	30%	0.297	C	S	.	.			trans	-74.6	133.8	-176	-59.9	176.9	0	0	0	111.8	E85 Y387 Y388 F389 N395 N396 F402	E85-L391 HydrophobicContact CG-CD1 3.81Å; E85-L391 WeakPolarHBondContact OE2-CD1 3.48Å; Y387-L391 HydrophobicContact CE1-CD1 4.14Å; Y387-L391 HydrophobicContact CE2-CD2 3.91Å; Y388-L391 HydrophobicContact CD2-CD1 4Å; Y388-L391 WeakPolarHBondContact O-CB 3.38Å; Y388-L391 PolarHBondContact O-N 3.06Å; F389-L391 VanDerWaalsContact C-N 3.33Å; L391-N395 WeakPolarHBondContact CA-OD1 3.29Å; L391-N396 HydrophobicContact CD2-CB 4.35Å; L391-F402 HydrophobicContact CB-CE1 4.3Å; L391-F402 HydrophobicContact CB-CE2 4.03Å; L391-F402 HydrophobicContact CB-CZ 3.53Å; L391-F402 HydrophobicContact CD1-CE2 4.1Å; L391-F402 HydrophobicContact CD1-CZ 4.46Å
392	T	93.2	Very high	92	Very high	40 Å²	40	59.5 Å²	59.5	25%	0.245	29%	0.289	C	S	.	.			trans	-133.9	158.3	175.1	68.5	0	0	0	0	109.6	E394 N395 N396	T392-E394 PolarHBondContact O-N 2.95Å; T392-E394 PolarHBondContact OG1-N 3.25Å; T392-N395 PolarHBondContact N-OD1 2.96Å; T392-N395 PolarHBondContact O-N 2.95Å; T392-N395 PolarHBondContact O-OD1 2.7Å; T392-N395 PolarHBondContact OG1-N 3.13Å; T392-N396 PolarHBondContact O-N 3.42Å
393	P	91.3	Very high	92.4	Very high	5 Å²	5	57.4 Å²	57.4	3%	0.032	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57	-19.3	175.3	-27.5	36.8	0	0	0	114.3	I403 W406 Y414	P393-I403 HydrophobicContact CB-CG1 4.39Å; P393-W406 HydrophobicContact CG-CB 4.16Å; P393-W406 HydrophobicContact CG-CD2 3.51Å; P393-W406 HydrophobicContact CG-CE3 4Å; P393-W406 HydrophobicContact CG-CG 3.59Å; P393-W406 HydrophobicContact CG-CZ2 4.3Å; P393-Y414 HydrophobicContact CB-CD1 4.41Å; P393-Y414 HydrophobicContact CB-CD2 4.3Å; P393-Y414 HydrophobicContact CB-CE1 3.97Å; P393-Y414 HydrophobicContact CB-CE2 3.86Å; P393-Y414 HydrophobicContact CG-CD2 4.43Å; P393-Y414 HydrophobicContact CG-CE2 4.26Å
394	E	89.7	Confident	92.6	Very high	127 Å²	127	52 Å²	52	59%	0.593	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.7	-39.9	179.1	-65.8	178.8	-177.9	0	0	112.6	T392	T392-E394 PolarHBondContact O-N 2.95Å; T392-E394 PolarHBondContact OG1-N 3.25Å
395	N	93	Very high	92.6	Very high	90 Å²	90	52.1 Å²	52.1	48%	0.481	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.4	-26.2	-177.8	72.1	14.6	0	0	0	113.3	S390 L391 T392 K397	S390-N395 PolarHBondContact O-ND2 2.88Å; L391-N395 WeakPolarHBondContact CA-OD1 3.29Å; T392-N395 PolarHBondContact N-OD1 2.96Å; T392-N395 PolarHBondContact O-N 2.95Å; T392-N395 PolarHBondContact O-OD1 2.7Å; T392-N395 PolarHBondContact OG1-N 3.13Å; N395-K397 PolarHBondContact O-N 2.74Å
396	N	92.6	Very high	92.7	Very high	5 Å²	5	47.8 Å²	47.8	3%	0.027	23%	0.23	C	C	.	.			trans	-103.3	79.1	-176.4	-169.8	2.6	0	0	0	111.9	E85 L391 T392 R398 N399 F402	E85-N396 VanDerWaalsContact CD-ND2 3.35Å; E85-N396 PolarHBondContact OE1-ND2 2.53Å; L391-N396 HydrophobicContact CD2-CB 4.35Å; T392-N396 PolarHBondContact O-N 3.42Å; N396-R398 VanDerWaalsContact OD1-CG 3.25Å; N396-R398 WeakPolarHBondContact OD1-CG 3.3Å; N396-N399 PolarHBondContact OD1-N 2.81Å; N396-F402 HydrophobicContact CB-CD1 3.92Å; N396-F402 HydrophobicContact CB-CE1 4.16Å; N396-F402 HydrophobicContact CB-CG 4.21Å; N396-F402 WeakPolarHBondContact ND2-CD2 3.46Å; N396-F402 WeakPolarHBondContact ND2-CG 3.42Å
397	K	90.3	Very high	92.7	Very high	179 Å²	179	40.2 Å²	40.2	78%	0.778	20%	0.197	S	C	*	.			trans	-91.4	-14.5	175.4	-62.8	-176.7	-177	176.4	0	113.8	N395	N395-K397 PolarHBondContact O-N 2.74Å
398	R	92.1	Very high	92.5	Very high	81 Å²	81	40.8 Å²	40.8	31%	0.306	20%	0.201	S	C	.	.	S	Bend	trans	-73.5	-28.9	-178.7	62.9	-169	-83.1	175.5	4.5	113.1	M88 D92 N396 P400	M88-R398 PolarHBondContact O-NH2 3.44Å; M88-R398 VanDerWaalsContact O-NH2 3.09Å; M88-R398 HydrophobicContact SD-CB 4.46Å; M88-R398 HydrophobicContact SD-CG 3.86Å; M88-R398 PolarHBondContact SD-NE 3.14Å; D92-R398 IonicContact OD1-NH2 3.87Å; D92-R398 PolarHBondContact OD1-NH2 3Å; D92-R398 IonicContact OD2-CZ 3.27Å; D92-R398 VanDerWaalsContact OD2-CZ 3.28Å; D92-R398 IonicContact OD2-NH1 3.55Å; D92-R398 PolarHBondContact OD2-NH1 3.46Å; D92-R398 IonicContact OD2-NH2 3.57Å; D92-R398 PolarHBondContact OD2-NH2 3.48Å; N396-R398 VanDerWaalsContact OD1-CG 3.25Å; N396-R398 WeakPolarHBondContact OD1-CG 3.3Å; R398-P400 WeakPolarHBondContact O-CD 3.49Å
399	N	94.2	Very high	92.4	Very high	3 Å²	3	42.8 Å²	42.8	2%	0.016	21%	0.21	C	C	.	.			trans	-95.5	108.1	177	-178.8	-11.7	0	0	0	110.7	E85 N396 W401 F402	E85-N399 VanDerWaalsContact OE1-CB 3.31Å; E85-N399 WeakPolarHBondContact OE1-CB 3.4Å; E85-N399 PolarHBondContact OE1-ND2 3.17Å; N396-N399 PolarHBondContact OD1-N 2.81Å; N399-W401 PolarHBondContact O-N 3.1Å; N399-W401 PolarHBondContact OD1-N 2.97Å; N399-W401 VanDerWaalsContact OD1-N 3.07Å; N399-F402 HydrophobicContact CB-CB 4.01Å; N399-F402 WeakPolarHBondContact O-CB 3.38Å; N399-F402 PolarHBondContact O-N 3.27Å; N399-F402 PolarHBondContact OD1-N 3.05Å
400	P	93.8	Very high	92.3	Very high	30 Å²	30	40.4 Å²	40.4	20%	0.195	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-12.9	-173.6	31.9	-36.8	0	0	0	113.9	R46 A48 R398	R46-P400 HydrophobicContact CB-CB 4.04Å; R46-P400 HydrophobicContact CB-CG 4.02Å; R46-P400 PolarHBondContact NH1-O 3.37Å; A48-P400 HydrophobicContact CB-CG 4.04Å; R398-P400 WeakPolarHBondContact O-CD 3.49Å
401	W	94.5	Very high	92.1	Very high	10 Å²	10	42.5 Å²	42.5	4%	0.038	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.4	-9.4	177.1	-57.8	-82.1	0	0	0	113	R46 A48 I62 H63 I81 D112 N399 I403 D404 F405	R46-W401 HydrophobicContact CB-CZ2 4.06Å; R46-W401 WeakPolarHBondContact O-CH2 3.48Å; R46-W401 WeakPolarHBondContact O-CZ2 3.37Å; A48-W401 HydrophobicContact CB-CE3 4.36Å; A48-W401 HydrophobicContact CB-CH2 4.41Å; A48-W401 HydrophobicContact CB-CZ3 3.64Å; I62-W401 HydrophobicContact CD1-CD2 3.56Å; I62-W401 HydrophobicContact CD1-CE3 3.3Å; I62-W401 HydrophobicContact CD1-CG 4.46Å; I62-W401 HydrophobicContact CD1-CH2 3.26Å; I62-W401 HydrophobicContact CD1-CZ2 3.5Å; I62-W401 VanDerWaalsContact CD1-CZ2 3.5Å; I62-W401 HydrophobicContact CD1-CZ3 3.13Å; I62-W401 HydrophobicContact CG2-CB 4.02Å; I62-W401 HydrophobicContact CG2-CD2 3.91Å; I62-W401 HydrophobicContact CG2-CE3 4.4Å; I62-W401 HydrophobicContact CG2-CG 3.71Å; H63-W401 AromaticContact CE1-CD1 3.73Å; H63-W401 AromaticContact CE1-NE1 3.89Å; I81-W401 HydrophobicContact CD1-CB 3.92Å; D112-W401 HydrophobicContact CB-CZ2 4.27Å; N399-W401 PolarHBondContact O-N 3.1Å; N399-W401 PolarHBondContact OD1-N 2.97Å; N399-W401 VanDerWaalsContact OD1-N 3.07Å; W401-I403 VanDerWaalsContact C-N 3.32Å; W401-I403 PolarHBondContact O-N 2.8Å; W401-D404 PolarHBondContact O-N 3.41Å; W401-D404 VanDerWaalsContact O-N 3.15Å; W401-F405 WeakPolarHBondContact O-CB 3.5Å; W401-F405 PolarHBondContact O-N 2.71Å
402	F	94.1	Very high	92.1	Very high	0 Å²	0	42 Å²	42	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-63.2	-36.4	-173.8	-165.6	-100.2	0	0	0	113.1	I81 L391 N396 N399 F405 W406	I81-F402 HydrophobicContact CG2-CD2 4.17Å; I81-F402 HydrophobicContact CG2-CE2 4.49Å; L391-F402 HydrophobicContact CB-CE1 4.3Å; L391-F402 HydrophobicContact CB-CE2 4.03Å; L391-F402 HydrophobicContact CB-CZ 3.53Å; L391-F402 HydrophobicContact CD1-CE2 4.1Å; L391-F402 HydrophobicContact CD1-CZ 4.46Å; N396-F402 HydrophobicContact CB-CD1 3.92Å; N396-F402 HydrophobicContact CB-CE1 4.16Å; N396-F402 HydrophobicContact CB-CG 4.21Å; N396-F402 WeakPolarHBondContact ND2-CD2 3.46Å; N396-F402 WeakPolarHBondContact ND2-CG 3.42Å; N399-F402 HydrophobicContact CB-CB 4.01Å; N399-F402 WeakPolarHBondContact O-CB 3.38Å; N399-F402 PolarHBondContact O-N 3.27Å; N399-F402 PolarHBondContact OD1-N 3.05Å; F402-F405 HydrophobicContact CD2-CD1 4.07Å; F402-F405 HydrophobicContact CE2-CD1 4.04Å; F402-F405 HydrophobicContact CE2-CE1 4.08Å; F402-F405 HydrophobicContact CZ-CE1 4.44Å; F402-F405 WeakPolarHBondContact O-CB 3.36Å; F402-W406 AromaticContact CE1-CE3 4Å; F402-W406 HydrophobicContact CE1-CE3 4Å; F402-W406 HydrophobicContact CE1-CZ3 4.28Å; F402-W406 HydrophobicContact CZ-CE3 4.21Å; F402-W406 HydrophobicContact CZ-CZ3 4.28Å; F402-W406 WeakPolarHBondContact O-CB 3.42Å; F402-W406 PolarHBondContact O-N 3.38Å
403	I	92.2	Very high	91.9	Very high	33 Å²	33	40.3 Å²	40.3	17%	0.169	19%	0.192	C	C	.	.	H	α-helix	trans	-67.6	-44.6	175	-65.8	170	0	0	0	110.8	P393 W401 F405 W406 E407 Y414 R415	P393-I403 HydrophobicContact CB-CG1 4.39Å; W401-I403 VanDerWaalsContact C-N 3.32Å; W401-I403 PolarHBondContact O-N 2.8Å; I403-F405 VanDerWaalsContact C-N 3.27Å; I403-F405 PolarHBondContact O-N 2.58Å; I403-W406 WeakPolarHBondContact O-CB 3.45Å; I403-W406 PolarHBondContact O-N 2.88Å; I403-W406 VanDerWaalsContact O-N 3.12Å; I403-E407 HydrophobicContact CG2-CG 4.37Å; I403-E407 WeakPolarHBondContact O-CG 3.41Å; I403-E407 PolarHBondContact O-N 2.97Å; I403-Y414 HydrophobicContact CG2-CD1 4.06Å; I403-Y414 HydrophobicContact CG2-CG 4.47Å; I403-R415 HydrophobicContact CG2-CG 4Å
404	D	91	Very high	91.7	Very high	34 Å²	34	44 Å²	44	18%	0.182	21%	0.206	C	C	.	.	H	α-helix	trans	-63.4	-39.4	179.6	-59	-4.2	0	0	0	110.1	R46 I75 W401 E407 E408 R415	R46-D404 IonicContact CZ-OD2 3.55Å; R46-D404 VanDerWaalsContact CZ-OD2 3.3Å; R46-D404 VanDerWaalsContact NH1-CG 3.32Å; R46-D404 IonicContact NH1-OD1 2.78Å; R46-D404 PolarHBondContact NH1-OD1 3.13Å; R46-D404 IonicContact NH1-OD2 2.75Å; R46-D404 PolarHBondContact NH1-OD2 2.82Å; R46-D404 IonicContact NH2-OD1 3.88Å; R46-D404 IonicContact NH2-OD2 3.27Å; R46-D404 PolarHBondContact NH2-OD2 3.01Å; I75-D404 VanDerWaalsContact CD1-C 3.46Å; I75-D404 HydrophobicContact CD1-CB 3.5Å; I75-D404 VanDerWaalsContact CD1-CB 3.5Å; W401-D404 PolarHBondContact O-N 3.41Å; W401-D404 VanDerWaalsContact O-N 3.15Å; D404-E407 PolarHBondContact O-N 3.01Å; D404-E408 WeakPolarHBondContact O-CB 3.4Å; D404-E408 PolarHBondContact O-N 2.8Å; D404-R415 IonicContact OD1-CZ 3.26Å; D404-R415 IonicContact OD1-NH1 3.34Å; D404-R415 PolarHBondContact OD1-NH1 3.25Å; D404-R415 IonicContact OD1-NH2 3.38Å
405	F	93.2	Very high	91.5	Very high	6 Å²	6	41.9 Å²	41.9	3%	0.026	19%	0.193	C	C	.	.	H	α-helix	trans	-58.5	-46.8	171.3	158.6	-110.1	0	0	0	112	I75 E77 I81 Y388 W401 F402 I403 E408 K409 V432	I75-F405 HydrophobicContact CD1-CB 4.2Å; I75-F405 VanDerWaalsContact CD1-N 3.26Å; I75-F405 HydrophobicContact CG2-CB 4.17Å; I75-F405 HydrophobicContact CG2-CD2 4.38Å; E77-F405 HydrophobicContact CB-CD2 4.42Å; E77-F405 HydrophobicContact CB-CE2 3.86Å; E77-F405 VanDerWaalsContact CD-CE2 3.47Å; E77-F405 HydrophobicContact CG-CD2 4.46Å; E77-F405 HydrophobicContact CG-CE2 3.56Å; E77-F405 HydrophobicContact CG-CZ 4.02Å; I81-F405 HydrophobicContact CD1-CB 3.98Å; I81-F405 HydrophobicContact CD1-CG 4.47Å; I81-F405 HydrophobicContact CG1-CB 3.97Å; I81-F405 HydrophobicContact CG1-CD2 4.07Å; I81-F405 HydrophobicContact CG1-CG 3.98Å; I81-F405 HydrophobicContact CG2-CD1 4.26Å; I81-F405 HydrophobicContact CG2-CG 4.38Å; Y388-F405 VanDerWaalsContact OH-CZ 3.28Å; Y388-F405 WeakPolarHBondContact OH-CZ 3.43Å; W401-F405 WeakPolarHBondContact O-CB 3.5Å; W401-F405 PolarHBondContact O-N 2.71Å; F402-F405 HydrophobicContact CD2-CD1 4.07Å; F402-F405 HydrophobicContact CE2-CD1 4.04Å; F402-F405 HydrophobicContact CE2-CE1 4.08Å; F402-F405 HydrophobicContact CZ-CE1 4.44Å; F402-F405 WeakPolarHBondContact O-CB 3.36Å; I403-F405 VanDerWaalsContact C-N 3.27Å; I403-F405 PolarHBondContact O-N 2.58Å; F405-E408 PolarHBondContact O-N 2.86Å; F405-K409 HydrophobicContact CD2-CB 4.41Å; F405-K409 HydrophobicContact CE1-CD 4.32Å; F405-K409 HydrophobicContact CE2-CB 4.12Å; F405-K409 HydrophobicContact CE2-CD 3.5Å; F405-K409 VanDerWaalsContact CE2-CD 3.5Å; F405-K409 HydrophobicContact CE2-CG 4.41Å; F405-K409 HydrophobicContact CZ-CD 3.38Å; F405-K409 WeakPolarHBondContact O-CB 3.3Å; F405-K409 PolarHBondContact O-N 2.93Å; F405-V432 HydrophobicContact CE1-CG2 4.25Å; F405-V432 HydrophobicContact CZ-CG2 4.36Å
406	W	92.6	Very high	90.8	Very high	1 Å²	1	45.9 Å²	45.9	0%	0.004	21%	0.206	C	C	.	.	H	α-helix	trans	-61.7	-45.6	179.9	-163.2	-90.9	0	0	0	111.7	P393 F402 I403 F410 E430 V432	P393-W406 HydrophobicContact CG-CB 4.16Å; P393-W406 HydrophobicContact CG-CD2 3.51Å; P393-W406 HydrophobicContact CG-CE3 4Å; P393-W406 HydrophobicContact CG-CG 3.59Å; P393-W406 HydrophobicContact CG-CZ2 4.3Å; F402-W406 AromaticContact CE1-CE3 4Å; F402-W406 HydrophobicContact CE1-CE3 4Å; F402-W406 HydrophobicContact CE1-CZ3 4.28Å; F402-W406 HydrophobicContact CZ-CE3 4.21Å; F402-W406 HydrophobicContact CZ-CZ3 4.28Å; F402-W406 WeakPolarHBondContact O-CB 3.42Å; F402-W406 PolarHBondContact O-N 3.38Å; I403-W406 WeakPolarHBondContact O-CB 3.45Å; I403-W406 PolarHBondContact O-N 2.88Å; I403-W406 VanDerWaalsContact O-N 3.12Å; W406-F410 AromaticContact CD1-CD2 3.82Å; W406-F410 AromaticContact CD2-CD2 3.78Å; W406-F410 HydrophobicContact CD2-CD2 3.78Å; W406-F410 AromaticContact CD2-CE2 3.58Å; W406-F410 HydrophobicContact CD2-CE2 3.58Å; W406-F410 AromaticContact CE2-CD2 3.69Å; W406-F410 AromaticContact CE2-CE2 3.52Å; W406-F410 HydrophobicContact CE3-CD2 4.41Å; W406-F410 AromaticContact CE3-CE2 3.79Å; W406-F410 HydrophobicContact CE3-CE2 3.79Å; W406-F410 AromaticContact CG-CD2 3.91Å; W406-F410 HydrophobicContact CG-CD2 3.91Å; W406-F410 HydrophobicContact CG-CE2 4.19Å; W406-F410 AromaticContact CH2-CE2 3.96Å; W406-F410 HydrophobicContact CH2-CE2 3.96Å; W406-F410 HydrophobicContact CZ2-CD2 4.3Å; W406-F410 AromaticContact CZ2-CE2 3.75Å; W406-F410 HydrophobicContact CZ2-CE2 3.75Å; W406-F410 AromaticContact CZ3-CE2 3.97Å; W406-F410 HydrophobicContact CZ3-CE2 3.97Å; W406-F410 AromaticContact NE1-CD2 3.67Å; W406-F410 WeakPolarHBondContact O-CB 3.44Å; W406-F410 VanDerWaalsContact O-CD2 3.29Å; W406-F410 WeakPolarHBondContact O-CD2 3.41Å; W406-F410 PolarHBondContact O-N 3.27Å; W406-E430 HydrophobicContact CH2-CB 4.4Å; W406-E430 WeakPolarHBondContact CH2-O 3.42Å; W406-E430 HydrophobicContact CZ2-CB 3.57Å; W406-E430 WeakPolarHBondContact CZ2-O 3.25Å; W406-E430 PolarHBondContact NE1-OE2 3.21Å; W406-V432 HydrophobicContact CH2-CB 4.38Å; W406-V432 HydrophobicContact CZ3-CB 3.99Å; W406-V432 HydrophobicContact CZ3-CG2 4.21Å
407	E	91.7	Very high	90.2	Very high	5 Å²	5	53 Å²	53	2%	0.023	24%	0.243	C	C	.	.	H	α-helix	trans	-63.6	-45.3	178.7	-68.4	-172.5	166.8	0	0	111.8	I403 D404 N411 C412 Y414 R415 T418 Y422	I403-E407 HydrophobicContact CG2-CG 4.37Å; I403-E407 WeakPolarHBondContact O-CG 3.41Å; I403-E407 PolarHBondContact O-N 2.97Å; D404-E407 PolarHBondContact O-N 3.01Å; E407-N411 VanDerWaalsContact O-CA 3.25Å; E407-N411 WeakPolarHBondContact O-CA 3.31Å; E407-N411 PolarHBondContact O-N 3.06Å; E407-C412 WeakPolarHBondContact CA-O 3.43Å; E407-C412 WeakPolarHBondContact CB-O 3.39Å; E407-C412 VanDerWaalsContact CG-O 3.27Å; E407-C412 WeakPolarHBondContact CG-O 3.23Å; E407-C412 PolarHBondContact O-N 3.33Å; E407-C412 VanDerWaalsContact O-N 3.15Å; E407-Y414 WeakPolarHBondContact OE1-CA 3.45Å; E407-Y414 WeakPolarHBondContact OE1-CB 3.31Å; E407-Y414 PolarHBondContact OE1-N 3.43Å; E407-R415 PolarHBondContact OE1-N 2.85Å; E407-T418 PolarHBondContact OE1-OG1 3.09Å; E407-T418 WeakPolarHBondContact OE2-CB 3.43Å; E407-T418 WeakPolarHBondContact OE2-CG2 3.49Å; E407-T418 PolarHBondContact OE2-OG1 3.02Å; E407-Y422 HydrophobicContact CB-CD2 4.25Å; E407-Y422 HydrophobicContact CB-CE2 3.9Å
408	E	90	Very high	89.6	Confident	58 Å²	58	45.6 Å²	45.6	27%	0.271	21%	0.213	S	C	.	.	H	α-helix	trans	-67.2	-44.3	178.3	-170.1	177.6	168.5	0	0	112	K74 I75 D404 F405 F410	K74-E408 WeakPolarHBondContact CB-OE1 3.41Å; K74-E408 VanDerWaalsContact CD-OE1 3.24Å; K74-E408 WeakPolarHBondContact CD-OE1 3.42Å; K74-E408 WeakPolarHBondContact CG-OE1 3.48Å; I75-E408 PolarHBondContact N-OE2 2.73Å; D404-E408 WeakPolarHBondContact O-CB 3.4Å; D404-E408 PolarHBondContact O-N 2.8Å; F405-E408 PolarHBondContact O-N 2.86Å; E408-F410 PolarHBondContact O-N 2.84Å
409	K	90.5	Very high	88.7	Confident	42 Å²	42	47.2 Å²	47.2	18%	0.183	22%	0.219	C	C	.	.	H	α-helix	trans	-64.8	-41.7	-177.8	179.4	164.2	-177.6	165.5	0	112.6	E77 F405 V432 F434	E77-K409 VanDerWaalsContact CD-NZ 3.3Å; E77-K409 IonicContact OE1-NZ 3.49Å; E77-K409 PolarHBondContact OE1-NZ 3.14Å; E77-K409 IonicContact OE2-NZ 2.91Å; E77-K409 PolarHBondContact OE2-NZ 2.74Å; E77-K409 VanDerWaalsContact OE2-NZ 3.13Å; F405-K409 HydrophobicContact CD2-CB 4.41Å; F405-K409 HydrophobicContact CE1-CD 4.32Å; F405-K409 HydrophobicContact CE2-CB 4.12Å; F405-K409 HydrophobicContact CE2-CD 3.5Å; F405-K409 VanDerWaalsContact CE2-CD 3.5Å; F405-K409 HydrophobicContact CE2-CG 4.41Å; F405-K409 HydrophobicContact CZ-CD 3.38Å; F405-K409 WeakPolarHBondContact O-CB 3.3Å; F405-K409 PolarHBondContact O-N 2.93Å; K409-V432 PolarHBondContact NZ-O 2.96Å; K409-F434 WeakPolarHBondContact CE-O 3.41Å; K409-F434 PolarHBondContact NZ-O 2.82Å
410	F	91.7	Very high	87.8	Confident	24 Å²	24	55.2 Å²	55.2	11%	0.105	26%	0.261	C	S	.	.	H	α-helix	trans	-99	-0.1	-177	-64.2	-62.1	0	0	0	113.7	W406 E408 C412 R424 E430 N431 F434	W406-F410 AromaticContact CD1-CD2 3.82Å; W406-F410 AromaticContact CD2-CD2 3.78Å; W406-F410 HydrophobicContact CD2-CD2 3.78Å; W406-F410 AromaticContact CD2-CE2 3.58Å; W406-F410 HydrophobicContact CD2-CE2 3.58Å; W406-F410 AromaticContact CE2-CD2 3.69Å; W406-F410 AromaticContact CE2-CE2 3.52Å; W406-F410 HydrophobicContact CE3-CD2 4.41Å; W406-F410 AromaticContact CE3-CE2 3.79Å; W406-F410 HydrophobicContact CE3-CE2 3.79Å; W406-F410 AromaticContact CG-CD2 3.91Å; W406-F410 HydrophobicContact CG-CD2 3.91Å; W406-F410 HydrophobicContact CG-CE2 4.19Å; W406-F410 AromaticContact CH2-CE2 3.96Å; W406-F410 HydrophobicContact CH2-CE2 3.96Å; W406-F410 HydrophobicContact CZ2-CD2 4.3Å; W406-F410 AromaticContact CZ2-CE2 3.75Å; W406-F410 HydrophobicContact CZ2-CE2 3.75Å; W406-F410 AromaticContact CZ3-CE2 3.97Å; W406-F410 HydrophobicContact CZ3-CE2 3.97Å; W406-F410 AromaticContact NE1-CD2 3.67Å; W406-F410 WeakPolarHBondContact O-CB 3.44Å; W406-F410 VanDerWaalsContact O-CD2 3.29Å; W406-F410 WeakPolarHBondContact O-CD2 3.41Å; W406-F410 PolarHBondContact O-N 3.27Å; E408-F410 PolarHBondContact O-N 2.84Å; F410-C412 VanDerWaalsContact C-N 3.27Å; F410-C412 VanDerWaalsContact CB-SG 3.55Å; F410-C412 PolarHBondContact O-N 3.41Å; F410-R424 PolarHBondContact O-NH2 2.84Å; F410-E430 HydrophobicContact CB-CG 4.33Å; F410-E430 HydrophobicContact CD1-CB 3.82Å; F410-E430 HydrophobicContact CD1-CG 4.08Å; F410-E430 HydrophobicContact CD2-CB 3.64Å; F410-E430 HydrophobicContact CD2-CG 4.07Å; F410-E430 HydrophobicContact CE1-CB 3.68Å; F410-E430 HydrophobicContact CE1-CG 4.42Å; F410-E430 HydrophobicContact CE2-CB 3.49Å; F410-E430 VanDerWaalsContact CE2-CB 3.49Å; F410-E430 HydrophobicContact CE2-CG 4.41Å; F410-E430 HydrophobicContact CG-CB 3.81Å; F410-E430 HydrophobicContact CG-CG 3.9Å; F410-E430 HydrophobicContact CZ-CB 3.5Å; F410-N431 WeakPolarHBondContact CE1-O 3.39Å; F410-N431 WeakPolarHBondContact CZ-O 3.5Å; F410-F434 HydrophobicContact CE1-CB 4.35Å
411	N	89.7	Confident	87.1	Confident	110 Å²	110	60.2 Å²	60.2	59%	0.588	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	51	48.6	-178.7	-159.1	38.5	0	0	0	111.3	E407 Y422	E407-N411 VanDerWaalsContact O-CA 3.25Å; E407-N411 WeakPolarHBondContact O-CA 3.31Å; E407-N411 PolarHBondContact O-N 3.06Å; N411-Y422 HydrophobicContact CB-CD1 4.47Å; N411-Y422 WeakPolarHBondContact OD1-CD1 3.5Å; N411-Y422 WeakPolarHBondContact OD1-CE1 3.5Å
412	C	91.9	Very high	86.6	Confident	0 Å²	0	61.8 Å²	61.8	0%	0	29%	0.292	C	S	.	.			trans	-140.5	155.6	-177.5	63.3	0	0	0	0	111.1	E407 F410 Y422 R424 C426	E407-C412 WeakPolarHBondContact CA-O 3.43Å; E407-C412 WeakPolarHBondContact CB-O 3.39Å; E407-C412 VanDerWaalsContact CG-O 3.27Å; E407-C412 WeakPolarHBondContact CG-O 3.23Å; E407-C412 PolarHBondContact O-N 3.33Å; E407-C412 VanDerWaalsContact O-N 3.15Å; F410-C412 VanDerWaalsContact C-N 3.27Å; F410-C412 VanDerWaalsContact CB-SG 3.55Å; F410-C412 PolarHBondContact O-N 3.41Å; C412-Y422 VanDerWaalsContact C-CB 3.44Å; C412-Y422 WeakPolarHBondContact O-CD2 3.31Å; C412-R424 CarbonylContact C-O 3.55Å; C412-R424 WeakPolarHBondContact CA-O 3.28Å; C412-R424 HydrophobicContact CB-CB 4.23Å; C412-R424 HydrophobicContact CB-CG 4.38Å; C412-R424 VanDerWaalsContact CB-O 3.22Å; C412-R424 WeakPolarHBondContact CB-O 3.39Å; C412-C426 HydrophobicContact CB-CB 4.04Å; C412-C426 WeakPolarHBondContact CB-SG 3.46Å; C412-C426 PolarHBondContact O-SG 3.28Å; C412-C426 WeakPolarHBondContact SG-CA 3.39Å; C412-C426 WeakPolarHBondContact SG-CB 3.43Å; C412-C426 CovalentContact SG-SG 2.03Å; C412-C426 PolarHBondContact SG-SG 3.02Å
413	S	90.3	Very high	85.9	Confident	3 Å²	3	71.6 Å²	71.6	2%	0.021	34%	0.337	C	S	.	.	B	Isolated β-bridge	trans	-94.3	125.5	175.2	68.7	0	0	0	0	110.5	R419 R424 R425 C426	S413-R419 WeakPolarHBondContact OG-CG 3.3Å; S413-R424 PolarHBondContact N-O 3.35Å; S413-R425 WeakPolarHBondContact O-CA 3.26Å; S413-C426 VanDerWaalsContact C-SG 3.54Å; S413-C426 PolarHBondContact O-N 2.87Å
414	Y	86.8	Confident	85.8	Confident	84 Å²	84	75.6 Å²	75.6	33%	0.329	35%	0.35	S	S	.	.	S	Bend	trans	-96	-41.9	168.1	-168	-97.1	0	0	0	110	P393 I403 E407 C426	P393-Y414 HydrophobicContact CB-CD1 4.41Å; P393-Y414 HydrophobicContact CB-CD2 4.3Å; P393-Y414 HydrophobicContact CB-CE1 3.97Å; P393-Y414 HydrophobicContact CB-CE2 3.86Å; P393-Y414 HydrophobicContact CG-CD2 4.43Å; P393-Y414 HydrophobicContact CG-CE2 4.26Å; I403-Y414 HydrophobicContact CG2-CD1 4.06Å; I403-Y414 HydrophobicContact CG2-CG 4.47Å; E407-Y414 WeakPolarHBondContact OE1-CA 3.45Å; E407-Y414 WeakPolarHBondContact OE1-CB 3.31Å; E407-Y414 PolarHBondContact OE1-N 3.43Å; Y414-C426 HydrophobicContact CD2-CB 4.03Å
415	R	84.7	Confident	85.7	Confident	81 Å²	81	82 Å²	82	31%	0.306	37%	0.372	S	S	.	.	S	Bend	trans	-83.7	150	175.1	-62.8	178.4	179	164	2.4	111.2	I403 D404 E407 L417 T418	I403-R415 HydrophobicContact CG2-CG 4Å; D404-R415 IonicContact OD1-CZ 3.26Å; D404-R415 IonicContact OD1-NH1 3.34Å; D404-R415 PolarHBondContact OD1-NH1 3.25Å; D404-R415 IonicContact OD1-NH2 3.38Å; E407-R415 PolarHBondContact OE1-N 2.85Å; R415-L417 VanDerWaalsContact C-N 3.26Å; R415-L417 PolarHBondContact O-N 3.39Å; R415-T418 PolarHBondContact O-N 3.05Å; R415-T418 PolarHBondContact O-OG1 3.02Å
416	K	79.5	Confident	85.4	Confident	175 Å²	175	82.2 Å²	82.2	76%	0.761	37%	0.374	S	S	*	.	S	Bend	trans	-63.2	-35	174.7	-71.7	-177.7	-178.3	176	0	111.9	T418 R419	K416-T418 VanDerWaalsContact C-N 3.32Å; K416-T418 PolarHBondContact O-N 2.91Å; K416-R419 WeakPolarHBondContact O-CB 3.32Å; K416-R419 WeakPolarHBondContact O-CG 3.48Å; K416-R419 PolarHBondContact O-N 2.91Å
417	L	78.6	Confident	85.3	Confident	154 Å²	154	90.5 Å²	90.5	81%	0.806	41%	0.41	S	S	*	.	G	3₁₀ helix	trans	-65.9	-31.9	-176.6	-169.8	66.8	0	0	0	112.9	R415	R415-L417 VanDerWaalsContact C-N 3.26Å; R415-L417 PolarHBondContact O-N 3.39Å
418	T	77.7	Confident	84.9	Confident	23 Å²	23	90.4 Å²	90.4	14%	0.141	41%	0.411	C	S	.	.	G	3₁₀ helix	trans	-91.4	4.2	-175.4	52.8	0	0	0	0	113.7	E407 R415 K416 L420 L421 Y422	E407-T418 PolarHBondContact OE1-OG1 3.09Å; E407-T418 WeakPolarHBondContact OE2-CB 3.43Å; E407-T418 WeakPolarHBondContact OE2-CG2 3.49Å; E407-T418 PolarHBondContact OE2-OG1 3.02Å; R415-T418 PolarHBondContact O-N 3.05Å; R415-T418 PolarHBondContact O-OG1 3.02Å; K416-T418 VanDerWaalsContact C-N 3.32Å; K416-T418 PolarHBondContact O-N 2.91Å; T418-L420 PolarHBondContact O-N 3.21Å; T418-L421 PolarHBondContact O-N 2.64Å; T418-Y422 PolarHBondContact O-N 3.21Å; T418-Y422 VanDerWaalsContact O-N 3.09Å
419	R	73.8	Confident	84.9	Confident	116 Å²	116	92.1 Å²	92.1	44%	0.438	43%	0.429	S	S	.	.	G	3₁₀ helix	trans	-61	-24.6	174	-74.4	-178.1	-179.2	-177.5	2.5	114.1	S413 K416 L421 R425	S413-R419 WeakPolarHBondContact OG-CG 3.3Å; K416-R419 WeakPolarHBondContact O-CB 3.32Å; K416-R419 WeakPolarHBondContact O-CG 3.48Å; K416-R419 PolarHBondContact O-N 2.91Å; R419-L421 VanDerWaalsContact C-N 3.27Å; R419-R425 VanDerWaalsContact NH2-NH2 3.15Å
420	L	75.7	Confident	84.8	Confident	170 Å²	170	91.3 Å²	91.3	89%	0.89	43%	0.426	S	S	*	.	G	3₁₀ helix	trans	-71.7	-24.7	175.2	-69	168.5	0	0	0	112.2	T418	T418-L420 PolarHBondContact O-N 3.21Å
421	L	79.3	Confident	84.6	Confident	136 Å²	136	94.8 Å²	94.8	71%	0.712	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.9	-37.2	179.2	-64.4	170	0	0	0	111.7	T418 R419	T418-L421 PolarHBondContact O-N 2.64Å; R419-L421 VanDerWaalsContact C-N 3.27Å
422	Y	83.9	Confident	84.5	Confident	43 Å²	43	89.8 Å²	89.8	17%	0.169	42%	0.419	C	S	.	.			trans	-125.1	118.9	-177.2	-54.1	-68.1	0	0	0	111.4	E407 N411 C412 T418	E407-Y422 HydrophobicContact CB-CD2 4.25Å; E407-Y422 HydrophobicContact CB-CE2 3.9Å; N411-Y422 HydrophobicContact CB-CD1 4.47Å; N411-Y422 WeakPolarHBondContact OD1-CD1 3.5Å; N411-Y422 WeakPolarHBondContact OD1-CE1 3.5Å; C412-Y422 VanDerWaalsContact C-CB 3.44Å; C412-Y422 WeakPolarHBondContact O-CD2 3.31Å; T418-Y422 PolarHBondContact O-N 3.21Å; T418-Y422 VanDerWaalsContact O-N 3.09Å
423	Q	79.2	Confident	84.3	Confident	206 Å²	206	92.3 Å²	92.3	96%	0.963	44%	0.435	S	S	*	.	S	Bend	trans	-70.2	-33.6	-179.9	-66.8	-179.2	-10.5	0	0	112.9
424	R	89.3	Confident	84.1	Confident	116 Å²	116	99.1 Å²	99.1	44%	0.438	46%	0.464	S	S	.	.	S	Bend	trans	-82.5	134.8	-177.2	-171.8	176.3	75.2	90.2	-6	110.5	F410 C412 S413 E430	F410-R424 PolarHBondContact O-NH2 2.84Å; C412-R424 CarbonylContact C-O 3.55Å; C412-R424 WeakPolarHBondContact CA-O 3.28Å; C412-R424 HydrophobicContact CB-CB 4.23Å; C412-R424 HydrophobicContact CB-CG 4.38Å; C412-R424 VanDerWaalsContact CB-O 3.22Å; C412-R424 WeakPolarHBondContact CB-O 3.39Å; S413-R424 PolarHBondContact N-O 3.35Å; R424-E430 IonicContact NH1-OE1 2.63Å
425	R	88.9	Confident	83.9	Confident	168 Å²	168	97.8 Å²	97.8	63%	0.634	48%	0.476	S	S	*	.	B	Isolated β-bridge	trans	-80.6	136.9	171	-166.1	-174.5	-69.2	178.7	2.2	110.8	S413 R419	S413-R425 WeakPolarHBondContact O-CA 3.26Å; R419-R425 VanDerWaalsContact NH2-NH2 3.15Å
426	C	88.8	Confident	84	Confident	12 Å²	12	95.6 Å²	95.6	8%	0.081	47%	0.468	C	S	.	.	P	Polyproline II helix	trans	-73.1	146.1	172.8	-55.1	0	0	0	0	111.3	C412 S413 Y414 E430	C412-C426 HydrophobicContact CB-CB 4.04Å; C412-C426 WeakPolarHBondContact CB-SG 3.46Å; C412-C426 PolarHBondContact O-SG 3.28Å; C412-C426 WeakPolarHBondContact SG-CA 3.39Å; C412-C426 WeakPolarHBondContact SG-CB 3.43Å; C412-C426 CovalentContact SG-SG 2.03Å; C412-C426 PolarHBondContact SG-SG 3.02Å; S413-C426 VanDerWaalsContact C-SG 3.54Å; S413-C426 PolarHBondContact O-N 2.87Å; Y414-C426 HydrophobicContact CD2-CB 4.03Å; C426-E430 WeakPolarHBondContact CA-OE1 3.45Å
427	K	88.7	Confident	84.2	Confident	174 Å²	174	91.6 Å²	91.6	76%	0.757	45%	0.451	S	S	*	.			trans	-83.6	-24.6	173.4	-68.1	-175.8	179.7	-178.7	0	112.7	S429 E430	K427-S429 PolarHBondContact O-N 3.02Å; K427-E430 PolarHBondContact N-OE1 3.47Å; K427-E430 PolarHBondContact N-OE2 2.76Å
428	G	85.2	Confident	84.5	Confident	4 Å²	4	87.5 Å²	87.5	4%	0.041	43%	0.433	C	S	.	.	S	Bend	trans	85.7	-13.2	-173.4	0	0	0	0	0	113.6	E430	G428-E430 PolarHBondContact N-OE2 3.35Å
429	S	88.1	Confident	85	Confident	93 Å²	93	86.7 Å²	86.7	65%	0.65	43%	0.428	S	S	*	.			trans	-113.8	18.6	176.4	57.4	0	0	0	0	112.9	K427	K427-S429 PolarHBondContact O-N 3.02Å
430	E	88.8	Confident	85.5	Confident	26 Å²	26	82.7 Å²	82.7	12%	0.121	42%	0.417	C	S	.	.			trans	-53.6	147.7	168.7	-71.2	87.5	175.4	0	0	112.4	W406 F410 R424 C426 K427 G428 V432	W406-E430 HydrophobicContact CH2-CB 4.4Å; W406-E430 WeakPolarHBondContact CH2-O 3.42Å; W406-E430 HydrophobicContact CZ2-CB 3.57Å; W406-E430 WeakPolarHBondContact CZ2-O 3.25Å; W406-E430 PolarHBondContact NE1-OE2 3.21Å; F410-E430 HydrophobicContact CB-CG 4.33Å; F410-E430 HydrophobicContact CD1-CB 3.82Å; F410-E430 HydrophobicContact CD1-CG 4.08Å; F410-E430 HydrophobicContact CD2-CB 3.64Å; F410-E430 HydrophobicContact CD2-CG 4.07Å; F410-E430 HydrophobicContact CE1-CB 3.68Å; F410-E430 HydrophobicContact CE1-CG 4.42Å; F410-E430 HydrophobicContact CE2-CB 3.49Å; F410-E430 VanDerWaalsContact CE2-CB 3.49Å; F410-E430 HydrophobicContact CE2-CG 4.41Å; F410-E430 HydrophobicContact CG-CB 3.81Å; F410-E430 HydrophobicContact CG-CG 3.9Å; F410-E430 HydrophobicContact CZ-CB 3.5Å; R424-E430 IonicContact NH1-OE1 2.63Å; C426-E430 WeakPolarHBondContact CA-OE1 3.45Å; K427-E430 PolarHBondContact N-OE1 3.47Å; K427-E430 PolarHBondContact N-OE2 2.76Å; G428-E430 PolarHBondContact N-OE2 3.35Å; E430-V432 PolarHBondContact O-N 2.91Å; E430-V432 VanDerWaalsContact O-N 3.1Å
431	N	87.4	Confident	86.1	Confident	97 Å²	97	75.7 Å²	75.7	52%	0.519	38%	0.379	S	S	.	.			trans	-79.2	100	-174.4	-174.8	2.8	0	0	0	111.1	F410 T433 F434	F410-N431 WeakPolarHBondContact CE1-O 3.39Å; F410-N431 WeakPolarHBondContact CZ-O 3.5Å; N431-T433 PolarHBondContact ND2-OG1 3.26Å; N431-T433 PolarHBondContact O-N 3.26Å; N431-T433 VanDerWaalsContact O-N 3.12Å; N431-T433 WeakPolarHBondContact OD1-CB 3.09Å; N431-T433 WeakPolarHBondContact OD1-CG2 3.15Å; N431-T433 PolarHBondContact OD1-N 3.03Å; N431-T433 VanDerWaalsContact OD1-N 3.13Å; N431-T433 PolarHBondContact OD1-OG1 2.89Å; N431-F434 WeakPolarHBondContact O-CB 3.43Å; N431-F434 PolarHBondContact O-N 2.91Å
432	V	88	Confident	86.7	Confident	4 Å²	4	69.6 Å²	69.6	2%	0.024	35%	0.348	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-21.5	178.9	71.9	0	0	0	0	113.5	Y388 F389 F405 W406 K409 E430 F434	Y388-V432 HydrophobicContact CD1-CG2 4.49Å; Y388-V432 HydrophobicContact CE1-CG2 3.9Å; F389-V432 HydrophobicContact CB-CG1 4.33Å; F389-V432 HydrophobicContact CD1-CG1 4.15Å; F405-V432 HydrophobicContact CE1-CG2 4.25Å; F405-V432 HydrophobicContact CZ-CG2 4.36Å; W406-V432 HydrophobicContact CH2-CB 4.38Å; W406-V432 HydrophobicContact CZ3-CB 3.99Å; W406-V432 HydrophobicContact CZ3-CG2 4.21Å; K409-V432 PolarHBondContact NZ-O 2.96Å; E430-V432 PolarHBondContact O-N 2.91Å; E430-V432 VanDerWaalsContact O-N 3.1Å; V432-F434 PolarHBondContact O-N 2.87Å
433	T	88.2	Confident	87.1	Confident	54 Å²	54	67.8 Å²	67.8	33%	0.331	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-17.8	174.5	70.7	0	0	0	0	112.8	F389 N431 G435 Y436	F389-T433 HydrophobicContact CB-CG2 4.21Å; F389-T433 HydrophobicContact CD1-CG2 3.69Å; F389-T433 HydrophobicContact CD2-CG2 3.72Å; F389-T433 HydrophobicContact CE1-CG2 3.94Å; F389-T433 HydrophobicContact CE2-CG2 3.96Å; F389-T433 HydrophobicContact CG-CG2 3.59Å; F389-T433 HydrophobicContact CZ-CG2 4.07Å; N431-T433 PolarHBondContact ND2-OG1 3.26Å; N431-T433 PolarHBondContact O-N 3.26Å; N431-T433 VanDerWaalsContact O-N 3.12Å; N431-T433 WeakPolarHBondContact OD1-CB 3.09Å; N431-T433 WeakPolarHBondContact OD1-CG2 3.15Å; N431-T433 PolarHBondContact OD1-N 3.03Å; N431-T433 VanDerWaalsContact OD1-N 3.13Å; N431-T433 PolarHBondContact OD1-OG1 2.89Å; T433-G435 PolarHBondContact O-N 3.01Å; T433-G435 VanDerWaalsContact O-N 3.11Å; T433-Y436 VanDerWaalsContact O-CB 3.31Å; T433-Y436 WeakPolarHBondContact O-CB 3.29Å; T433-Y436 PolarHBondContact O-N 2.9Å
434	F	85.9	Confident	87.8	Confident	146 Å²	146	58.3 Å²	58.3	64%	0.64	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	117	179.7	-178	-101.3	0	0	0	110.9	K409 F410 N431 V432 Y436	K409-F434 WeakPolarHBondContact CE-O 3.41Å; K409-F434 PolarHBondContact NZ-O 2.82Å; F410-F434 HydrophobicContact CE1-CB 4.35Å; N431-F434 WeakPolarHBondContact O-CB 3.43Å; N431-F434 PolarHBondContact O-N 2.91Å; V432-F434 PolarHBondContact O-N 2.87Å; F434-Y436 PolarHBondContact O-N 2.75Å
435	G	82	Confident	88.1	Confident	56 Å²	56	52.8 Å²	52.8	58%	0.577	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.8	9.4	-178.9	0	0	0	0	0	114.9	T433 K437	T433-G435 PolarHBondContact O-N 3.01Å; T433-G435 VanDerWaalsContact O-N 3.11Å; G435-K437 PolarHBondContact O-N 3.07Å
436	Y	86.8	Confident	88.4	Confident	34 Å²	34	45.1 Å²	45.1	13%	0.133	25%	0.248	C	C	.	.			trans	-58.9	134.6	179.8	174.8	-102.9	0	0	0	111.4	Q82 E385 Y388 F389 T433 F434 P438	Q82-Y436 HydrophobicContact CG-CE2 4.48Å; E385-Y436 HydrophobicContact CG-CE1 4.17Å; Y388-Y436 AromaticContact CD1-CD2 3.84Å; Y388-Y436 HydrophobicContact CD1-CD2 3.84Å; Y388-Y436 AromaticContact CD1-CE2 3.55Å; Y388-Y436 HydrophobicContact CD1-CE2 3.55Å; Y388-Y436 AromaticContact CE1-CD2 3.6Å; Y388-Y436 HydrophobicContact CE1-CD2 3.6Å; Y388-Y436 AromaticContact CE1-CE2 3.63Å; Y388-Y436 HydrophobicContact CE1-CE2 3.63Å; Y388-Y436 HydrophobicContact CG-CE2 4.42Å; F389-Y436 AromaticContact CE1-CD1 3.61Å; F389-Y436 HydrophobicContact CE1-CD1 3.61Å; F389-Y436 AromaticContact CE1-CD2 3.82Å; F389-Y436 HydrophobicContact CE1-CD2 3.82Å; F389-Y436 AromaticContact CE1-CE1 3.83Å; F389-Y436 HydrophobicContact CE1-CE1 3.83Å; F389-Y436 HydrophobicContact CE1-CE2 4.02Å; F389-Y436 AromaticContact CE1-CG 3.59Å; F389-Y436 HydrophobicContact CE1-CG 3.59Å; F389-Y436 AromaticContact CZ-CD1 3.5Å; F389-Y436 HydrophobicContact CZ-CD1 3.5Å; F389-Y436 AromaticContact CZ-CE1 3.65Å; F389-Y436 HydrophobicContact CZ-CE1 3.65Å; F389-Y436 AromaticContact CZ-CG 3.98Å; F389-Y436 HydrophobicContact CZ-CG 3.98Å; T433-Y436 VanDerWaalsContact O-CB 3.31Å; T433-Y436 WeakPolarHBondContact O-CB 3.29Å; T433-Y436 PolarHBondContact O-N 2.9Å; F434-Y436 PolarHBondContact O-N 2.75Å; Y436-P438 HydrophobicContact CE1-CB 4.22Å
437	K	83.5	Confident	88.7	Confident	92 Å²	92	45.3 Å²	45.3	40%	0.4	25%	0.249	S	C	.	.			trans	-136.7	121.6	172.8	-65	176	-173.5	169.8	0	107.3	Q78 Q82 G435	Q78-K437 WeakPolarHBondContact CG-O 3.08Å; Q78-K437 PolarHBondContact NE2-O 2.8Å; Q82-K437 PolarHBondContact NE2-O 3.42Å; G435-K437 PolarHBondContact O-N 3.07Å
438	P	86.1	Confident	89	Confident	68 Å²	68	37 Å²	37	44%	0.442	21%	0.213	S	C	.	.			trans	-64.9	143	179.4	26.7	-33.6	0	0	0	110.5	Q78 Y436 P440	Q78-P438 PolarHBondContact NE2-O 3.33Å; Y436-P438 HydrophobicContact CE1-CB 4.22Å; P438-P440 WeakPolarHBondContact O-CD 3.18Å
439	D	87.2	Confident	89.6	Confident	5 Å²	5	36.9 Å²	36.9	3%	0.027	21%	0.211	C	C	.	.			trans	-71.2	121	166.3	173.3	16	0	0	0	109.1	Q78 Y79 R83 K441 L442	Q78-D439 HydrophobicContact CB-CB 4.27Å; Q78-D439 WeakPolarHBondContact O-CB 3.39Å; Y79-D439 HydrophobicContact CD1-CB 4.49Å; Y79-D439 WeakPolarHBondContact CE1-OD1 3.05Å; R83-D439 IonicContact CZ-OD2 2.82Å; R83-D439 IonicContact NE-OD2 3.86Å; R83-D439 PolarHBondContact NE-OD2 2.79Å; R83-D439 IonicContact NH2-OD1 3.72Å; R83-D439 IonicContact NH2-OD2 2.58Å; R83-D439 PolarHBondContact NH2-OD2 3.1Å; R83-D439 VanDerWaalsContact NH2-OD2 3.12Å; D439-K441 PolarHBondContact O-N 3.44Å; D439-K441 WeakPolarHBondContact OD1-CB 3.36Å; D439-K441 PolarHBondContact OD1-N 3.28Å; D439-L442 HydrophobicContact CB-CD1 4.33Å; D439-L442 HydrophobicContact CB-CD2 4.02Å; D439-L442 HydrophobicContact CB-CG 3.8Å; D439-L442 WeakPolarHBondContact O-CG 3.29Å; D439-L442 PolarHBondContact O-N 2.95Å
440	P	84.3	Confident	90	Very high	33 Å²	33	34.7 Å²	34.7	21%	0.214	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-7.7	177.7	28.1	-36.4	0	0	0	113.1	S378 P438	S378-P440 WeakPolarHBondContact CB-O 3.44Å; S378-P440 PolarHBondContact OG-O 2.86Å; P438-P440 WeakPolarHBondContact O-CD 3.18Å
441	K	88.7	Confident	90.3	Very high	22 Å²	22	33.5 Å²	33.5	10%	0.096	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.6	10	-176.9	-63.6	-168.3	172.9	163.8	0	114.7	S195 D439 S443 Q444 V445	S195-K441 PolarHBondContact OG-NZ 2.91Å; D439-K441 PolarHBondContact O-N 3.44Å; D439-K441 WeakPolarHBondContact OD1-CB 3.36Å; D439-K441 PolarHBondContact OD1-N 3.28Å; K441-S443 VanDerWaalsContact C-N 3.31Å; K441-S443 PolarHBondContact O-N 2.85Å; K441-Q444 VanDerWaalsContact CA-OE1 3.3Å; K441-Q444 WeakPolarHBondContact O-CB 3.44Å; K441-Q444 PolarHBondContact O-N 3.09Å; K441-Q444 VanDerWaalsContact O-N 3.1Å; K441-V445 PolarHBondContact O-N 3.11Å
442	L	91.7	Very high	90.8	Very high	9 Å²	9	28.9 Å²	28.9	5%	0.047	16%	0.158	C	C	.	.	H	α-helix	trans	-59.1	-39.6	-177.4	-69.2	170	0	0	0	113.2	Q82 R83 I86 V381 F384 D439 Q444 V445 V446	Q82-L442 HydrophobicContact CB-CD2 4.03Å; R83-L442 HydrophobicContact CG-CD2 4.43Å; I86-L442 HydrophobicContact CB-CD2 4.25Å; I86-L442 HydrophobicContact CG2-CD2 3.69Å; V381-L442 HydrophobicContact CG2-CB 4Å; F384-L442 HydrophobicContact CD1-CD1 3.57Å; F384-L442 HydrophobicContact CE1-CD1 3.48Å; F384-L442 VanDerWaalsContact CE1-CD1 3.48Å; F384-L442 HydrophobicContact CE1-CD2 4.39Å; F384-L442 HydrophobicContact CG-CD1 4.46Å; F384-L442 HydrophobicContact CZ-CD1 4.32Å; D439-L442 HydrophobicContact CB-CD1 4.33Å; D439-L442 HydrophobicContact CB-CD2 4.02Å; D439-L442 HydrophobicContact CB-CG 3.8Å; D439-L442 WeakPolarHBondContact O-CG 3.29Å; D439-L442 PolarHBondContact O-N 2.95Å; L442-Q444 PolarHBondContact O-N 3.22Å; L442-V445 WeakPolarHBondContact O-CB 3.45Å; L442-V445 PolarHBondContact O-N 3.16Å; L442-V446 PolarHBondContact O-N 3.07Å
443	S	92.6	Very high	91.1	Very high	4 Å²	4	28.7 Å²	28.7	3%	0.028	16%	0.157	C	C	.	.	H	α-helix	trans	-62.7	-32	178.6	62.4	0	0	0	0	112.5	S378 P379 K441 V445 V446 T447	S378-S443 PolarHBondContact OG-OG 3.48Å; P379-S443 WeakPolarHBondContact CD-OG 3.46Å; P379-S443 VanDerWaalsContact O-CB 3.29Å; P379-S443 WeakPolarHBondContact O-CB 3.41Å; K441-S443 VanDerWaalsContact C-N 3.31Å; K441-S443 PolarHBondContact O-N 2.85Å; S443-V445 VanDerWaalsContact C-N 3.35Å; S443-V446 WeakPolarHBondContact O-CB 3.31Å; S443-V446 PolarHBondContact O-N 3.28Å; S443-T447 PolarHBondContact O-N 2.85Å; S443-T447 PolarHBondContact O-OG1 3.11Å
444	Q	93.5	Very high	91.5	Very high	7 Å²	7	29.6 Å²	29.6	3%	0.033	16%	0.155	C	C	.	.	H	α-helix	trans	-69.8	-34.1	177.7	-66.5	132.6	22	0	0	111.6	V213 V214 Y377 K441 L442 T447 S448	V213-Q444 HydrophobicContact CG2-CB 4.14Å; V213-Q444 WeakPolarHBondContact CG2-O 3.43Å; V214-Q444 HydrophobicContact CG1-CB 4.32Å; V214-Q444 HydrophobicContact CG1-CG 3.8Å; Y377-Q444 PolarHBondContact O-NE2 3.42Å; K441-Q444 VanDerWaalsContact CA-OE1 3.3Å; K441-Q444 WeakPolarHBondContact O-CB 3.44Å; K441-Q444 PolarHBondContact O-N 3.09Å; K441-Q444 VanDerWaalsContact O-N 3.1Å; L442-Q444 PolarHBondContact O-N 3.22Å; Q444-T447 PolarHBondContact O-N 3.42Å; Q444-S448 WeakPolarHBondContact O-CB 3.16Å; Q444-S448 PolarHBondContact O-N 2.94Å; Q444-S448 PolarHBondContact O-OG 3.06Å
445	V	95.4	Very high	92	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-62.2	-47.1	170.8	179.8	0	0	0	0	109.8	F60 R83 I86 A87 Y194 K441 L442 S443 T447 S448 I449	F60-V445 HydrophobicContact CE1-CG1 4.26Å; F60-V445 HydrophobicContact CE1-CG2 4.37Å; F60-V445 HydrophobicContact CZ-CG1 3.69Å; R83-V445 HydrophobicContact CG-CG2 4.14Å; I86-V445 HydrophobicContact CG2-CB 4.24Å; I86-V445 HydrophobicContact CG2-CG1 4.05Å; A87-V445 HydrophobicContact CB-CG1 4.09Å; Y194-V445 HydrophobicContact CG-CG2 4.4Å; K441-V445 PolarHBondContact O-N 3.11Å; L442-V445 WeakPolarHBondContact O-CB 3.45Å; L442-V445 PolarHBondContact O-N 3.16Å; S443-V445 VanDerWaalsContact C-N 3.35Å; V445-T447 PolarHBondContact O-N 3.48Å; V445-S448 PolarHBondContact O-N 2.82Å; V445-S448 PolarHBondContact O-OG 3Å; V445-I449 HydrophobicContact CG1-CD1 4.25Å; V445-I449 WeakPolarHBondContact O-CG1 3.43Å; V445-I449 PolarHBondContact O-N 2.84Å
446	V	95.4	Very high	92.6	Very high	7 Å²	7	20 Å²	20	4%	0.042	10%	0.097	C	C	.	.	H	α-helix	trans	-57.7	-51.5	176.3	177.6	0	0	0	0	111	I86 T90 V381 L442 S443 S448 I449 Y450 L496	I86-V446 HydrophobicContact CD1-CG2 3.88Å; I86-V446 HydrophobicContact CG1-CG2 3.47Å; I86-V446 VanDerWaalsContact CG1-CG2 3.47Å; T90-V446 HydrophobicContact CG2-CG1 4.15Å; V381-V446 HydrophobicContact CG2-CG2 4.43Å; L442-V446 PolarHBondContact O-N 3.07Å; S443-V446 WeakPolarHBondContact O-CB 3.31Å; S443-V446 PolarHBondContact O-N 3.28Å; V446-S448 VanDerWaalsContact C-N 3.28Å; V446-S448 PolarHBondContact O-N 2.98Å; V446-I449 PolarHBondContact O-N 3.44Å; V446-I449 VanDerWaalsContact O-N 3.16Å; V446-Y450 HydrophobicContact CG1-CD2 3.54Å; V446-Y450 HydrophobicContact CG1-CE2 3.53Å; V446-Y450 WeakPolarHBondContact O-CD2 3Å; V446-Y450 PolarHBondContact O-N 3.49Å; V446-L496 HydrophobicContact CG1-CD1 4.27Å
447	T	94.8	Very high	93	Very high	16 Å²	16	18.8 Å²	18.8	10%	0.098	9%	0.093	C	C	.	.	H	α-helix	trans	-58.7	-38	178.5	-55.6	0	0	0	0	112.1	V213 S443 Q444 V445 Y450 T451 F493 I501	V213-T447 HydrophobicContact CB-CG2 3.96Å; V213-T447 HydrophobicContact CG1-CG2 3.9Å; S443-T447 PolarHBondContact O-N 2.85Å; S443-T447 PolarHBondContact O-OG1 3.11Å; Q444-T447 PolarHBondContact O-N 3.42Å; V445-T447 PolarHBondContact O-N 3.48Å; T447-Y450 PolarHBondContact O-N 3.06Å; T447-T451 WeakPolarHBondContact O-CB 3.45Å; T447-T451 PolarHBondContact O-N 3.18Å; T447-T451 PolarHBondContact O-OG1 2.97Å; T447-F493 HydrophobicContact CG2-CE2 4.16Å; T447-F493 HydrophobicContact CG2-CZ 3.72Å; T447-I501 HydrophobicContact CG2-CG1 4.27Å; T447-I501 HydrophobicContact CG2-CG2 4.14Å
448	S	96.3	Very high	93.5	Very high	0 Å²	0	16.8 Å²	16.8	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-64.6	-39.7	177.7	69.3	0	0	0	0	112.8	I169 Q444 V445 V446 T451 V452	I169-S448 VanDerWaalsContact CG2-OG 3.28Å; I169-S448 WeakPolarHBondContact CG2-OG 3.32Å; Q444-S448 WeakPolarHBondContact O-CB 3.16Å; Q444-S448 PolarHBondContact O-N 2.94Å; Q444-S448 PolarHBondContact O-OG 3.06Å; V445-S448 PolarHBondContact O-N 2.82Å; V445-S448 PolarHBondContact O-OG 3Å; V446-S448 VanDerWaalsContact C-N 3.28Å; V446-S448 PolarHBondContact O-N 2.98Å; S448-T451 PolarHBondContact O-N 3.36Å; S448-V452 PolarHBondContact O-N 3.14Å
449	I	97	Very high	93.8	Very high	1 Å²	1	13.7 Å²	13.7	1%	0.005	7%	0.07	C	C	.	.	H	α-helix	trans	-70.4	-45.2	177.4	-62	167.6	0	0	0	110.3	A87 T90 V91 I94 I108 I169 V445 V446 T451 V452 A453	A87-I449 VanDerWaalsContact CA-CD1 3.5Å; A87-I449 HydrophobicContact CB-CD1 3.71Å; T90-I449 HydrophobicContact CG2-CB 4Å; T90-I449 HydrophobicContact CG2-CD1 4.16Å; T90-I449 HydrophobicContact CG2-CG2 3.89Å; V91-I449 HydrophobicContact CG2-CG2 4.03Å; I94-I449 HydrophobicContact CD1-CG2 3.61Å; I108-I449 HydrophobicContact CD1-CD1 4.41Å; I169-I449 HydrophobicContact CD1-CB 4.25Å; I169-I449 HydrophobicContact CD1-CG1 3.51Å; V445-I449 HydrophobicContact CG1-CD1 4.25Å; V445-I449 WeakPolarHBondContact O-CG1 3.43Å; V445-I449 PolarHBondContact O-N 2.84Å; V446-I449 PolarHBondContact O-N 3.44Å; V446-I449 VanDerWaalsContact O-N 3.16Å; I449-T451 VanDerWaalsContact C-N 3.29Å; I449-T451 PolarHBondContact O-N 3.48Å; I449-V452 PolarHBondContact O-N 2.78Å; I449-A453 PolarHBondContact O-N 3.47Å
450	Y	96.1	Very high	94	Very high	48 Å²	48	13.5 Å²	13.5	19%	0.188	7%	0.07	C	C	.	.	H	α-helix	trans	-62.1	-35.5	176	-85.9	-72.3	0	0	0	112.8	T90 I94 I100 V446 T447 V452 A453 Y454	T90-Y450 HydrophobicContact CG2-CD2 4.08Å; T90-Y450 HydrophobicContact CG2-CE2 3.79Å; I94-Y450 HydrophobicContact CD1-CD1 4.27Å; I94-Y450 HydrophobicContact CD1-CE1 4.24Å; I94-Y450 HydrophobicContact CG1-CD1 4.24Å; I94-Y450 HydrophobicContact CG1-CE1 3.77Å; I100-Y450 HydrophobicContact CD1-CD1 4.37Å; I100-Y450 HydrophobicContact CD1-CE1 4.09Å; V446-Y450 HydrophobicContact CG1-CD2 3.54Å; V446-Y450 HydrophobicContact CG1-CE2 3.53Å; V446-Y450 WeakPolarHBondContact O-CD2 3Å; V446-Y450 PolarHBondContact O-N 3.49Å; T447-Y450 PolarHBondContact O-N 3.06Å; Y450-V452 VanDerWaalsContact C-N 3.32Å; Y450-V452 PolarHBondContact O-N 2.9Å; Y450-A453 PolarHBondContact O-N 3.35Å; Y450-Y454 HydrophobicContact CD1-CD2 4.34Å; Y450-Y454 AromaticContact CD1-CE2 3.75Å; Y450-Y454 HydrophobicContact CD1-CE2 3.75Å; Y450-Y454 HydrophobicContact CG-CE2 4.33Å; Y450-Y454 WeakPolarHBondContact O-CB 3.48Å; Y450-Y454 WeakPolarHBondContact O-CD2 3.5Å; Y450-Y454 PolarHBondContact O-N 3.11Å
451	T	96	Very high	94.3	Very high	0 Å²	0	16.7 Å²	16.7	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-59	-45.6	175.4	-59.3	0	0	0	0	110.9	M211 T447 S448 I449 A455 F503	M211-T451 HydrophobicContact CE-CG2 3.78Å; M211-T451 HydrophobicContact SD-CG2 4.45Å; T447-T451 WeakPolarHBondContact O-CB 3.45Å; T447-T451 PolarHBondContact O-N 3.18Å; T447-T451 PolarHBondContact O-OG1 2.97Å; S448-T451 PolarHBondContact O-N 3.36Å; I449-T451 VanDerWaalsContact C-N 3.29Å; I449-T451 PolarHBondContact O-N 3.48Å; T451-A455 VanDerWaalsContact O-CB 3.29Å; T451-A455 WeakPolarHBondContact O-CB 3.42Å; T451-A455 PolarHBondContact O-N 2.97Å; T451-A455 VanDerWaalsContact O-N 3.14Å; T451-F503 HydrophobicContact CG2-CE2 3.76Å; T451-F503 HydrophobicContact CG2-CZ 3.85Å
452	V	96.6	Very high	94.4	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-66.3	-45	175.9	179.7	0	0	0	0	110.7	I56 A167 I169 V192 S448 I449 Y450 A455 L456 M488	I56-V452 HydrophobicContact CD1-CB 3.99Å; I56-V452 HydrophobicContact CD1-CG1 3.63Å; I56-V452 HydrophobicContact CG1-CG1 4.08Å; A167-V452 HydrophobicContact CB-CG1 4.02Å; A167-V452 HydrophobicContact CB-CG2 4.1Å; I169-V452 HydrophobicContact CD1-CG2 4.44Å; V192-V452 HydrophobicContact CG2-CG2 3.91Å; S448-V452 PolarHBondContact O-N 3.14Å; I449-V452 PolarHBondContact O-N 2.78Å; Y450-V452 VanDerWaalsContact C-N 3.32Å; Y450-V452 PolarHBondContact O-N 2.9Å; V452-A455 PolarHBondContact O-N 2.82Å; V452-L456 HydrophobicContact CG1-CD1 3.8Å; V452-L456 HydrophobicContact CG1-CG 4.23Å; V452-L456 WeakPolarHBondContact O-CB 3.28Å; V452-L456 VanDerWaalsContact O-CG 3.29Å; V452-L456 WeakPolarHBondContact O-CG 3.23Å; V452-L456 PolarHBondContact O-N 3Å; V452-M488 HydrophobicContact CG2-CE 4.18Å
453	A	96.1	Very high	94.3	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-62.6	-45.9	-178.3	0	0	0	0	0	113	I94 I100 L106 I449 Y450 L456 D457	I94-A453 HydrophobicContact CD1-CB 3.85Å; I94-A453 HydrophobicContact CG2-CB 4.23Å; I100-A453 HydrophobicContact CG2-CB 4.17Å; L106-A453 HydrophobicContact CD2-CB 4.32Å; I449-A453 PolarHBondContact O-N 3.47Å; Y450-A453 PolarHBondContact O-N 3.35Å; A453-L456 PolarHBondContact O-N 3.21Å; A453-D457 VanDerWaalsContact O-CB 3.31Å; A453-D457 WeakPolarHBondContact O-CB 3.48Å; A453-D457 PolarHBondContact O-N 3.49Å
454	Y	96.1	Very high	94.1	Very high	73 Å²	73	22.2 Å²	22.2	29%	0.286	11%	0.112	S	C	.	.	H	α-helix	trans	-67.5	-35.3	176.6	-77.2	-58.3	0	0	0	112.8	I100 Y450 D457 S458 F493	I100-Y454 HydrophobicContact CD1-CD1 4.42Å; I100-Y454 HydrophobicContact CD1-CE1 3.72Å; I100-Y454 HydrophobicContact CG1-CE1 4Å; Y450-Y454 HydrophobicContact CD1-CD2 4.34Å; Y450-Y454 AromaticContact CD1-CE2 3.75Å; Y450-Y454 HydrophobicContact CD1-CE2 3.75Å; Y450-Y454 HydrophobicContact CG-CE2 4.33Å; Y450-Y454 WeakPolarHBondContact O-CB 3.48Å; Y450-Y454 WeakPolarHBondContact O-CD2 3.5Å; Y450-Y454 PolarHBondContact O-N 3.11Å; Y454-D457 PolarHBondContact O-N 3.07Å; Y454-S458 WeakPolarHBondContact O-CB 3.29Å; Y454-S458 PolarHBondContact O-N 2.97Å; Y454-S458 PolarHBondContact O-OG 3.19Å; Y454-F493 HydrophobicContact CD2-CB 4.06Å; Y454-F493 AromaticContact CD2-CD1 3.88Å; Y454-F493 HydrophobicContact CD2-CD1 3.88Å; Y454-F493 HydrophobicContact CD2-CD2 4.19Å; Y454-F493 HydrophobicContact CD2-CE1 4.35Å; Y454-F493 AromaticContact CD2-CG 3.79Å; Y454-F493 HydrophobicContact CD2-CG 3.79Å; Y454-F493 HydrophobicContact CE2-CB 3.87Å; Y454-F493 HydrophobicContact CE2-CD1 4.35Å; Y454-F493 AromaticContact CE2-CD2 3.86Å; Y454-F493 HydrophobicContact CE2-CD2 3.86Å; Y454-F493 HydrophobicContact CE2-CE2 4.49Å; Y454-F493 AromaticContact CE2-CG 3.78Å; Y454-F493 HydrophobicContact CE2-CG 3.78Å
455	A	96.1	Very high	93.6	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-66.2	-44.4	174.5	0	0	0	0	0	111.4	T451 V452 S458 M459 L484 M488 T491	T451-A455 VanDerWaalsContact O-CB 3.29Å; T451-A455 WeakPolarHBondContact O-CB 3.42Å; T451-A455 PolarHBondContact O-N 2.97Å; T451-A455 VanDerWaalsContact O-N 3.14Å; V452-A455 PolarHBondContact O-N 2.82Å; A455-S458 PolarHBondContact O-N 3.22Å; A455-M459 WeakPolarHBondContact O-CB 3.41Å; A455-M459 PolarHBondContact O-N 3.33Å; A455-L484 HydrophobicContact CB-CD1 4.08Å; A455-M488 HydrophobicContact CB-CB 4.12Å; A455-M488 HydrophobicContact CB-CG 3.37Å; A455-T491 HydrophobicContact CB-CG2 3.76Å
456	L	94.8	Very high	92.8	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-62.8	-43	174.6	-74	171.6	0	0	0	111.5	L54 L101 L106 V166 V452 A453 M459 Y460 M476 L484	L54-L456 HydrophobicContact CD1-CD1 4.28Å; L54-L456 HydrophobicContact CD1-CD2 4.19Å; L101-L456 HydrophobicContact CD1-CB 4.09Å; L101-L456 HydrophobicContact CD1-CD1 4.46Å; L101-L456 HydrophobicContact CD2-CB 4.15Å; L106-L456 HydrophobicContact CD1-CD1 3.91Å; V166-L456 HydrophobicContact CG2-CD1 4.03Å; V166-L456 HydrophobicContact CG2-CD2 4.36Å; V452-L456 HydrophobicContact CG1-CD1 3.8Å; V452-L456 HydrophobicContact CG1-CG 4.23Å; V452-L456 WeakPolarHBondContact O-CB 3.28Å; V452-L456 VanDerWaalsContact O-CG 3.29Å; V452-L456 WeakPolarHBondContact O-CG 3.23Å; V452-L456 PolarHBondContact O-N 3Å; A453-L456 PolarHBondContact O-N 3.21Å; L456-M459 PolarHBondContact O-N 3.02Å; L456-Y460 WeakPolarHBondContact O-CB 3.48Å; L456-Y460 PolarHBondContact O-N 3.49Å; L456-M476 HydrophobicContact CD2-CE 4.2Å; L456-L484 HydrophobicContact CD2-CD1 3.68Å; L456-L484 HydrophobicContact CD2-CD2 4.08Å; L456-L484 HydrophobicContact CG-CD1 4.05Å
457	D	94	Very high	92	Very high	9 Å²	9	35.2 Å²	35.2	5%	0.048	20%	0.2	C	C	.	.	H	α-helix	trans	-62.8	-42.7	177.2	178.5	72.1	0	0	0	112	I100 L101 A453 Y454 Y460 K461	I100-D457 HydrophobicContact CG2-CB 4.1Å; L101-D457 HydrophobicContact CD2-CB 4.28Å; L101-D457 HydrophobicContact CG-CB 4.19Å; L101-D457 PolarHBondContact N-OD1 2.94Å; A453-D457 VanDerWaalsContact O-CB 3.31Å; A453-D457 WeakPolarHBondContact O-CB 3.48Å; A453-D457 PolarHBondContact O-N 3.49Å; Y454-D457 PolarHBondContact O-N 3.07Å; D457-Y460 PolarHBondContact O-N 2.69Å; D457-K461 WeakPolarHBondContact O-CB 3.44Å; D457-K461 VanDerWaalsContact O-CG 3.3Å; D457-K461 WeakPolarHBondContact O-CG 3.49Å; D457-K461 PolarHBondContact O-N 3.42Å; D457-K461 VanDerWaalsContact OD1-CE 3.25Å; D457-K461 WeakPolarHBondContact OD1-CE 3.29Å; D457-K461 IonicContact OD1-NZ 3.1Å; D457-K461 PolarHBondContact OD1-NZ 3.01Å; D457-K461 VanDerWaalsContact OD2-CE 3.22Å; D457-K461 WeakPolarHBondContact OD2-CE 3.29Å; D457-K461 IonicContact OD2-NZ 3.28Å; D457-K461 PolarHBondContact OD2-NZ 3.31Å
458	S	94	Very high	91	Very high	51 Å²	51	37.4 Å²	37.4	36%	0.357	21%	0.21	S	C	.	.	H	α-helix	trans	-63	-44.7	174.8	-59.7	0	0	0	0	111.5	Y454 A455 K461 D462	Y454-S458 WeakPolarHBondContact O-CB 3.29Å; Y454-S458 PolarHBondContact O-N 2.97Å; Y454-S458 PolarHBondContact O-OG 3.19Å; A455-S458 PolarHBondContact O-N 3.22Å; S458-K461 PolarHBondContact O-N 2.97Å; S458-D462 WeakPolarHBondContact O-CB 3.15Å; S458-D462 PolarHBondContact O-N 3.4Å; S458-D462 VanDerWaalsContact O-N 3.1Å
459	M	93.4	Very high	89.9	Confident	2 Å²	2	41.6 Å²	41.6	1%	0.01	25%	0.245	C	C	.	.	H	α-helix	trans	-64.5	-41.1	175.7	-176.7	174.4	175.8	0	0	111.8	A455 L456 D462 V463 V479 K483 L484 Y487	A455-M459 WeakPolarHBondContact O-CB 3.41Å; A455-M459 PolarHBondContact O-N 3.33Å; L456-M459 PolarHBondContact O-N 3.02Å; M459-D462 PolarHBondContact O-N 2.98Å; M459-V463 HydrophobicContact CG-CG2 4.01Å; M459-V463 VanDerWaalsContact O-CB 3.24Å; M459-V463 WeakPolarHBondContact O-CB 3.23Å; M459-V463 VanDerWaalsContact O-CG2 3.32Å; M459-V463 WeakPolarHBondContact O-CG2 3.28Å; M459-V463 PolarHBondContact O-N 3.19Å; M459-V479 HydrophobicContact CE-CG1 4.01Å; M459-V479 HydrophobicContact SD-CG1 4.02Å; M459-K483 HydrophobicContact CE-CB 4.27Å; M459-L484 HydrophobicContact SD-CB 4.26Å; M459-L484 HydrophobicContact SD-CD1 4.34Å; M459-Y487 HydrophobicContact CB-CD1 4.41Å; M459-Y487 HydrophobicContact CB-CD2 3.73Å; M459-Y487 HydrophobicContact CB-CE1 4.49Å; M459-Y487 HydrophobicContact CB-CE2 3.84Å; M459-Y487 HydrophobicContact CB-CG 4.05Å; M459-Y487 HydrophobicContact CG-CD2 3.96Å; M459-Y487 HydrophobicContact CG-CE2 3.74Å; M459-Y487 HydrophobicContact SD-CD2 4.27Å; M459-Y487 HydrophobicContact SD-CE2 4.38Å
460	Y	91.4	Very high	88.9	Confident	2 Å²	2	49.1 Å²	49.1	1%	0.008	28%	0.277	C	S	.	.	H	α-helix	trans	-62.5	-45.1	178	176.4	-119.7	0	0	0	111.3	L101 P102 V104 L456 D457 D462 C464 I468 G471 M476	L101-Y460 HydrophobicContact CD2-CD1 4.19Å; L101-Y460 HydrophobicContact CD2-CG 4.15Å; P102-Y460 HydrophobicContact CG-CE1 4.16Å; P102-Y460 PolarHBondContact O-OH 3.35Å; V104-Y460 HydrophobicContact CG2-CE1 4.45Å; V104-Y460 HydrophobicContact CG2-CE2 3.91Å; L456-Y460 WeakPolarHBondContact O-CB 3.48Å; L456-Y460 PolarHBondContact O-N 3.49Å; D457-Y460 PolarHBondContact O-N 2.69Å; Y460-D462 VanDerWaalsContact C-N 3.35Å; Y460-D462 PolarHBondContact O-N 3.16Å; Y460-C464 HydrophobicContact CD2-CB 3.83Å; Y460-C464 VanDerWaalsContact CD2-SG 3.55Å; Y460-C464 HydrophobicContact CE2-CB 3.95Å; Y460-C464 WeakPolarHBondContact O-CA 3.28Å; Y460-C464 WeakPolarHBondContact O-CB 3.45Å; Y460-C464 PolarHBondContact O-N 3.37Å; Y460-I468 HydrophobicContact CE1-CB 4.46Å; Y460-I468 HydrophobicContact CE1-CG1 4.35Å; Y460-I468 HydrophobicContact CE1-CG2 3.95Å; Y460-I468 WeakPolarHBondContact OH-CA 3.25Å; Y460-I468 PolarHBondContact OH-O 3Å; Y460-G471 PolarHBondContact OH-O 3.32Å; Y460-M476 HydrophobicContact CD2-SD 3.76Å; Y460-M476 HydrophobicContact CG-SD 4.33Å
461	K	90.2	Very high	88.3	Confident	99 Å²	99	47.2 Å²	47.2	43%	0.43	27%	0.272	S	S	.	.	H	α-helix	trans	-64.9	-36.7	177.2	-73.7	169	179.5	166.2	0	112.8	T99 D457 S458 T465	T99-K461 PolarHBondContact O-NZ 2.03Å; D457-K461 WeakPolarHBondContact O-CB 3.44Å; D457-K461 VanDerWaalsContact O-CG 3.3Å; D457-K461 WeakPolarHBondContact O-CG 3.49Å; D457-K461 PolarHBondContact O-N 3.42Å; D457-K461 VanDerWaalsContact OD1-CE 3.25Å; D457-K461 WeakPolarHBondContact OD1-CE 3.29Å; D457-K461 IonicContact OD1-NZ 3.1Å; D457-K461 PolarHBondContact OD1-NZ 3.01Å; D457-K461 VanDerWaalsContact OD2-CE 3.22Å; D457-K461 WeakPolarHBondContact OD2-CE 3.29Å; D457-K461 IonicContact OD2-NZ 3.28Å; D457-K461 PolarHBondContact OD2-NZ 3.31Å; S458-K461 PolarHBondContact O-N 2.97Å; K461-T465 WeakPolarHBondContact O-CG2 3.45Å
462	D	91.2	Very high	87.7	Confident	101 Å²	101	48.8 Å²	48.8	54%	0.54	28%	0.282	S	S	.	.	H	α-helix	trans	-79.9	-44.5	-178.4	-163.9	19.1	0	0	0	112.4	S458 M459 Y460 Y487	S458-D462 WeakPolarHBondContact O-CB 3.15Å; S458-D462 PolarHBondContact O-N 3.4Å; S458-D462 VanDerWaalsContact O-N 3.1Å; M459-D462 PolarHBondContact O-N 2.98Å; Y460-D462 VanDerWaalsContact C-N 3.35Å; Y460-D462 PolarHBondContact O-N 3.16Å; D462-Y487 HydrophobicContact CB-CE1 4.27Å; D462-Y487 PolarHBondContact OD2-OH 2.88Å
463	V	89.7	Confident	87.3	Confident	47 Å²	47	49.1 Å²	49.1	29%	0.285	28%	0.284	S	S	.	.	H	α-helix	trans	-88.5	-32.8	-172.5	179.6	0	0	0	0	112.8	M459 T465 A475	M459-V463 HydrophobicContact CG-CG2 4.01Å; M459-V463 VanDerWaalsContact O-CB 3.24Å; M459-V463 WeakPolarHBondContact O-CB 3.23Å; M459-V463 VanDerWaalsContact O-CG2 3.32Å; M459-V463 WeakPolarHBondContact O-CG2 3.28Å; M459-V463 PolarHBondContact O-N 3.19Å; V463-T465 PolarHBondContact O-N 3.37Å; V463-A475 HydrophobicContact CG1-CB 3.4Å
464	C	88.6	Confident	86.8	Confident	3 Å²	3	53.7 Å²	53.7	2%	0.02	31%	0.314	C	S	.	.	S	Bend	trans	-99.2	35.5	-177	-56.7	0	0	0	0	113.2	Y460 G466 Y467 C473 M476	Y460-C464 HydrophobicContact CD2-CB 3.83Å; Y460-C464 VanDerWaalsContact CD2-SG 3.55Å; Y460-C464 HydrophobicContact CE2-CB 3.95Å; Y460-C464 WeakPolarHBondContact O-CA 3.28Å; Y460-C464 WeakPolarHBondContact O-CB 3.45Å; Y460-C464 PolarHBondContact O-N 3.37Å; C464-G466 PolarHBondContact O-N 3.35Å; C464-Y467 PolarHBondContact O-N 3.31Å; C464-C473 VanDerWaalsContact CA-SG 3.52Å; C464-C473 HydrophobicContact CB-CB 3.63Å; C464-C473 WeakPolarHBondContact CB-SG 3.44Å; C464-C473 WeakPolarHBondContact SG-CB 3.36Å; C464-C473 CovalentContact SG-SG 2.03Å; C464-C473 PolarHBondContact SG-SG 2.96Å; C464-M476 VanDerWaalsContact SG-SD 3.65Å
465	T	82.4	Confident	86.3	Confident	113 Å²	113	53.1 Å²	53.1	69%	0.693	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.1	113.9	177.3	46.9	0	0	0	0	110.8	K461 V463	K461-T465 WeakPolarHBondContact O-CG2 3.45Å; V463-T465 PolarHBondContact O-N 3.37Å
466	G	78.7	Confident	85.9	Confident	84 Å²	84	53.2 Å²	53.2	87%	0.866	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	91.4	-4.6	-176.8	0	0	0	0	0	116.5	C464	C464-G466 PolarHBondContact O-N 3.35Å
467	Y	77.8	Confident	85.2	Confident	91 Å²	91	56.8 Å²	56.8	36%	0.357	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.7	-3.8	178.4	-137.7	-95	0	0	0	113.9	C464 A469 K470 C473	C464-Y467 PolarHBondContact O-N 3.31Å; Y467-A469 PolarHBondContact O-N 3.11Å; Y467-K470 HydrophobicContact CD1-CB 3.71Å; Y467-K470 HydrophobicContact CE1-CB 3.61Å; Y467-K470 HydrophobicContact CE1-CD 4.18Å; Y467-K470 HydrophobicContact CE2-CD 4.18Å; Y467-K470 HydrophobicContact CG-CB 4.44Å; Y467-K470 PolarHBondContact O-N 2.63Å; Y467-C473 HydrophobicContact CD1-CB 3.66Å; Y467-C473 HydrophobicContact CD2-CB 4.5Å; Y467-C473 HydrophobicContact CE1-CB 4.4Å; Y467-C473 HydrophobicContact CG-CB 3.72Å
468	I	74	Confident	84.5	Confident	62 Å²	62	60.3 Å²	60.3	32%	0.318	37%	0.37	S	S	.	.	G	3₁₀ helix	trans	-55.5	-28.4	-169.7	-60.8	175.5	0	0	0	113.6	P102 N103 Y460 K470	P102-I468 HydrophobicContact CG-CG2 3.88Å; N103-I468 PolarHBondContact ND2-O 2.99Å; Y460-I468 HydrophobicContact CE1-CB 4.46Å; Y460-I468 HydrophobicContact CE1-CG1 4.35Å; Y460-I468 HydrophobicContact CE1-CG2 3.95Å; Y460-I468 WeakPolarHBondContact OH-CA 3.25Å; Y460-I468 PolarHBondContact OH-O 3Å; I468-K470 VanDerWaalsContact C-N 3.34Å
469	A	72.9	Confident	84.1	Confident	88 Å²	88	59 Å²	59	73%	0.727	36%	0.359	S	S	*	.	G	3₁₀ helix	trans	-79.5	-12	178.5	0	0	0	0	0	114.3	Y467	Y467-A469 PolarHBondContact O-N 3.11Å
470	K	76.8	Confident	83.9	Confident	158 Å²	158	62.1 Å²	62.1	69%	0.687	38%	0.376	S	S	*	.	G	3₁₀ helix	trans	-108.4	2	-171.8	-65.4	-176	178.5	-178.6	0	114	Y467 I468	Y467-K470 HydrophobicContact CD1-CB 3.71Å; Y467-K470 HydrophobicContact CE1-CB 3.61Å; Y467-K470 HydrophobicContact CE1-CD 4.18Å; Y467-K470 HydrophobicContact CE2-CD 4.18Å; Y467-K470 HydrophobicContact CG-CB 4.44Å; Y467-K470 PolarHBondContact O-N 2.63Å; I468-K470 VanDerWaalsContact C-N 3.34Å
471	G	83.3	Confident	83.9	Confident	8 Å²	8	62.5 Å²	62.5	8%	0.082	38%	0.38	C	S	.	.	S	Bend	trans	87.4	-152.4	-175.1	0	0	0	0	0	112.7	N103 Y460 C473	N103-G471 WeakPolarHBondContact O-CA 3.47Å; Y460-G471 PolarHBondContact OH-O 3.32Å; G471-C473 PolarHBondContact O-N 2.95Å
472	V	84.2	Confident	84.1	Confident	34 Å²	34	59.3 Å²	59.3	21%	0.206	37%	0.371	C	S	.	.	S	Bend	trans	-62.6	122.4	-173.9	-173.1	0	0	0	0	110.8	D53 L54 V104 M476 V477	D53-V472 HydrophobicContact CB-CG2 3.66Å; L54-V472 HydrophobicContact CD2-CG1 4.4Å; L54-V472 HydrophobicContact CG-CG2 4.42Å; V104-V472 HydrophobicContact CB-CG2 4.29Å; V104-V472 HydrophobicContact CG1-CG2 3.61Å; V104-V472 HydrophobicContact CG2-CG2 3.75Å; V472-M476 HydrophobicContact CG1-CB 3.73Å; V472-V477 HydrophobicContact CG1-CG2 3.62Å
473	C	88.1	Confident	84.2	Confident	6 Å²	6	59.6 Å²	59.6	4%	0.041	37%	0.367	C	S	.	.			trans	-79.1	157.2	179.1	75.7	0	0	0	0	112	C464 Y467 G471 A475 M476	C464-C473 VanDerWaalsContact CA-SG 3.52Å; C464-C473 HydrophobicContact CB-CB 3.63Å; C464-C473 WeakPolarHBondContact CB-SG 3.44Å; C464-C473 WeakPolarHBondContact SG-CB 3.36Å; C464-C473 CovalentContact SG-SG 2.03Å; C464-C473 PolarHBondContact SG-SG 2.96Å; Y467-C473 HydrophobicContact CD1-CB 3.66Å; Y467-C473 HydrophobicContact CD2-CB 4.5Å; Y467-C473 HydrophobicContact CE1-CB 4.4Å; Y467-C473 HydrophobicContact CG-CB 3.72Å; G471-C473 PolarHBondContact O-N 2.95Å; C473-A475 PolarHBondContact O-N 2.85Å; C473-M476 PolarHBondContact O-N 3.06Å
474	P	85.5	Confident	84.4	Confident	97 Å²	97	57.3 Å²	57.3	63%	0.63	35%	0.353	S	S	*	.	G	3₁₀ helix	trans	-55.9	-26.1	179.8	-27.3	35.2	0	0	0	114.6	M476 V477	P474-M476 PolarHBondContact O-N 2.82Å; P474-V477 PolarHBondContact O-N 2.84Å
475	A	85.4	Confident	84.7	Confident	61 Å²	61	58 Å²	58	50%	0.504	36%	0.356	S	S	.	.	G	3₁₀ helix	trans	-73.3	-10.1	177.9	0	0	0	0	0	114.1	V463 C473	V463-A475 HydrophobicContact CG1-CB 3.4Å; C473-A475 PolarHBondContact O-N 2.85Å
476	M	86.4	Confident	85.3	Confident	1 Å²	1	58 Å²	58	1%	0.005	35%	0.348	C	S	.	.	G	3₁₀ helix	trans	-105.8	7	172.3	-70.2	-172.1	72.8	0	0	113	L54 L456 Y460 C464 V472 C473 P474 P478 V479	L54-M476 HydrophobicContact CD1-CE 4.02Å; L456-M476 HydrophobicContact CD2-CE 4.2Å; Y460-M476 HydrophobicContact CD2-SD 3.76Å; Y460-M476 HydrophobicContact CG-SD 4.33Å; C464-M476 VanDerWaalsContact SG-SD 3.65Å; V472-M476 HydrophobicContact CG1-CB 3.73Å; C473-M476 PolarHBondContact O-N 3.06Å; P474-M476 PolarHBondContact O-N 2.82Å; M476-P478 VanDerWaalsContact C-C 3.5Å; M476-P478 CarbonylContact O-C 3.56Å; M476-P478 VanDerWaalsContact O-C 3.22Å; M476-V479 HydrophobicContact CB-CG2 4.29Å; M476-V479 HydrophobicContact CE-CG2 4.25Å; M476-V479 WeakPolarHBondContact O-CG2 3.34Å; M476-V479 PolarHBondContact O-N 2.91Å
477	V	80.3	Confident	86.2	Confident	75 Å²	75	56.3 Å²	56.3	46%	0.455	32%	0.316	S	S	.	.	S	Bend	trans	-122.4	98.4	-179.4	-172.7	0	0	0	0	110.4	V472 P474	V472-V477 HydrophobicContact CG1-CG2 3.62Å; P474-V477 PolarHBondContact O-N 2.84Å
478	P	80.2	Confident	87	Confident	83 Å²	83	52 Å²	52	54%	0.539	30%	0.299	S	S	.	.	S	Bend	cis	-79.2	156.8	-5.4	33.7	-35	0	0	0	112.8	M476 D480	M476-P478 VanDerWaalsContact C-C 3.5Å; M476-P478 CarbonylContact O-C 3.56Å; M476-P478 VanDerWaalsContact O-C 3.22Å; P478-D480 PolarHBondContact O-N 2.93Å
479	V	86.2	Confident	88	Confident	24 Å²	24	51.3 Å²	51.3	15%	0.145	30%	0.296	C	S	.	.			trans	-66.6	128.6	174.8	179.7	0	0	0	0	109.9	L54 V166 M459 M476 G481 L484	L54-V479 HydrophobicContact CD2-CG2 3.97Å; V166-V479 HydrophobicContact CG1-CB 4.05Å; V166-V479 HydrophobicContact CG1-CG2 3.7Å; M459-V479 HydrophobicContact CE-CG1 4.01Å; M459-V479 HydrophobicContact SD-CG1 4.02Å; M476-V479 HydrophobicContact CB-CG2 4.29Å; M476-V479 HydrophobicContact CE-CG2 4.25Å; M476-V479 WeakPolarHBondContact O-CG2 3.34Å; M476-V479 PolarHBondContact O-N 2.91Å; V479-G481 PolarHBondContact O-N 3.49Å; V479-L484 HydrophobicContact CG1-CB 4.15Å; V479-L484 HydrophobicContact CG1-CD2 4.12Å
480	D	89.2	Confident	89	Confident	68 Å²	68	55 Å²	55	36%	0.364	30%	0.296	S	S	.	.			trans	-74.4	104.1	171.7	-179.5	-10.6	0	0	0	109.9	P478 S482 K483 L484	P478-D480 PolarHBondContact O-N 2.93Å; D480-S482 PolarHBondContact O-N 3.15Å; D480-S482 WeakPolarHBondContact OD1-CB 3.34Å; D480-S482 PolarHBondContact OD1-N 2.83Å; D480-K483 HydrophobicContact CB-CB 4.18Å; D480-K483 HydrophobicContact CB-CD 4.19Å; D480-K483 HydrophobicContact CB-CG 4.24Å; D480-K483 PolarHBondContact O-N 3.43Å; D480-K483 VanDerWaalsContact O-N 3.1Å; D480-K483 PolarHBondContact OD1-N 2.82Å; D480-K483 WeakPolarHBondContact OD2-CG 3.29Å; D480-L484 PolarHBondContact O-N 2.91Å
481	G	91	Very high	89.7	Confident	9 Å²	9	48 Å²	48	9%	0.093	27%	0.266	C	S	.	.	H	α-helix	trans	-62.5	-23.3	-178.5	0	0	0	0	0	114.3	H188 P190 V479 F485	H188-G481 CarbonylContact O-C 3.45Å; H188-G481 VanDerWaalsContact O-CA 3.27Å; H188-G481 WeakPolarHBondContact O-CA 3.44Å; P190-G481 VanDerWaalsContact CG-O 3.31Å; P190-G481 WeakPolarHBondContact CG-O 3.24Å; V479-G481 PolarHBondContact O-N 3.49Å; G481-F485 WeakPolarHBondContact O-CB 3.33Å; G481-F485 PolarHBondContact O-N 2.82Å
482	S	93.3	Very high	90.2	Very high	32 Å²	32	53.8 Å²	53.8	22%	0.224	29%	0.291	C	S	.	.	H	α-helix	trans	-72.6	-38.6	173.4	-61.4	0	0	0	0	112.6	Y209 D480 Q486	Y209-S482 WeakPolarHBondContact CE1-OG 3.41Å; Y209-S482 PolarHBondContact OH-OG 3.49Å; D480-S482 PolarHBondContact O-N 3.15Å; D480-S482 WeakPolarHBondContact OD1-CB 3.34Å; D480-S482 PolarHBondContact OD1-N 2.83Å; S482-Q486 WeakPolarHBondContact O-CG 3.38Å; S482-Q486 PolarHBondContact O-N 2.74Å
483	K	93.5	Very high	90.5	Very high	107 Å²	107	53.2 Å²	53.2	47%	0.465	29%	0.286	S	S	.	.	H	α-helix	trans	-68.9	-45.6	172	-71.7	-178.8	-174.5	-178.6	0	110.6	M459 D480 F485 Q486 Y487	M459-K483 HydrophobicContact CE-CB 4.27Å; D480-K483 HydrophobicContact CB-CB 4.18Å; D480-K483 HydrophobicContact CB-CD 4.19Å; D480-K483 HydrophobicContact CB-CG 4.24Å; D480-K483 PolarHBondContact O-N 3.43Å; D480-K483 VanDerWaalsContact O-N 3.1Å; D480-K483 PolarHBondContact OD1-N 2.82Å; D480-K483 WeakPolarHBondContact OD2-CG 3.29Å; K483-F485 VanDerWaalsContact C-N 3.28Å; K483-F485 PolarHBondContact O-N 3.27Å; K483-Q486 WeakPolarHBondContact O-CB 3.37Å; K483-Q486 PolarHBondContact O-N 3.39Å; K483-Y487 WeakPolarHBondContact O-CD2 3.16Å; K483-Y487 PolarHBondContact O-N 3.1Å; K483-Y487 VanDerWaalsContact O-N 3.13Å
484	L	94.6	Very high	90.6	Very high	0 Å²	0	56.8 Å²	56.8	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-54.2	-46.4	177.5	-179.7	57.5	0	0	0	111.2	V166 P190 A455 L456 M459 V479 D480 Q486 Y487 M488	V166-L484 HydrophobicContact CB-CD2 4.24Å; V166-L484 WeakPolarHBondContact O-CD2 3.49Å; P190-L484 HydrophobicContact CG-CB 4.48Å; P190-L484 HydrophobicContact CG-CD2 4.33Å; P190-L484 HydrophobicContact CG-CG 4.43Å; A455-L484 HydrophobicContact CB-CD1 4.08Å; L456-L484 HydrophobicContact CD2-CD1 3.68Å; L456-L484 HydrophobicContact CD2-CD2 4.08Å; L456-L484 HydrophobicContact CG-CD1 4.05Å; M459-L484 HydrophobicContact SD-CB 4.26Å; M459-L484 HydrophobicContact SD-CD1 4.34Å; V479-L484 HydrophobicContact CG1-CB 4.15Å; V479-L484 HydrophobicContact CG1-CD2 4.12Å; D480-L484 PolarHBondContact O-N 2.91Å; L484-Q486 VanDerWaalsContact C-N 3.28Å; L484-Q486 PolarHBondContact O-N 3.21Å; L484-Y487 PolarHBondContact O-N 3.06Å; L484-M488 HydrophobicContact CD1-CG 4.37Å; L484-M488 HydrophobicContact CG-CG 4.35Å; L484-M488 HydrophobicContact CG-SD 3.96Å; L484-M488 VanDerWaalsContact O-CG 3.27Å; L484-M488 WeakPolarHBondContact O-CG 3.44Å; L484-M488 PolarHBondContact O-N 2.92Å
485	F	95	Very high	90.5	Very high	16 Å²	16	53 Å²	53	7%	0.07	29%	0.285	C	S	.	.	H	α-helix	trans	-59	-36.2	176.9	-170.5	-107.6	0	0	0	113.3	P190 K208 Y209 Y210 M211 G481 K483 M488 L489	P190-F485 HydrophobicContact CB-CD2 4.2Å; P190-F485 HydrophobicContact CG-CB 4.16Å; K208-F485 WeakPolarHBondContact O-CE1 3.25Å; K208-F485 VanDerWaalsContact O-CZ 3.26Å; K208-F485 WeakPolarHBondContact O-CZ 3.49Å; Y209-F485 HydrophobicContact CD1-CB 4.22Å; Y209-F485 HydrophobicContact CD1-CG 4.29Å; Y210-F485 WeakPolarHBondContact O-CZ 3.42Å; M211-F485 HydrophobicContact CB-CE2 4.06Å; M211-F485 HydrophobicContact CG-CE2 4.24Å; M211-F485 HydrophobicContact SD-CE2 4.37Å; G481-F485 WeakPolarHBondContact O-CB 3.33Å; G481-F485 PolarHBondContact O-N 2.82Å; K483-F485 VanDerWaalsContact C-N 3.28Å; K483-F485 PolarHBondContact O-N 3.27Å; F485-M488 PolarHBondContact O-N 2.85Å; F485-L489 HydrophobicContact CD1-CD1 4.03Å; F485-L489 HydrophobicContact CD1-CG 4.4Å; F485-L489 HydrophobicContact CE1-CD1 3.65Å; F485-L489 HydrophobicContact CE1-CD2 4.46Å; F485-L489 HydrophobicContact CE1-CG 4.06Å; F485-L489 HydrophobicContact CZ-CD1 4.31Å; F485-L489 HydrophobicContact CZ-CD2 4.32Å; F485-L489 HydrophobicContact CZ-CG 4.3Å; F485-L489 PolarHBondContact O-N 3.01Å
486	Q	95.3	Very high	90.3	Very high	115 Å²	115	54.1 Å²	54.1	54%	0.537	28%	0.282	S	S	.	.	H	α-helix	trans	-67.2	-35.9	174.8	-67.9	178.4	8.9	0	0	112.8	S482 K483 L484 K490	S482-Q486 WeakPolarHBondContact O-CG 3.38Å; S482-Q486 PolarHBondContact O-N 2.74Å; K483-Q486 WeakPolarHBondContact O-CB 3.37Å; K483-Q486 PolarHBondContact O-N 3.39Å; L484-Q486 VanDerWaalsContact C-N 3.28Å; L484-Q486 PolarHBondContact O-N 3.21Å; Q486-K490 WeakPolarHBondContact O-CG 3.37Å
487	Y	96.2	Very high	90.1	Very high	47 Å²	47	57.2 Å²	57.2	18%	0.184	30%	0.304	C	S	.	.	H	α-helix	trans	-67.6	-42.2	171.6	-72.7	-83	0	0	0	110.7	M459 D462 K483 L484 L489 K490 T491	M459-Y487 HydrophobicContact CB-CD1 4.41Å; M459-Y487 HydrophobicContact CB-CD2 3.73Å; M459-Y487 HydrophobicContact CB-CE1 4.49Å; M459-Y487 HydrophobicContact CB-CE2 3.84Å; M459-Y487 HydrophobicContact CB-CG 4.05Å; M459-Y487 HydrophobicContact CG-CD2 3.96Å; M459-Y487 HydrophobicContact CG-CE2 3.74Å; M459-Y487 HydrophobicContact SD-CD2 4.27Å; M459-Y487 HydrophobicContact SD-CE2 4.38Å; D462-Y487 HydrophobicContact CB-CE1 4.27Å; D462-Y487 PolarHBondContact OD2-OH 2.88Å; K483-Y487 WeakPolarHBondContact O-CD2 3.16Å; K483-Y487 PolarHBondContact O-N 3.1Å; K483-Y487 VanDerWaalsContact O-N 3.13Å; L484-Y487 PolarHBondContact O-N 3.06Å; Y487-L489 VanDerWaalsContact C-N 3.34Å; Y487-L489 PolarHBondContact O-N 3.31Å; Y487-K490 CarbonylContact O-C 3.38Å; Y487-K490 PolarHBondContact O-N 3.41Å; Y487-T491 WeakPolarHBondContact O-CG2 3.39Å; Y487-T491 PolarHBondContact O-N 2.85Å; Y487-T491 VanDerWaalsContact O-N 3.15Å
488	M	96.5	Very high	90.3	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-60.1	-39.3	177.9	-63.4	166.7	74.5	0	0	112.8	P190 V192 M211 V452 A455 L484 F485 K490 T491	P190-M488 HydrophobicContact CB-CE 4.12Å; P190-M488 HydrophobicContact CB-SD 3.66Å; P190-M488 HydrophobicContact CG-SD 4.12Å; V192-M488 HydrophobicContact CG2-CE 3.15Å; M211-M488 HydrophobicContact CE-CB 4.3Å; M211-M488 HydrophobicContact CG-CE 4.1Å; M211-M488 HydrophobicContact SD-CB 3.51Å; M211-M488 VanDerWaalsContact SD-CB 3.51Å; M211-M488 HydrophobicContact SD-CE 3.34Å; M211-M488 WeakPolarHBondContact SD-CE 3.38Å; M211-M488 HydrophobicContact SD-CG 4.33Å; M211-M488 HydrophobicContact SD-SD 4.28Å; V452-M488 HydrophobicContact CG2-CE 4.18Å; A455-M488 HydrophobicContact CB-CB 4.12Å; A455-M488 HydrophobicContact CB-CG 3.37Å; L484-M488 HydrophobicContact CD1-CG 4.37Å; L484-M488 HydrophobicContact CG-CG 4.35Å; L484-M488 HydrophobicContact CG-SD 3.96Å; L484-M488 VanDerWaalsContact O-CG 3.27Å; L484-M488 WeakPolarHBondContact O-CG 3.44Å; L484-M488 PolarHBondContact O-N 2.92Å; F485-M488 PolarHBondContact O-N 2.85Å; M488-K490 PolarHBondContact O-N 2.96Å; M488-T491 PolarHBondContact O-N 3.32Å; M488-T491 PolarHBondContact O-OG1 3.3Å
489	L	94.7	Very high	90.4	Very high	48 Å²	48	55 Å²	55	25%	0.251	30%	0.296	S	S	.	.	H	α-helix	trans	-65.6	-21.8	174.5	-74.3	175.2	0	0	0	113.6	F485 Y487	F485-L489 HydrophobicContact CD1-CD1 4.03Å; F485-L489 HydrophobicContact CD1-CG 4.4Å; F485-L489 HydrophobicContact CE1-CD1 3.65Å; F485-L489 HydrophobicContact CE1-CD2 4.46Å; F485-L489 HydrophobicContact CE1-CG 4.06Å; F485-L489 HydrophobicContact CZ-CD1 4.31Å; F485-L489 HydrophobicContact CZ-CD2 4.32Å; F485-L489 HydrophobicContact CZ-CG 4.3Å; F485-L489 PolarHBondContact O-N 3.01Å; Y487-L489 VanDerWaalsContact C-N 3.34Å; Y487-L489 PolarHBondContact O-N 3.31Å
490	K	93.6	Very high	90.4	Very high	167 Å²	167	55.5 Å²	55.5	73%	0.726	30%	0.301	S	S	*	.	H	α-helix	trans	-99.3	-4.6	-178.3	-67.5	176.1	-176.4	175.2	0	113.5	Q486 Y487 M488 E492	Q486-K490 WeakPolarHBondContact O-CG 3.37Å; Y487-K490 CarbonylContact O-C 3.38Å; Y487-K490 PolarHBondContact O-N 3.41Å; M488-K490 PolarHBondContact O-N 2.96Å; K490-E492 PolarHBondContact O-N 2.95Å
491	T	92	Very high	90.4	Very high	10 Å²	10	53.4 Å²	53.4	6%	0.061	29%	0.289	C	S	.	.			trans	-68.1	130.3	179.8	55.6	0	0	0	0	110.8	A455 Y487 M488 F503	A455-T491 HydrophobicContact CB-CG2 3.76Å; Y487-T491 WeakPolarHBondContact O-CG2 3.39Å; Y487-T491 PolarHBondContact O-N 2.85Å; Y487-T491 VanDerWaalsContact O-N 3.15Å; M488-T491 PolarHBondContact O-N 3.32Å; M488-T491 PolarHBondContact O-OG1 3.3Å; T491-F503 WeakPolarHBondContact OG1-CE2 3.49Å
492	E	92.8	Very high	90.4	Very high	129 Å²	129	54.8 Å²	54.8	60%	0.603	29%	0.292	S	S	*	.			trans	-129.5	127	168.5	-177.9	172.7	-175.4	0	0	108.8	K490 S500 I501	K490-E492 PolarHBondContact O-N 2.95Å; E492-S500 PolarHBondContact OE1-OG 3.17Å; E492-I501 WeakPolarHBondContact CA-O 3.4Å
493	F	91.8	Very high	90.4	Very high	23 Å²	23	54.1 Å²	54.1	10%	0.101	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.7	164.3	178.1	65	-83.2	0	0	0	110.9	T447 Y454 I501	T447-F493 HydrophobicContact CG2-CE2 4.16Å; T447-F493 HydrophobicContact CG2-CZ 3.72Å; Y454-F493 HydrophobicContact CD2-CB 4.06Å; Y454-F493 AromaticContact CD2-CD1 3.88Å; Y454-F493 HydrophobicContact CD2-CD1 3.88Å; Y454-F493 HydrophobicContact CD2-CD2 4.19Å; Y454-F493 HydrophobicContact CD2-CE1 4.35Å; Y454-F493 AromaticContact CD2-CG 3.79Å; Y454-F493 HydrophobicContact CD2-CG 3.79Å; Y454-F493 HydrophobicContact CE2-CB 3.87Å; Y454-F493 HydrophobicContact CE2-CD1 4.35Å; Y454-F493 AromaticContact CE2-CD2 3.86Å; Y454-F493 HydrophobicContact CE2-CD2 3.86Å; Y454-F493 HydrophobicContact CE2-CE2 4.49Å; Y454-F493 AromaticContact CE2-CG 3.78Å; Y454-F493 HydrophobicContact CE2-CG 3.78Å; F493-I501 HydrophobicContact CE1-CB 4.33Å; F493-I501 HydrophobicContact CE1-CG2 4.14Å; F493-I501 HydrophobicContact CE2-CG1 4.47Å; F493-I501 HydrophobicContact CZ-CB 4.3Å; F493-I501 HydrophobicContact CZ-CG2 4.18Å; F493-I501 PolarHBondContact N-O 3.24Å; F493-I501 PolarHBondContact O-N 3.43Å
494	S	89.2	Confident	90.2	Very high	81 Å²	81	51.3 Å²	51.3	57%	0.566	28%	0.275	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.2	134.5	175.7	-63	0	0	0	0	110.8	Q499	S494-Q499 WeakPolarHBondContact CA-O 3.5Å
495	D	84.2	Confident	90	Very high	18 Å²	18	59.8 Å²	59.8	10%	0.096	31%	0.312	C	S	.	.			trans	-70.3	-179.5	171.8	77.3	-0.3	0	0	0	112.6	Y377 S497 G498 Q499 I501	Y377-D495 WeakPolarHBondContact CE1-OD2 3.09Å; D495-S497 PolarHBondContact O-N 2.97Å; D495-S497 VanDerWaalsContact OD1-C 3.28Å; D495-S497 VanDerWaalsContact OD1-CA 3.32Å; D495-S497 WeakPolarHBondContact OD1-CA 3.39Å; D495-S497 PolarHBondContact OD1-N 3.27Å; D495-G498 PolarHBondContact O-N 3.31Å; D495-G498 PolarHBondContact OD1-N 3.37Å; D495-Q499 PolarHBondContact N-O 3.23Å; D495-Q499 WeakPolarHBondContact OD1-CB 3.43Å; D495-Q499 PolarHBondContact OD1-N 3.34Å; D495-I501 HydrophobicContact CB-CD1 4.28Å; D495-I501 HydrophobicContact CB-CG1 4Å
496	L	81.5	Confident	89.9	Confident	84 Å²	84	61.4 Å²	61.4	44%	0.44	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-12.3	178.8	-65.2	170.8	0	0	0	114.3	V381 V446	V381-L496 HydrophobicContact CB-CD1 4.33Å; V381-L496 HydrophobicContact CG1-CD1 4Å; V381-L496 HydrophobicContact CG2-CD1 4.03Å; V446-L496 HydrophobicContact CG1-CD1 4.27Å
497	S	82.1	Confident	89.8	Confident	65 Å²	65	55.9 Å²	55.9	46%	0.455	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.5	9.2	176.6	-75.7	0	0	0	0	113.4	Y377 P379 D495 Q499	Y377-S497 WeakPolarHBondContact OH-CB 3.49Å; P379-S497 WeakPolarHBondContact CB-OG 3.36Å; D495-S497 PolarHBondContact O-N 2.97Å; D495-S497 VanDerWaalsContact OD1-C 3.28Å; D495-S497 VanDerWaalsContact OD1-CA 3.32Å; D495-S497 WeakPolarHBondContact OD1-CA 3.39Å; D495-S497 PolarHBondContact OD1-N 3.27Å; S497-Q499 VanDerWaalsContact C-N 3.32Å
498	G	83.8	Confident	89.6	Confident	56 Å²	56	54.1 Å²	54.1	58%	0.577	29%	0.289	S	S	*	.	S	Bend	trans	78.4	11.5	179.2	0	0	0	0	0	114.4	D495	D495-G498 PolarHBondContact O-N 3.31Å; D495-G498 PolarHBondContact OD1-N 3.37Å
499	Q	82.3	Confident	89.4	Confident	55 Å²	55	54.4 Å²	54.4	26%	0.257	29%	0.292	S	S	.	.			trans	-83.7	129.9	176.4	-65.7	-165.8	7.6	0	0	110.6	Y377 S494 D495 S497 I501	Y377-Q499 HydrophobicContact CE1-CG 4.23Å; Y377-Q499 VanDerWaalsContact CZ-OE1 3.28Å; Y377-Q499 VanDerWaalsContact OH-CD 3.24Å; Y377-Q499 PolarHBondContact OH-NE2 2.75Å; S494-Q499 WeakPolarHBondContact CA-O 3.5Å; D495-Q499 PolarHBondContact N-O 3.23Å; D495-Q499 WeakPolarHBondContact OD1-CB 3.43Å; D495-Q499 PolarHBondContact OD1-N 3.34Å; S497-Q499 VanDerWaalsContact C-N 3.32Å; Q499-I501 PolarHBondContact O-N 3.37Å
500	S	85.7	Confident	89	Confident	36 Å²	36	52.8 Å²	52.8	25%	0.252	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.1	127.4	175.1	170.6	0	0	0	0	111	E492	E492-S500 PolarHBondContact OE1-OG 3.17Å
501	I	89.2	Confident	88.8	Confident	23 Å²	23	44.8 Å²	44.8	12%	0.118	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	122.4	171.9	-57.3	-59.8	0	0	0	107.6	T447 E492 F493 D495 Q499 F503	T447-I501 HydrophobicContact CG2-CG1 4.27Å; T447-I501 HydrophobicContact CG2-CG2 4.14Å; E492-I501 WeakPolarHBondContact CA-O 3.4Å; F493-I501 HydrophobicContact CE1-CB 4.33Å; F493-I501 HydrophobicContact CE1-CG2 4.14Å; F493-I501 HydrophobicContact CE2-CG1 4.47Å; F493-I501 HydrophobicContact CZ-CB 4.3Å; F493-I501 HydrophobicContact CZ-CG2 4.18Å; F493-I501 PolarHBondContact N-O 3.24Å; F493-I501 PolarHBondContact O-N 3.43Å; D495-I501 HydrophobicContact CB-CD1 4.28Å; D495-I501 HydrophobicContact CB-CG1 4Å; Q499-I501 PolarHBondContact O-N 3.37Å; I501-F503 HydrophobicContact CG2-CE1 4.48Å; I501-F503 HydrophobicContact CG2-CE2 4.46Å; I501-F503 HydrophobicContact CG2-CZ 3.98Å
502	Y	91.6	Very high	88.7	Confident	39 Å²	39	47.4 Å²	47.4	15%	0.153	26%	0.258	C	S	.	.			trans	-146.6	163.2	175.5	58.4	-92.5	0	0	0	108.9	P509 P510 W535	Y502-P509 WeakPolarHBondContact O-CA 2.88Å; Y502-P510 HydrophobicContact CD1-CG 4.46Å; Y502-P510 HydrophobicContact CE1-CG 3.92Å; Y502-P510 HydrophobicContact CE2-CB 4.42Å; Y502-P510 HydrophobicContact CE2-CG 4.19Å; Y502-P510 VanDerWaalsContact O-CD 3.25Å; Y502-P510 WeakPolarHBondContact O-CD 3.46Å; Y502-W535 HydrophobicContact CE2-CB 4.46Å; Y502-W535 AromaticContact CE2-CD1 3.89Å; Y502-W535 HydrophobicContact CE2-CG 4.44Å
503	F	92.7	Very high	88.6	Confident	18 Å²	18	41.5 Å²	41.5	8%	0.079	23%	0.23	C	C	.	.			trans	-119.7	146.1	-176.8	-54.1	-76.4	0	0	0	111.5	M211 R212 V213 T451 T491 I501 D508 P509	M211-F503 HydrophobicContact CE-CD1 3.79Å; M211-F503 HydrophobicContact CE-CD2 3.58Å; M211-F503 HydrophobicContact CE-CE1 3.73Å; M211-F503 HydrophobicContact CE-CE2 3.51Å; M211-F503 HydrophobicContact CE-CG 3.73Å; M211-F503 HydrophobicContact CE-CZ 3.58Å; R212-F503 WeakPolarHBondContact O-CE1 3.23Å; V213-F503 HydrophobicContact CG1-CE1 4.23Å; V213-F503 HydrophobicContact CG1-CZ 4.12Å; T451-F503 HydrophobicContact CG2-CE2 3.76Å; T451-F503 HydrophobicContact CG2-CZ 3.85Å; T491-F503 WeakPolarHBondContact OG1-CE2 3.49Å; I501-F503 HydrophobicContact CG2-CE1 4.48Å; I501-F503 HydrophobicContact CG2-CE2 4.46Å; I501-F503 HydrophobicContact CG2-CZ 3.98Å; F503-D508 WeakPolarHBondContact CA-O 3.48Å; F503-P509 HydrophobicContact CD1-CB 4.31Å; F503-P509 HydrophobicContact CE1-CB 4.3Å
504	D	90.5	Very high	88.6	Confident	47 Å²	47	41.8 Å²	41.8	25%	0.251	23%	0.233	S	C	.	.			trans	-78.6	-178.3	169.6	76.4	0.9	0	0	0	111.6	N506 G507 D508	D504-N506 PolarHBondContact O-N 3.11Å; D504-N506 VanDerWaalsContact O-N 3.09Å; D504-N506 VanDerWaalsContact OD1-C 3.26Å; D504-N506 VanDerWaalsContact OD1-CA 3.23Å; D504-N506 WeakPolarHBondContact OD1-CA 2.82Å; D504-N506 WeakPolarHBondContact OD1-CB 3.26Å; D504-N506 PolarHBondContact OD1-N 3.23Å; D504-G507 PolarHBondContact O-N 3.19Å; D504-G507 PolarHBondContact OD1-N 3.45Å; D504-D508 PolarHBondContact N-O 3.26Å; D504-D508 PolarHBondContact OD1-N 3.09Å
505	K	90.3	Very high	88.8	Confident	178 Å²	178	38 Å²	38	77%	0.774	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-19.6	176.3	63.6	175.8	-177.1	176.9	0	114.1
506	N	91.8	Very high	89.1	Confident	50 Å²	50	37.2 Å²	37.2	27%	0.267	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.3	6.4	178.3	-58.7	-28.6	0	0	0	111.8	K204 D504 D508	K204-N506 VanDerWaalsContact CE-CA 3.49Å; K204-N506 WeakPolarHBondContact CE-O 3.35Å; K204-N506 PolarHBondContact NZ-O 3.12Å; D504-N506 PolarHBondContact O-N 3.11Å; D504-N506 VanDerWaalsContact O-N 3.09Å; D504-N506 VanDerWaalsContact OD1-C 3.26Å; D504-N506 VanDerWaalsContact OD1-CA 3.23Å; D504-N506 WeakPolarHBondContact OD1-CA 2.82Å; D504-N506 WeakPolarHBondContact OD1-CB 3.26Å; D504-N506 PolarHBondContact OD1-N 3.23Å; N506-D508 PolarHBondContact O-N 3.38Å
507	G	92.6	Very high	89.7	Confident	0 Å²	0	33.2 Å²	33.2	0%	0	18%	0.181	C	C	.	.	S	Bend	trans	68.6	24.7	-177.8	0	0	0	0	0	113.3	R212 D504	R212-G507 PolarHBondContact N-O 3.28Å; R212-G507 VanDerWaalsContact N-O 3.1Å; D504-G507 PolarHBondContact O-N 3.19Å; D504-G507 PolarHBondContact OD1-N 3.45Å
508	D	93.2	Very high	90.1	Very high	9 Å²	9	30.5 Å²	30.5	5%	0.048	16%	0.161	C	C	.	.	P	Polyproline II helix	trans	-102.4	138.4	177.5	-71.3	-37.8	0	0	0	111.1	S202 R212 F503 D504 N506	S202-D508 WeakPolarHBondContact CB-OD2 3.4Å; S202-D508 PolarHBondContact OG-OD2 2.78Å; R212-D508 IonicContact CZ-OD1 2.73Å; R212-D508 IonicContact NE-OD1 3.1Å; R212-D508 PolarHBondContact NE-OD1 2.94Å; R212-D508 IonicContact NH2-OD1 3.99Å; R212-D508 PolarHBondContact NH2-OD1 3.42Å; R212-D508 IonicContact NH2-OD2 3.06Å; R212-D508 PolarHBondContact NH2-OD2 2.87Å; F503-D508 WeakPolarHBondContact CA-O 3.48Å; D504-D508 PolarHBondContact N-O 3.26Å; D504-D508 PolarHBondContact OD1-N 3.09Å; N506-D508 PolarHBondContact O-N 3.38Å
509	P	91.5	Very high	90.3	Very high	7 Å²	7	30 Å²	30	5%	0.045	14%	0.143	C	C	.	.	P	Polyproline II helix	trans	-85.5	165.7	178	36.3	-34.7	0	0	0	111.7	R212 V214 Y502 F503	R212-P509 WeakPolarHBondContact O-CD 3.22Å; V214-P509 VanDerWaalsContact C-CG 3.43Å; V214-P509 VanDerWaalsContact O-CD 3.27Å; V214-P509 WeakPolarHBondContact O-CD 3.26Å; V214-P509 WeakPolarHBondContact O-CG 3.32Å; Y502-P509 WeakPolarHBondContact O-CA 2.88Å; F503-P509 HydrophobicContact CD1-CB 4.31Å; F503-P509 HydrophobicContact CE1-CB 4.3Å
510	P	86.9	Confident	90.4	Very high	13 Å²	13	27.9 Å²	27.9	8%	0.084	14%	0.136	C	C	.	.	P	Polyproline II helix	trans	-59.5	140.5	172.1	25.5	-35.2	0	0	0	112.2	Y502	Y502-P510 HydrophobicContact CD1-CG 4.46Å; Y502-P510 HydrophobicContact CE1-CG 3.92Å; Y502-P510 HydrophobicContact CE2-CB 4.42Å; Y502-P510 HydrophobicContact CE2-CG 4.19Å; Y502-P510 VanDerWaalsContact O-CD 3.25Å; Y502-P510 WeakPolarHBondContact O-CD 3.46Å
511	A	89.6	Confident	90.2	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	16%	0.16	C	C	.	.	P	Polyproline II helix	trans	-88.5	125.2	-177	0	0	0	0	0	112.8	P215 W219 Y513 W531 H533	P215-A511 HydrophobicContact CB-CB 3.56Å; P215-A511 HydrophobicContact CG-CB 4.23Å; W219-A511 HydrophobicContact CB-CB 3.42Å; W219-A511 VanDerWaalsContact CB-CB 3.42Å; W219-A511 HydrophobicContact CD2-CB 4.23Å; W219-A511 HydrophobicContact CG-CB 3.5Å; A511-Y513 HydrophobicContact CB-CE2 4.08Å; A511-W531 HydrophobicContact CB-CH2 4.45Å; A511-W531 HydrophobicContact CB-CZ3 3.74Å; A511-H533 HydrophobicContact CB-CB 4.43Å; A511-H533 PolarHBondContact O-N 3.1Å
512	R	89.5	Confident	89.8	Confident	64 Å²	64	43.1 Å²	43.1	24%	0.242	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	125.3	175.8	-61.5	178.8	-173.2	163.1	7.5	108.9	Y377	Y377-R512 WeakPolarHBondContact CB-O 3.46Å; Y377-R512 HydrophobicContact CG-CB 4.38Å; Y377-R512 PolarHBondContact N-O 3.25Å
513	Y	91.6	Very high	89.4	Confident	5 Å²	5	43.8 Å²	43.8	2%	0.02	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	139.3	-178.7	-58.6	-70	0	0	0	111.5	P215 S216 W219 Q220 A223 F374 R375 I376 A511 T530 W531	P215-Y513 HydrophobicContact CG-CE1 3.86Å; P215-Y513 WeakPolarHBondContact CG-OH 3.12Å; S216-Y513 PolarHBondContact O-OH 3.38Å; W219-Y513 HydrophobicContact CB-CE2 4.2Å; Q220-Y513 HydrophobicContact CB-CE2 4.32Å; A223-Y513 HydrophobicContact CB-CD2 4.33Å; F374-Y513 HydrophobicContact CD1-CG 4.18Å; R375-Y513 CarbonylContact O-C 3.59Å; R375-Y513 VanDerWaalsContact O-CA 3.29Å; R375-Y513 WeakPolarHBondContact O-CA 3.37Å; I376-Y513 HydrophobicContact CG1-CD1 4.18Å; I376-Y513 HydrophobicContact CG1-CE1 3.84Å; A511-Y513 HydrophobicContact CB-CE2 4.08Å; Y513-T530 CarbonylContact O-C 3.53Å; Y513-T530 WeakPolarHBondContact O-CA 3.43Å; Y513-W531 HydrophobicContact CD2-CD2 4.32Å; Y513-W531 AromaticContact CD2-CE3 3.48Å; Y513-W531 HydrophobicContact CD2-CE3 3.48Å; Y513-W531 VanDerWaalsContact CD2-CE3 3.48Å; Y513-W531 AromaticContact CD2-CZ3 3.87Å; Y513-W531 HydrophobicContact CD2-CZ3 3.87Å; Y513-W531 AromaticContact CE2-CE3 3.95Å; Y513-W531 HydrophobicContact CE2-CE3 3.95Å; Y513-W531 AromaticContact CE2-CZ3 3.85Å; Y513-W531 HydrophobicContact CE2-CZ3 3.85Å; Y513-W531 PolarHBondContact N-O 3.19Å; Y513-W531 PolarHBondContact O-N 3.46Å
514	D	91	Very high	89.1	Confident	30 Å²	30	43.8 Å²	43.8	16%	0.16	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	139.1	157.8	-59.4	-35.6	0	0	0	109.2	F374 R375 L516 T527	F374-D514 CarbonylContact C-O 3.56Å; R375-D514 HydrophobicContact CB-CB 4.19Å; R375-D514 IonicContact CZ-OD2 3.32Å; R375-D514 PolarHBondContact N-O 3.41Å; R375-D514 IonicContact NE-OD2 3.13Å; R375-D514 PolarHBondContact NE-OD2 3.26Å; R375-D514 VanDerWaalsContact NE-OD2 3.11Å; R375-D514 IonicContact NH2-OD2 2.69Å; R375-D514 PolarHBondContact NH2-OD2 2.65Å; R375-D514 PolarHBondContact O-N 3.42Å; D514-L516 HydrophobicContact CB-CD2 4.46Å; D514-T527 HydrophobicContact CB-CG2 4.14Å
515	I	92.3	Very high	89.1	Confident	1 Å²	1	43.1 Å²	43.1	1%	0.005	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	118.1	175.5	-57.9	168.9	0	0	0	107.4	I227 Y372 F374 V528 G529 W531 L555 I557	I227-I515 HydrophobicContact CD1-CD1 3.87Å; I227-I515 HydrophobicContact CD1-CG1 4.4Å; I227-I515 HydrophobicContact CD1-CG2 4.33Å; I227-I515 HydrophobicContact CG1-CD1 4.22Å; Y372-I515 HydrophobicContact CD1-CG2 3.67Å; Y372-I515 HydrophobicContact CE1-CG2 4.19Å; F374-I515 HydrophobicContact CD1-CG1 4.44Å; F374-I515 HydrophobicContact CE1-CG1 4.22Å; I515-V528 HydrophobicContact CB-CG2 4.41Å; I515-V528 HydrophobicContact CG2-CG2 3.9Å; I515-V528 WeakPolarHBondContact O-CG2 3.04Å; I515-V528 PolarHBondContact O-N 2.03Å; I515-G529 PolarHBondContact N-O 2.75Å; I515-G529 PolarHBondContact O-N 3.23Å; I515-W531 HydrophobicContact CD1-CB 4.36Å; I515-L555 HydrophobicContact CD1-CD1 3.32Å; I515-I557 HydrophobicContact CD1-CG1 4.44Å
516	L	92.5	Very high	89.1	Confident	1 Å²	1	36.5 Å²	36.5	1%	0.005	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	149.7	-179.3	-50	176.1	0	0	0	110.3	Y372 S373 R375 D514 Y525 V526 T527	Y372-L516 CarbonylContact C-O 3.58Å; Y372-L516 VanDerWaalsContact CA-O 3.29Å; Y372-L516 WeakPolarHBondContact CA-O 3.4Å; S373-L516 PolarHBondContact N-O 3.2Å; S373-L516 PolarHBondContact O-N 3.11Å; R375-L516 HydrophobicContact CB-CD1 4Å; R375-L516 HydrophobicContact CB-CG 4.34Å; D514-L516 HydrophobicContact CB-CD2 4.46Å; L516-Y525 HydrophobicContact CB-CD1 4.48Å; L516-Y525 HydrophobicContact CD1-CD1 4.36Å; L516-V526 CarbonylContact C-O 3.53Å; L516-V526 WeakPolarHBondContact CA-O 3.44Å; L516-T527 HydrophobicContact CD2-CG2 4.35Å; L516-T527 VanDerWaalsContact CD2-OG1 3.24Å; L516-T527 WeakPolarHBondContact CD2-OG1 3.43Å
517	N	92.2	Very high	89.1	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	128.4	170.7	177.3	-117.2	0	0	0	108.4	G370 A371 Q519 V526 V528 L563	G370-N517 PolarHBondContact O-ND2 3.43Å; A371-N517 WeakPolarHBondContact O-CA 3.42Å; N517-Q519 WeakPolarHBondContact OD1-CG 3.27Å; N517-Q519 PolarHBondContact OD1-NE2 3.41Å; N517-Q519 VanDerWaalsContact OD1-NE2 3.13Å; N517-V526 PolarHBondContact N-O 2.84Å; N517-V526 PolarHBondContact O-N 3.27Å; N517-V528 HydrophobicContact CB-CB 4.43Å; N517-V528 HydrophobicContact CB-CG1 3.51Å; N517-V528 HydrophobicContact CB-CG2 4.03Å; N517-L563 PolarHBondContact OD1-N 2.84Å; N517-L563 PolarHBondContact OD1-O 3.17Å
518	Y	91	Very high	89	Confident	9 Å²	9	36.8 Å²	36.8	4%	0.035	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	118.8	-179.8	-176.2	-99.8	0	0	0	110.8	V361 E365 A368 T369 G370 A371 Y525	V361-Y518 HydrophobicContact CB-CE1 4.36Å; V361-Y518 HydrophobicContact CB-CE2 4.1Å; V361-Y518 HydrophobicContact CG1-CD2 4.29Å; V361-Y518 HydrophobicContact CG1-CE1 4.37Å; V361-Y518 HydrophobicContact CG1-CE2 4.06Å; V361-Y518 HydrophobicContact CG2-CE2 3.75Å; E365-Y518 HydrophobicContact CB-CE1 4.29Å; E365-Y518 VanDerWaalsContact CG-OH 3.23Å; E365-Y518 WeakPolarHBondContact CG-OH 3.41Å; A368-Y518 HydrophobicContact CB-CD1 3.72Å; A368-Y518 HydrophobicContact CB-CE1 3.84Å; A368-Y518 WeakPolarHBondContact O-CD1 3.34Å; T369-Y518 CarbonylContact C-O 3.5Å; T369-Y518 WeakPolarHBondContact CA-O 3.23Å; G370-Y518 PolarHBondContact N-O 2.8Å; A371-Y518 PolarHBondContact O-N 3.2Å; Y518-Y525 AromaticContact CD2-CD1 3.99Å; Y518-Y525 HydrophobicContact CD2-CD1 3.99Å; Y518-Y525 HydrophobicContact CD2-CD2 4.23Å; Y518-Y525 AromaticContact CD2-CE1 3.87Å; Y518-Y525 HydrophobicContact CD2-CE1 3.87Å; Y518-Y525 HydrophobicContact CD2-CE2 4.11Å; Y518-Y525 HydrophobicContact CD2-CG 4.17Å; Y518-Y525 AromaticContact CD2-CZ 3.92Å; Y518-Y525 HydrophobicContact CE2-CE2 4.31Å; Y518-Y525 HydrophobicContact CG-CE1 4.5Å
519	Q	89	Confident	89	Confident	46 Å²	46	36.8 Å²	36.8	22%	0.215	19%	0.192	C	C	.	.			trans	-112.3	34.4	-170.5	-58.5	-167.8	2.7	0	0	112.8	N517 A523 G524 V526 K561 L563	N517-Q519 WeakPolarHBondContact OD1-CG 3.27Å; N517-Q519 PolarHBondContact OD1-NE2 3.41Å; N517-Q519 VanDerWaalsContact OD1-NE2 3.13Å; Q519-A523 HydrophobicContact CB-CB 3.66Å; Q519-G524 PolarHBondContact N-O 2.94Å; Q519-V526 HydrophobicContact CB-CG2 4.32Å; Q519-V526 HydrophobicContact CG-CB 4.33Å; Q519-V526 HydrophobicContact CG-CG2 4.01Å; Q519-K561 PolarHBondContact NE2-O 3.43Å; Q519-L563 HydrophobicContact CB-CB 4.5Å; Q519-L563 HydrophobicContact CB-CD2 3.94Å; Q519-L563 HydrophobicContact CG-CB 3.82Å; Q519-L563 HydrophobicContact CG-CD2 4.16Å
520	G	84	Confident	89	Confident	9 Å²	9	39.2 Å²	39.2	9%	0.093	21%	0.207	C	C	.	.	H	α-helix	trans	77.2	-169.1	178	0	0	0	0	0	113.6	Q522 G524	G520-Q522 PolarHBondContact O-N 3.02Å; G520-G524 VanDerWaalsContact O-CA 3.29Å; G520-G524 WeakPolarHBondContact O-CA 3Å; G520-G524 PolarHBondContact O-N 3.13Å
521	K	80.5	Confident	89.2	Confident	176 Å²	176	38.7 Å²	38.7	77%	0.765	20%	0.204	S	C	*	.	H	α-helix	trans	-67	-33.2	-168.1	-168.6	173.4	-178.9	176.2	0	114.6	E365	E365-K521 HydrophobicContact CG-CB 4.36Å
522	Q	81.4	Confident	89	Confident	203 Å²	203	39.5 Å²	39.5	95%	0.949	21%	0.212	S	C	*	.	H	α-helix	trans	-79.3	-50.4	-176	-71.8	-178.4	-14.4	0	0	112.2	G520	G520-Q522 PolarHBondContact O-N 3.02Å
523	A	83	Confident	88.3	Confident	54 Å²	54	36.9 Å²	36.9	45%	0.446	20%	0.202	S	C	.	.	H	α-helix	trans	-85.7	-27.5	-178	0	0	0	0	0	112.9	Q519 V526	Q519-A523 HydrophobicContact CB-CB 3.66Å; A523-V526 HydrophobicContact CB-CG2 4.19Å
524	G	87.4	Confident	86.9	Confident	17 Å²	17	40.1 Å²	40.1	18%	0.175	22%	0.222	C	C	.	.			trans	65.1	-138	-179.3	0	0	0	0	0	112.2	Q519 G520	Q519-G524 PolarHBondContact N-O 2.94Å; G520-G524 VanDerWaalsContact O-CA 3.29Å; G520-G524 WeakPolarHBondContact O-CA 3Å; G520-G524 PolarHBondContact O-N 3.13Å
525	Y	89	Confident	85.1	Confident	33 Å²	33	42.3 Å²	42.3	13%	0.129	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	124.9	176.3	-63.4	-86.2	0	0	0	110.3	W354 R357 V361 L516 Y518	W354-Y525 HydrophobicContact CD2-CE1 4.3Å; W354-Y525 AromaticContact CE3-CE1 3.66Å; W354-Y525 HydrophobicContact CE3-CE1 3.66Å; W354-Y525 AromaticContact CE3-CZ 3.77Å; W354-Y525 AromaticContact CH2-CE1 3.78Å; W354-Y525 HydrophobicContact CH2-CE1 3.78Å; W354-Y525 HydrophobicContact CZ2-CE1 4.42Å; W354-Y525 AromaticContact CZ3-CE1 3.35Å; W354-Y525 HydrophobicContact CZ3-CE1 3.35Å; W354-Y525 AromaticContact CZ3-CZ 3.75Å; W354-Y525 VanDerWaalsContact CZ3-OH 3.31Å; W354-Y525 WeakPolarHBondContact CZ3-OH 3.41Å; W354-Y525 PolarHBondContact O-OH 2.79Å; R357-Y525 PolarHBondContact O-OH 3.31Å; V361-Y525 WeakPolarHBondContact CG1-OH 3.42Å; L516-Y525 HydrophobicContact CB-CD1 4.48Å; L516-Y525 HydrophobicContact CD1-CD1 4.36Å; Y518-Y525 AromaticContact CD2-CD1 3.99Å; Y518-Y525 HydrophobicContact CD2-CD1 3.99Å; Y518-Y525 HydrophobicContact CD2-CD2 4.23Å; Y518-Y525 AromaticContact CD2-CE1 3.87Å; Y518-Y525 HydrophobicContact CD2-CE1 3.87Å; Y518-Y525 HydrophobicContact CD2-CE2 4.11Å; Y518-Y525 HydrophobicContact CD2-CG 4.17Å; Y518-Y525 AromaticContact CD2-CZ 3.92Å; Y518-Y525 HydrophobicContact CE2-CE2 4.31Å; Y518-Y525 HydrophobicContact CG-CE1 4.5Å
526	V	90.7	Very high	82.9	Confident	39 Å²	39	50 Å²	50	24%	0.236	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	128.2	179.2	-179.9	0	0	0	0	109.5	L516 N517 Q519 A523 V528	L516-V526 CarbonylContact C-O 3.53Å; L516-V526 WeakPolarHBondContact CA-O 3.44Å; N517-V526 PolarHBondContact N-O 2.84Å; N517-V526 PolarHBondContact O-N 3.27Å; Q519-V526 HydrophobicContact CB-CG2 4.32Å; Q519-V526 HydrophobicContact CG-CB 4.33Å; Q519-V526 HydrophobicContact CG-CG2 4.01Å; A523-V526 HydrophobicContact CB-CG2 4.19Å; V526-V528 PolarHBondContact O-N 2.98Å
527	T	91.4	Very high	80.3	Confident	53 Å²	53	57.6 Å²	57.6	33%	0.325	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	116	175.1	-50.8	0	0	0	0	110.7	R375 D514 L516	R375-T527 PolarHBondContact NH2-OG1 2.83Å; D514-T527 HydrophobicContact CB-CG2 4.14Å; L516-T527 HydrophobicContact CD2-CG2 4.35Å; L516-T527 VanDerWaalsContact CD2-OG1 3.24Å; L516-T527 WeakPolarHBondContact CD2-OG1 3.43Å
528	V	92.1	Very high	77.6	Confident	3 Å²	3	62.4 Å²	62.4	2%	0.018	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	-14.7	-179.4	-64.9	0	0	0	0	112.9	Y372 I515 N517 V526 D558 K561 I562	Y372-V528 HydrophobicContact CD1-CG2 4.38Å; Y372-V528 HydrophobicContact CE1-CG2 3.96Å; I515-V528 HydrophobicContact CB-CG2 4.41Å; I515-V528 HydrophobicContact CG2-CG2 3.9Å; I515-V528 WeakPolarHBondContact O-CG2 3.04Å; I515-V528 PolarHBondContact O-N 2.03Å; N517-V528 HydrophobicContact CB-CB 4.43Å; N517-V528 HydrophobicContact CB-CG1 3.51Å; N517-V528 HydrophobicContact CB-CG2 4.03Å; V526-V528 PolarHBondContact O-N 2.98Å; V528-D558 PolarHBondContact O-N 2.86Å; V528-K561 HydrophobicContact CG1-CB 4Å; V528-I562 HydrophobicContact CB-CG1 4.23Å; V528-I562 HydrophobicContact CG1-CG1 4.22Å
529	G	91.8	Very high	74.9	Confident	9 Å²	9	70.1 Å²	70.1	9%	0.093	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-169.3	177.1	-179.2	0	0	0	0	0	114	I515 R556	I515-G529 PolarHBondContact N-O 2.75Å; I515-G529 PolarHBondContact O-N 3.23Å; G529-R556 CarbonylContact C-O 3.5Å; G529-R556 WeakPolarHBondContact CA-O 3.36Å
530	T	92	Very high	72.3	Confident	58 Å²	58	74 Å²	74	36%	0.356	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	149.8	174.1	59.7	0	0	0	0	110	Y513 R556	Y513-T530 CarbonylContact O-C 3.53Å; Y513-T530 WeakPolarHBondContact O-CA 3.43Å; T530-R556 PolarHBondContact N-O 3.22Å; T530-R556 PolarHBondContact O-N 3.15Å
531	W	92.1	Very high	70.1	Confident	3 Å²	3	79.3 Å²	79.3	1%	0.011	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	131.4	172.4	-175.1	99.9	0	0	0	108.3	W219 K222 A223 D226 A511 Y513 I515 H533 L555	W219-W531 HydrophobicContact CB-CH2 4.05Å; W219-W531 HydrophobicContact CB-CZ3 4.23Å; W219-W531 HydrophobicContact CD2-CH2 4.43Å; W219-W531 AromaticContact CE3-CH2 3.81Å; W219-W531 HydrophobicContact CE3-CH2 3.81Å; K222-W531 HydrophobicContact CB-CZ2 4.44Å; K222-W531 HydrophobicContact CG-CZ2 4.25Å; A223-W531 HydrophobicContact CB-CB 4.44Å; A223-W531 HydrophobicContact CB-CD2 3.59Å; A223-W531 HydrophobicContact CB-CE3 4.15Å; A223-W531 HydrophobicContact CB-CG 3.73Å; A223-W531 HydrophobicContact CB-CZ2 4.15Å; D226-W531 PolarHBondContact OD2-NE1 2.9Å; A511-W531 HydrophobicContact CB-CH2 4.45Å; A511-W531 HydrophobicContact CB-CZ3 3.74Å; Y513-W531 HydrophobicContact CD2-CD2 4.32Å; Y513-W531 AromaticContact CD2-CE3 3.48Å; Y513-W531 HydrophobicContact CD2-CE3 3.48Å; Y513-W531 VanDerWaalsContact CD2-CE3 3.48Å; Y513-W531 AromaticContact CD2-CZ3 3.87Å; Y513-W531 HydrophobicContact CD2-CZ3 3.87Å; Y513-W531 AromaticContact CE2-CE3 3.95Å; Y513-W531 HydrophobicContact CE2-CE3 3.95Å; Y513-W531 AromaticContact CE2-CZ3 3.85Å; Y513-W531 HydrophobicContact CE2-CZ3 3.85Å; Y513-W531 PolarHBondContact N-O 3.19Å; Y513-W531 PolarHBondContact O-N 3.46Å; I515-W531 HydrophobicContact CD1-CB 4.36Å; W531-H533 HydrophobicContact CH2-CB 3.83Å; W531-H533 HydrophobicContact CZ3-CB 3.94Å; W531-L555 HydrophobicContact CB-CD1 4.27Å
532	G	84.5	Confident	68	Low	16 Å²	16	77.7 Å²	77.7	17%	0.165	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	140.1	178.9	0	0	0	0	0	111.6	K554	G532-K554 PolarHBondContact N-O 2.83Å; G532-K554 PolarHBondContact O-N 3.01Å
533	H	75	Confident	66.1	Low	9 Å²	9	78.7 Å²	78.7	4%	0.042	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	113.1	166.4	-172.5	-97.2	0	0	0	108.2	W219 A511 W531 W535	W219-H533 HydrophobicContact CE3-CB 4.29Å; W219-H533 AromaticContact CH2-CD2 3.6Å; W219-H533 AromaticContact CH2-CE1 3.23Å; W219-H533 WeakPolarHBondContact CH2-CE1 3.48Å; W219-H533 AromaticContact CH2-CG 3.77Å; W219-H533 AromaticContact CH2-ND1 3.56Å; W219-H533 AromaticContact CH2-NE2 3.28Å; W219-H533 VanDerWaalsContact CH2-NE2 3.28Å; W219-H533 WeakPolarHBondContact CH2-NE2 2.91Å; W219-H533 AromaticContact CZ2-CE1 3.81Å; W219-H533 AromaticContact CZ2-ND1 3.86Å; W219-H533 HydrophobicContact CZ3-CB 4.35Å; W219-H533 AromaticContact CZ3-CD2 3.29Å; W219-H533 WeakPolarHBondContact CZ3-CD2 3.35Å; W219-H533 AromaticContact CZ3-CE1 3.79Å; W219-H533 AromaticContact CZ3-CG 3.59Å; W219-H533 AromaticContact CZ3-ND1 3.89Å; W219-H533 AromaticContact CZ3-NE2 3.45Å; W219-H533 WeakPolarHBondContact CZ3-NE2 3.5Å; A511-H533 HydrophobicContact CB-CB 4.43Å; A511-H533 PolarHBondContact O-N 3.1Å; W531-H533 HydrophobicContact CH2-CB 3.83Å; W531-H533 HydrophobicContact CZ3-CB 3.94Å; H533-W535 AromaticContact CE1-CD2 3.59Å; H533-W535 AromaticContact CE1-CE2 3.36Å; H533-W535 AromaticContact CE1-CE3 3.92Å; H533-W535 AromaticContact CE1-CH2 3.84Å; H533-W535 AromaticContact CE1-CZ2 3.53Å; H533-W535 AromaticContact CE1-NE1 3.84Å; H533-W535 AromaticContact ND1-CD1 3.94Å; H533-W535 AromaticContact ND1-CD2 3.95Å; H533-W535 AromaticContact ND1-CE2 3.49Å; H533-W535 AromaticContact ND1-CZ2 3.89Å; H533-W535 AromaticContact ND1-NE1 3.47Å; H533-W535 PolarHBondContact ND1-NE1 3.24Å
534	V	62.2	Low	64.3	Low	73 Å²	73	82.6 Å²	82.6	44%	0.442	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	123.4	178	-176.2	0	0	0	0	108.7	R536	V534-R536 WeakPolarHBondContact CG1-O 2.83Å
535	W	53.4	Low	62.2	Low	76 Å²	76	85.6 Å²	85.6	29%	0.288	45%	0.445	S	S	.	.			trans	-85.1	109	165.5	-51.3	93.7	0	0	0	107.5	W219 Y502 H533 Y551	W219-W535 HydrophobicContact CH2-CH2 4.26Å; W219-W535 HydrophobicContact CH2-CZ2 4.06Å; W219-W535 HydrophobicContact CZ2-CH2 4.03Å; W219-W535 AromaticContact CZ2-CZ2 3.52Å; W219-W535 HydrophobicContact CZ2-CZ2 3.52Å; Y502-W535 HydrophobicContact CE2-CB 4.46Å; Y502-W535 AromaticContact CE2-CD1 3.89Å; Y502-W535 HydrophobicContact CE2-CG 4.44Å; H533-W535 AromaticContact CE1-CD2 3.59Å; H533-W535 AromaticContact CE1-CE2 3.36Å; H533-W535 AromaticContact CE1-CE3 3.92Å; H533-W535 AromaticContact CE1-CH2 3.84Å; H533-W535 AromaticContact CE1-CZ2 3.53Å; H533-W535 AromaticContact CE1-NE1 3.84Å; H533-W535 AromaticContact ND1-CD1 3.94Å; H533-W535 AromaticContact ND1-CD2 3.95Å; H533-W535 AromaticContact ND1-CE2 3.49Å; H533-W535 AromaticContact ND1-CZ2 3.89Å; H533-W535 AromaticContact ND1-NE1 3.47Å; H533-W535 PolarHBondContact ND1-NE1 3.24Å; W535-Y551 AromaticContact CE3-CD1 3.67Å; W535-Y551 HydrophobicContact CE3-CD1 3.67Å; W535-Y551 AromaticContact CE3-CE1 3.46Å; W535-Y551 HydrophobicContact CE3-CE1 3.46Å; W535-Y551 VanDerWaalsContact CE3-CE1 3.46Å; W535-Y551 AromaticContact CZ3-CD1 3.58Å; W535-Y551 HydrophobicContact CZ3-CD1 3.58Å; W535-Y551 AromaticContact CZ3-CE1 3.29Å; W535-Y551 HydrophobicContact CZ3-CE1 3.29Å
536	R	45.6	Very low	59.9	Low	162 Å²	162	92.3 Å²	92.3	61%	0.611	48%	0.477	S	S	*	.			trans	96	118.1	-179.7	-68.1	177.2	-94	-139.1	-3	117.1	V534	V534-R536 WeakPolarHBondContact CG1-O 2.83Å
537	D	37	Very low	57.3	Low	161 Å²	161	94.6 Å²	94.6	86%	0.861	49%	0.493	S	S	*	.				-125.3	122.4	106.4	-82.8	-40.6	0	0	0	107.7	E539	D537-E539 PolarHBondContact O-N 2Å
538	V	37.1	Very low	54.6	Low	101 Å²	101	98.2 Å²	98.2	61%	0.612	52%	0.515	S	S	*	.			trans	-75.8	110.2	164.6	178.8	0	0	0	0	104.8
539	E	34.4	Very low	52.1	Low	171 Å²	171	101.5 Å²	101.5	80%	0.799	54%	0.535	S	S	*	.			trans	-54.5	143.4	167.7	-86.1	-178.7	171.8	0	0	109.2	D537 F541	D537-E539 PolarHBondContact O-N 2Å; E539-F541 PolarHBondContact O-N 2.89Å
540	P	33.4	Very low	49.5	Very low	129 Å²	129	110.1 Å²	110.1	84%	0.838	57%	0.57	S	S	*	*			trans	-53	119.6	178.5	-19.8	29.8	0	0	0	109.8	N542	P540-N542 PolarHBondContact O-N 2.83Å; P540-N542 VanDerWaalsContact O-N 3.13Å
541	F	39	Very low	47.5	Very low	119 Å²	119	114.2 Å²	114.2	52%	0.522	58%	0.58	S	S	.	*			trans	-58.2	111.2	-172.5	-161.5	-101	0	0	0	111.3	E539 R543 S545	E539-F541 PolarHBondContact O-N 2.89Å; F541-R543 HydrophobicContact CD1-CG 4.31Å; F541-R543 HydrophobicContact CE1-CG 4.41Å; F541-S545 WeakPolarHBondContact CE2-O 2.95Å; F541-S545 WeakPolarHBondContact CZ-O 3.42Å
542	N	34.9	Very low	45.7	Very low	142 Å²	142	116.1 Å²	116.1	76%	0.759	60%	0.6	S	S	*	*			trans	-77.5	128.1	154.5	-127.1	-3.2	0	0	0	107.1	P540 T544	P540-N542 PolarHBondContact O-N 2.83Å; P540-N542 VanDerWaalsContact O-N 3.13Å; N542-T544 PolarHBondContact O-N 3.43Å
543	R	41.3	Very low	44.9	Very low	224 Å²	224	117.8 Å²	117.8	85%	0.845	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.1	17.3	-152.1	-118.3	-177.8	-152.5	-170.9	5.8	119.5	F541	F541-R543 HydrophobicContact CD1-CG 4.31Å; F541-R543 HydrophobicContact CE1-CG 4.41Å
544	T	46.4	Very low	45.1	Very low	136 Å²	136	123.2 Å²	123.2	83%	0.834	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-141.6	14.3	-166.5	49.9	0	0	0	0	116.8	N542	N542-T544 PolarHBondContact O-N 3.43Å
545	S	42.4	Very low	46.3	Very low	80 Å²	80	121.6 Å²	121.6	56%	0.559	62%	0.621	S	S	*	*	S	Bend	trans	-136.2	135.5	176.1	49.4	0	0	0	0	112.5	F541	F541-S545 WeakPolarHBondContact CE2-O 2.95Å; F541-S545 WeakPolarHBondContact CZ-O 3.42Å
546	H	41.7	Very low	48	Very low	174 Å²	174	125.2 Å²	125.2	81%	0.806	64%	0.635	S	S	*	*			trans	-50.3	139.3	174	-68.6	-75.7	0	0	0	110.3	V548	H546-V548 PolarHBondContact O-N 3.24Å
547	P	35.1	Very low	50.1	Low	88 Å²	88	118.5 Å²	118.5	57%	0.571	61%	0.611	S	S	*	*			trans	-63.2	107.7	-178.3	25	-32	0	0	0	110.1	V549	P547-V549 PolarHBondContact O-N 3.43Å
548	V	34.8	Very low	52.6	Low	129 Å²	129	113 Å²	113	78%	0.782	58%	0.582	S	S	*	*			trans	-80.3	103.8	169.6	-178.9	0	0	0	0	107.1	H546 K550	H546-V548 PolarHBondContact O-N 3.24Å; V548-K550 PolarHBondContact O-N 3.14Å
549	V	39.5	Very low	54.9	Low	72 Å²	72	112.7 Å²	112.7	44%	0.436	57%	0.569	S	S	.	*			trans	-65.8	103.3	170.4	-177.7	0	0	0	0	107.7	P547 Y551	P547-V549 PolarHBondContact O-N 3.43Å; V549-Y551 HydrophobicContact CB-CE1 4.29Å; V549-Y551 HydrophobicContact CB-CE2 4.27Å; V549-Y551 HydrophobicContact CG1-CD1 3.96Å; V549-Y551 HydrophobicContact CG1-CE1 3.43Å; V549-Y551 VanDerWaalsContact CG1-CE1 3.43Å; V549-Y551 HydrophobicContact CG1-CE2 4.19Å; V549-Y551 WeakPolarHBondContact O-CD2 3.17Å; V549-Y551 WeakPolarHBondContact O-CE2 3.11Å; V549-Y551 PolarHBondContact O-N 3.33Å
550	K	37.3	Very low	57.3	Low	189 Å²	189	113.1 Å²	113.1	82%	0.822	56%	0.564	S	S	*	*			trans	-80.1	104.4	171.5	-116.2	-179.2	-177.9	174.5	0	108.7	V548	V548-K550 PolarHBondContact O-N 3.14Å
551	Y	49.6	Very low	59.9	Low	145 Å²	145	112.2 Å²	112.2	57%	0.569	55%	0.546	S	S	*	.			trans	-73.7	125.6	169.2	-51.1	-77.8	0	0	0	108.5	W535 V549	W535-Y551 AromaticContact CE3-CD1 3.67Å; W535-Y551 HydrophobicContact CE3-CD1 3.67Å; W535-Y551 AromaticContact CE3-CE1 3.46Å; W535-Y551 HydrophobicContact CE3-CE1 3.46Å; W535-Y551 VanDerWaalsContact CE3-CE1 3.46Å; W535-Y551 AromaticContact CZ3-CD1 3.58Å; W535-Y551 HydrophobicContact CZ3-CD1 3.58Å; W535-Y551 AromaticContact CZ3-CE1 3.29Å; W535-Y551 HydrophobicContact CZ3-CE1 3.29Å; V549-Y551 HydrophobicContact CB-CE1 4.29Å; V549-Y551 HydrophobicContact CB-CE2 4.27Å; V549-Y551 HydrophobicContact CG1-CD1 3.96Å; V549-Y551 HydrophobicContact CG1-CE1 3.43Å; V549-Y551 VanDerWaalsContact CG1-CE1 3.43Å; V549-Y551 HydrophobicContact CG1-CE2 4.19Å; V549-Y551 WeakPolarHBondContact O-CD2 3.17Å; V549-Y551 WeakPolarHBondContact O-CE2 3.11Å; V549-Y551 PolarHBondContact O-N 3.33Å
552	G	55.4	Low	62.1	Low	43 Å²	43	106.5 Å²	106.5	44%	0.443	52%	0.522	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	118.1	177	0	0	0	0	0	110.9
553	S	68.1	Low	64.5	Low	50 Å²	50	101.1 Å²	101.1	35%	0.35	49%	0.493	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	141.4	162.5	60.4	0	0	0	0	109	D226	D226-S553 PolarHBondContact OD2-OG 3.3Å
554	K	77.6	Confident	66.3	Low	124 Å²	124	90.8 Å²	90.8	54%	0.539	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	97.2	178.4	-166.3	173.3	-171.6	171.4	0	110	G532 R556	G532-K554 PolarHBondContact N-O 2.83Å; G532-K554 PolarHBondContact O-N 3.01Å; K554-R556 HydrophobicContact CG-CG 4.49Å
555	L	88.3	Confident	67.3	Low	38 Å²	38	85.7 Å²	85.7	20%	0.199	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	126.6	170.8	-179.7	63.3	0	0	0	110.3	D226 I227 Y230 I515 W531 I557	D226-L555 HydrophobicContact CB-CD2 4.12Å; D226-L555 WeakPolarHBondContact O-CD2 3.3Å; I227-L555 HydrophobicContact CG1-CD1 4.19Å; I227-L555 HydrophobicContact CG1-CD2 4.19Å; Y230-L555 HydrophobicContact CD2-CD2 4.41Å; Y230-L555 HydrophobicContact CG-CD2 4.19Å; I515-L555 HydrophobicContact CD1-CD1 3.32Å; W531-L555 HydrophobicContact CB-CD1 4.27Å; L555-I557 HydrophobicContact CD1-CD1 4.05Å; L555-I557 HydrophobicContact CD1-CG1 3.92Å; L555-I557 HydrophobicContact CD2-CD1 4.02Å; L555-I557 HydrophobicContact CD2-CG1 4.49Å; L555-I557 HydrophobicContact CG-CD1 4.19Å; L555-I557 HydrophobicContact CG-CG1 4.12Å
556	R	89.8	Confident	68.3	Low	152 Å²	152	84.7 Å²	84.7	57%	0.574	41%	0.409	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-127.1	118.3	173.5	-73.5	179.4	156	176.4	-6.1	109.4	G529 T530 K554	G529-R556 CarbonylContact C-O 3.5Å; G529-R556 WeakPolarHBondContact CA-O 3.36Å; T530-R556 PolarHBondContact N-O 3.22Å; T530-R556 PolarHBondContact O-N 3.15Å; K554-R556 HydrophobicContact CG-CG 4.49Å
557	I	89.1	Confident	69.3	Low	21 Å²	21	86.4 Å²	86.4	11%	0.108	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	128	178.3	-65.1	179.3	0	0	0	109.5	I227 Y230 F231 I515 L555 R559 I562	I227-I557 HydrophobicContact CG1-CD1 4.41Å; Y230-I557 HydrophobicContact CD1-CD1 3.82Å; Y230-I557 HydrophobicContact CE1-CB 4.06Å; Y230-I557 HydrophobicContact CE1-CD1 4.06Å; Y230-I557 HydrophobicContact CE1-CG2 4.22Å; Y230-I557 HydrophobicContact CG-CD1 4.29Å; F231-I557 HydrophobicContact CE2-CD1 3.93Å; F231-I557 HydrophobicContact CZ-CD1 4.13Å; F231-I557 HydrophobicContact CZ-CG2 4.3Å; I515-I557 HydrophobicContact CD1-CG1 4.44Å; L555-I557 HydrophobicContact CD1-CD1 4.05Å; L555-I557 HydrophobicContact CD1-CG1 3.92Å; L555-I557 HydrophobicContact CD2-CD1 4.02Å; L555-I557 HydrophobicContact CD2-CG1 4.49Å; L555-I557 HydrophobicContact CG-CD1 4.19Å; L555-I557 HydrophobicContact CG-CG1 4.12Å; I557-R559 PolarHBondContact O-N 2.91Å; I557-I562 HydrophobicContact CG2-CD1 3.75Å
558	D	88.9	Confident	70.6	Confident	46 Å²	46	88.9 Å²	88.9	25%	0.246	41%	0.41	C	S	.	.			trans	-90.8	97	170	-173.3	-1.6	0	0	0	110.2	V528 R560 K561	V528-D558 PolarHBondContact O-N 2.86Å; D558-R560 PolarHBondContact O-N 3.39Å; D558-R560 VanDerWaalsContact O-N 3.07Å; D558-R560 WeakPolarHBondContact OD1-CB 3.18Å; D558-R560 PolarHBondContact OD1-N 2.72Å; D558-R560 IonicContact OD1-NE 2.79Å; D558-R560 PolarHBondContact OD1-NE 3.03Å; D558-K561 HydrophobicContact CB-CD 4.28Å; D558-K561 HydrophobicContact CB-CG 4.39Å; D558-K561 PolarHBondContact O-N 3.13Å; D558-K561 VanDerWaalsContact O-N 3.11Å; D558-K561 VanDerWaalsContact OD2-CE 3.3Å; D558-K561 WeakPolarHBondContact OD2-CE 3.44Å
559	R	86.3	Confident	71.7	Confident	94 Å²	94	86.6 Å²	86.6	36%	0.355	40%	0.4	S	S	.	.	G	3₁₀ helix	trans	-58.2	-23.8	-177.3	-67.6	-172.7	176.9	-158.5	-4.8	114.1	Y230 I557 K561 I562	Y230-R559 HydrophobicContact CE1-CG 4.42Å; Y230-R559 PolarHBondContact OH-NE 2.87Å; I557-R559 PolarHBondContact O-N 2.91Å; R559-K561 VanDerWaalsContact C-N 3.31Å; R559-K561 PolarHBondContact O-N 2.76Å; R559-I562 HydrophobicContact CB-CD1 4.42Å; R559-I562 HydrophobicContact CG-CD1 4.4Å; R559-I562 PolarHBondContact O-N 3.4Å
560	R	84.8	Confident	72.6	Confident	181 Å²	181	84.1 Å²	84.1	68%	0.683	39%	0.389	S	S	*	.	G	3₁₀ helix	trans	-73.9	-24	-178.6	-65.2	176.1	-73.4	-171.8	-5	112.9	D558	D558-R560 PolarHBondContact O-N 3.39Å; D558-R560 VanDerWaalsContact O-N 3.07Å; D558-R560 WeakPolarHBondContact OD1-CB 3.18Å; D558-R560 PolarHBondContact OD1-N 2.72Å; D558-R560 IonicContact OD1-NE 2.79Å; D558-R560 PolarHBondContact OD1-NE 3.03Å
561	K	87	Confident	73.5	Confident	109 Å²	109	78.9 Å²	78.9	47%	0.474	38%	0.376	S	S	.	.	G	3₁₀ helix	trans	-88	-7.2	179.3	-66.1	-177.9	-178.6	179.5	0	113.1	Q519 V528 D558 R559	Q519-K561 PolarHBondContact NE2-O 3.43Å; V528-K561 HydrophobicContact CG1-CB 4Å; D558-K561 HydrophobicContact CB-CD 4.28Å; D558-K561 HydrophobicContact CB-CG 4.39Å; D558-K561 PolarHBondContact O-N 3.13Å; D558-K561 VanDerWaalsContact O-N 3.11Å; D558-K561 VanDerWaalsContact OD2-CE 3.3Å; D558-K561 WeakPolarHBondContact OD2-CE 3.44Å; R559-K561 VanDerWaalsContact C-N 3.31Å; R559-K561 PolarHBondContact O-N 2.76Å
562	I	86.3	Confident	74.1	Confident	0 Å²	0	77.9 Å²	77.9	0%	0	39%	0.39	C	S	.	.	P	Polyproline II helix	trans	-79.4	126.6	-176.5	-57.7	170	0	0	0	109.7	F231 Y372 V528 I557 R559 W564	F231-I562 HydrophobicContact CE1-CD1 4.28Å; F231-I562 HydrophobicContact CZ-CD1 3.87Å; Y372-I562 WeakPolarHBondContact OH-CD1 3.38Å; Y372-I562 VanDerWaalsContact OH-CG2 3.27Å; Y372-I562 WeakPolarHBondContact OH-CG2 3.48Å; V528-I562 HydrophobicContact CB-CG1 4.23Å; V528-I562 HydrophobicContact CG1-CG1 4.22Å; I557-I562 HydrophobicContact CG2-CD1 3.75Å; R559-I562 HydrophobicContact CB-CD1 4.42Å; R559-I562 HydrophobicContact CG-CD1 4.4Å; R559-I562 PolarHBondContact O-N 3.4Å; I562-W564 HydrophobicContact CD1-CZ2 4.18Å; I562-W564 HydrophobicContact CG2-CD2 3.84Å; I562-W564 HydrophobicContact CG2-CE3 4.15Å; I562-W564 HydrophobicContact CG2-CG 4.41Å; I562-W564 HydrophobicContact CG2-CH2 4.11Å; I562-W564 HydrophobicContact CG2-CZ2 3.78Å; I562-W564 HydrophobicContact CG2-CZ3 4.27Å
563	L	84.4	Confident	74.8	Confident	29 Å²	29	79.7 Å²	79.7	15%	0.152	38%	0.384	C	S	.	.	B	Isolated β-bridge	trans	-96.6	116.1	165.7	-174.3	67.9	0	0	0	109	T369 G370 N517 Q519	T369-L563 HydrophobicContact CG2-CD2 3.76Å; G370-L563 WeakPolarHBondContact CA-O 3.22Å; N517-L563 PolarHBondContact OD1-N 2.84Å; N517-L563 PolarHBondContact OD1-O 3.17Å; Q519-L563 HydrophobicContact CB-CB 4.5Å; Q519-L563 HydrophobicContact CB-CD2 3.94Å; Q519-L563 HydrophobicContact CG-CB 3.82Å; Q519-L563 HydrophobicContact CG-CD2 4.16Å
564	W	79.6	Confident	75.2	Confident	6 Å²	6	79.4 Å²	79.4	2%	0.023	38%	0.38	C	S	.	.	P	Polyproline II helix	trans	-82.1	157.7	171.8	-58.6	107.7	0	0	0	111.2	F231 W233 V347 Y372 I562 N566 R567 K568 Y573 T574 P575	F231-W564 HydrophobicContact CD1-CH2 4.18Å; F231-W564 AromaticContact CE1-CH2 3.76Å; F231-W564 HydrophobicContact CE1-CH2 3.76Å; F231-W564 HydrophobicContact CE1-CZ2 4.01Å; F231-W564 HydrophobicContact CZ-CH2 4.01Å; F231-W564 HydrophobicContact CZ-CZ2 4.49Å; W233-W564 HydrophobicContact CZ2-CZ3 4.4Å; V347-W564 HydrophobicContact CG2-CE3 4.19Å; V347-W564 HydrophobicContact CG2-CZ3 3.87Å; Y372-W564 HydrophobicContact CE2-CZ3 4.34Å; I562-W564 HydrophobicContact CD1-CZ2 4.18Å; I562-W564 HydrophobicContact CG2-CD2 3.84Å; I562-W564 HydrophobicContact CG2-CE3 4.15Å; I562-W564 HydrophobicContact CG2-CG 4.41Å; I562-W564 HydrophobicContact CG2-CH2 4.11Å; I562-W564 HydrophobicContact CG2-CZ2 3.78Å; I562-W564 HydrophobicContact CG2-CZ3 4.27Å; W564-N566 PolarHBondContact O-N 2.69Å; W564-N566 VanDerWaalsContact O-N 3.11Å; W564-R567 PolarHBondContact O-N 3.04Å; W564-K568 PolarHBondContact N-O 3.27Å; W564-Y573 HydrophobicContact CB-CD1 3.85Å; W564-Y573 HydrophobicContact CB-CE1 4.3Å; W564-Y573 HydrophobicContact CD2-CD1 4.39Å; W564-Y573 AromaticContact CG-CD1 3.84Å; W564-Y573 HydrophobicContact CG-CD1 3.84Å; W564-Y573 PolarHBondContact NE1-O 2.94Å; W564-T574 HydrophobicContact CH2-CG2 4.49Å; W564-P575 HydrophobicContact CE3-CG 4.08Å; W564-P575 HydrophobicContact CZ3-CG 4.24Å
565	H	66.3	Low	75.3	Confident	29 Å²	29	73.7 Å²	73.7	13%	0.134	36%	0.356	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-26.6	-173.9	-162.6	75.9	0	0	0	114.2	F343 T369 R567	F343-H565 AromaticContact CD1-CD2 3.22Å; F343-H565 WeakPolarHBondContact CD1-CD2 3.47Å; F343-H565 AromaticContact CD1-NE2 2.88Å; F343-H565 WeakPolarHBondContact CD1-NE2 3.32Å; F343-H565 AromaticContact CE1-CD2 3.26Å; F343-H565 WeakPolarHBondContact CE1-CD2 3.29Å; F343-H565 AromaticContact CE1-NE2 2.82Å; F343-H565 WeakPolarHBondContact CE1-NE2 3.47Å; F343-H565 AromaticContact CG-CD2 3.61Å; F343-H565 AromaticContact CG-NE2 3.77Å; F343-H565 AromaticContact CZ-CD2 3.7Å; F343-H565 AromaticContact CZ-NE2 3.69Å; T369-H565 PolarHBondContact O-ND1 3.43Å; H565-R567 PolarHBondContact O-N 2.7Å
566	N	64.4	Low	75	Confident	60 Å²	60	75.7 Å²	75.7	32%	0.321	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.2	9.7	174.2	66.1	3.4	0	0	0	114	W564 K568 Y573	W564-N566 PolarHBondContact O-N 2.69Å; W564-N566 VanDerWaalsContact O-N 3.11Å; N566-K568 PolarHBondContact O-N 2.77Å; N566-K568 VanDerWaalsContact O-N 3.08Å; N566-K568 VanDerWaalsContact OD1-CB 3.23Å; N566-K568 WeakPolarHBondContact OD1-CB 3.47Å; N566-K568 PolarHBondContact OD1-N 3.36Å; N566-Y573 VanDerWaalsContact ND2-CD1 3.3Å; N566-Y573 WeakPolarHBondContact ND2-CD1 3.29Å; N566-Y573 WeakPolarHBondContact ND2-CE1 3.43Å
567	R	62.4	Low	74.9	Confident	210 Å²	210	68.5 Å²	68.5	79%	0.792	34%	0.342	S	S	*	.	S	Bend	trans	57.6	12.4	-173.4	-60.8	-172.3	176.9	-162	-0.8	114.5	W564 H565 S569	W564-R567 PolarHBondContact O-N 3.04Å; H565-R567 PolarHBondContact O-N 2.7Å; R567-S569 PolarHBondContact O-N 3.48Å
568	K	62.6	Low	74.8	Confident	139 Å²	139	69.8 Å²	69.8	60%	0.604	35%	0.347	S	S	*	.			trans	-83.6	111.4	169.6	-59.6	-172.2	178.5	-176.9	0	107.4	W564 N566	W564-K568 PolarHBondContact N-O 3.27Å; N566-K568 PolarHBondContact O-N 2.77Å; N566-K568 VanDerWaalsContact O-N 3.08Å; N566-K568 VanDerWaalsContact OD1-CB 3.23Å; N566-K568 WeakPolarHBondContact OD1-CB 3.47Å; N566-K568 PolarHBondContact OD1-N 3.36Å
569	S	58.2	Low	74.7	Confident	82 Å²	82	68.1 Å²	68.1	57%	0.573	34%	0.339	S	S	*	.	B	Isolated β-bridge	trans	-80.3	140.5	165.3	-176.3	0	0	0	0	108.8	R567	R567-S569 PolarHBondContact O-N 3.48Å
570	G	57.3	Low	74.7	Confident	20 Å²	20	64.4 Å²	64.4	21%	0.206	33%	0.328	C	S	.	.	S	Bend	trans	110.9	163.8	169.8	0	0	0	0	0	116.2	S572	G570-S572 PolarHBondContact O-N 3.04Å
571	S	56.2	Low	74.7	Confident	78 Å²	78	64 Å²	64	55%	0.545	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-3.7	-164.7	-44.2	0	0	0	0	117.2
572	S	62	Low	74.5	Confident	125 Å²	125	65.5 Å²	65.5	87%	0.874	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.6	-14	-169.1	-177	0	0	0	0	114.3	G570	G570-S572 PolarHBondContact O-N 3.04Å
573	Y	70.6	Confident	74.5	Confident	81 Å²	81	66.9 Å²	66.9	32%	0.318	35%	0.345	S	S	.	.			trans	-128.5	136.7	-177	-178.3	-107	0	0	0	110.7	W564 N566 P575	W564-Y573 HydrophobicContact CB-CD1 3.85Å; W564-Y573 HydrophobicContact CB-CE1 4.3Å; W564-Y573 HydrophobicContact CD2-CD1 4.39Å; W564-Y573 AromaticContact CG-CD1 3.84Å; W564-Y573 HydrophobicContact CG-CD1 3.84Å; W564-Y573 PolarHBondContact NE1-O 2.94Å; N566-Y573 VanDerWaalsContact ND2-CD1 3.3Å; N566-Y573 WeakPolarHBondContact ND2-CD1 3.29Å; N566-Y573 WeakPolarHBondContact ND2-CE1 3.43Å; Y573-P575 HydrophobicContact CE1-CG 3.76Å
574	T	77.1	Confident	74.4	Confident	44 Å²	44	67.2 Å²	67.2	27%	0.27	36%	0.356	S	S	.	.			trans	-143.7	123.5	169	-60	0	0	0	0	105.8	F231 W233 W564	F231-T574 HydrophobicContact CB-CG2 4.15Å; F231-T574 HydrophobicContact CD1-CG2 3.76Å; F231-T574 HydrophobicContact CG-CG2 4.33Å; W233-T574 HydrophobicContact CZ2-CG2 4.5Å; W564-T574 HydrophobicContact CH2-CG2 4.49Å
575	P	79.1	Confident	74.3	Confident	4 Å²	4	73 Å²	73	3%	0.026	39%	0.386	C	S	.	.			trans	-54.3	144.3	176.4	-30.2	39.5	0	0	0	111.3	W233 D346 V347 W564 Y573	W233-P575 PolarHBondContact NE1-O 3.11Å; D346-P575 HydrophobicContact CB-CB 3.87Å; D346-P575 HydrophobicContact CB-CG 3.91Å; V347-P575 HydrophobicContact CG2-CB 4.26Å; V347-P575 HydrophobicContact CG2-CG 3.69Å; W564-P575 HydrophobicContact CE3-CG 4.08Å; W564-P575 HydrophobicContact CZ3-CG 4.24Å; Y573-P575 HydrophobicContact CE1-CG 3.76Å
576	V	82.8	Confident	74.9	Confident	80 Å²	80	71.8 Å²	71.8	49%	0.485	38%	0.382	S	S	.	.			trans	-99.1	122.3	177.3	-177.7	0	0	0	0	108.1	T295 K578	T295-V576 PolarHBondContact OG1-O 3.48Å; V576-K578 HydrophobicContact CG1-CB 4.28Å; V576-K578 HydrophobicContact CG1-CD 4.37Å; V576-K578 HydrophobicContact CG1-CG 4.03Å
577	A	87	Confident	76	Confident	0 Å²	0	72.1 Å²	72.1	0%	0	38%	0.381	C	S	.	.			trans	-124.8	76	176.7	0	0	0	0	0	108.7	W233 S234 Y235 T295 V296	W233-A577 HydrophobicContact CB-CB 3.96Å; W233-A577 HydrophobicContact CG-CB 3.85Å; S234-A577 PolarHBondContact N-O 2.7Å; Y235-A577 PolarHBondContact N-O 2.9Å; T295-A577 WeakPolarHBondContact OG1-CB 3.2Å; V296-A577 HydrophobicContact CB-CB 4.14Å; V296-A577 HydrophobicContact CG2-CB 3.71Å
578	K	87.6	Confident	77.2	Confident	48 Å²	48	63.6 Å²	63.6	21%	0.209	35%	0.351	C	S	.	.			trans	-125.5	139.2	-178.8	-66.5	-170.2	174.7	-172.2	0	110.2	S234 V576 E582	S234-K578 WeakPolarHBondContact OG-CA 2.91Å; V576-K578 HydrophobicContact CG1-CB 4.28Å; V576-K578 HydrophobicContact CG1-CD 4.37Å; V576-K578 HydrophobicContact CG1-CG 4.03Å; K578-E582 IonicContact NZ-OE1 3.93Å
579	C	87.3	Confident	78.4	Confident	11 Å²	11	58.3 Å²	58.3	7%	0.074	33%	0.328	C	S	.	.	S	Bend	trans	-71.8	-44.9	175.1	-171.5	0	0	0	0	111.8	Y235 C597	Y235-C579 HydrophobicContact CD1-CB 4.17Å; Y235-C579 HydrophobicContact CD2-CB 3.74Å; Y235-C579 HydrophobicContact CE2-CB 4.25Å; Y235-C579 HydrophobicContact CG-CB 3.7Å; C579-C597 HydrophobicContact CB-CB 4.02Å; C579-C597 WeakPolarHBondContact CB-SG 3.42Å; C579-C597 WeakPolarHBondContact SG-CB 3.44Å; C579-C597 CovalentContact SG-SG 2.03Å; C579-C597 PolarHBondContact SG-SG 3.5Å
580	S	86.1	Confident	79.9	Confident	17 Å²	17	60.9 Å²	60.9	12%	0.119	33%	0.329	C	S	.	.	S	Bend	trans	-133.5	145.9	-177.7	-65.6	0	0	0	0	110.4	W598	S580-W598 WeakPolarHBondContact CB-O 3.18Å; S580-W598 PolarHBondContact OG-N 2.76Å; S580-W598 PolarHBondContact OG-O 3.48Å
581	Y	84.3	Confident	81.1	Confident	171 Å²	171	63.8 Å²	63.8	67%	0.671	34%	0.339	S	S	*	.	P	Polyproline II helix	trans	-84	162	173.9	-64	-81.4	0	0	0	110.7	C583 W598	Y581-C583 PolarHBondContact O-N 2.74Å; Y581-W598 PolarHBondContact O-NE1 2.86Å
582	E	83.8	Confident	82.2	Confident	142 Å²	142	65.1 Å²	65.1	66%	0.664	34%	0.337	S	S	*	.	P	Polyproline II helix	trans	-61.4	135.3	172.6	-74.2	160.1	-145.5	0	0	109.7	K578	K578-E582 IonicContact NZ-OE1 3.93Å
583	C	86.3	Confident	82.9	Confident	28 Å²	28	64.4 Å²	64.4	19%	0.189	34%	0.338	C	S	.	.	P	Polyproline II helix	trans	-72.3	148.3	-177.3	-63.9	0	0	0	0	111.3	Y581 E587 W598 C600	Y581-C583 PolarHBondContact O-N 2.74Å; C583-E587 HydrophobicContact CB-CB 3.95Å; C583-W598 VanDerWaalsContact SG-CD1 3.59Å; C583-C600 WeakPolarHBondContact CA-SG 3.49Å; C583-C600 HydrophobicContact CB-CB 3.69Å; C583-C600 WeakPolarHBondContact CB-SG 3.34Å; C583-C600 WeakPolarHBondContact SG-CA 3.32Å; C583-C600 WeakPolarHBondContact SG-CB 3.3Å; C583-C600 CovalentContact SG-SG 2.05Å; C583-C600 PolarHBondContact SG-SG 3.14Å
584	G	80.8	Confident	83.3	Confident	37 Å²	37	63.4 Å²	63.4	38%	0.381	34%	0.337	S	S	.	.	P	Polyproline II helix	trans	-67.9	172.4	178.8	0	0	0	0	0	112.3	G586 E587	G584-G586 PolarHBondContact O-N 3.48Å; G584-E587 PolarHBondContact N-OE2 3.5Å; G584-E587 PolarHBondContact O-N 3.11Å; G584-E587 VanDerWaalsContact O-N 3.15Å
585	I	78.6	Confident	83.4	Confident	127 Å²	127	69.8 Å²	69.8	65%	0.651	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	127.1	174.9	-61	176.9	0	0	0	109.3	N627	I585-N627 WeakPolarHBondContact CG2-O 3.14Å
586	G	77.9	Confident	83.7	Confident	4 Å²	4	69.7 Å²	69.7	4%	0.041	36%	0.36	C	S	.	.	T	Hydrogen-bonded Turn	trans	79.9	15.8	-178.2	0	0	0	0	0	114.9	G584 C603	G584-G586 PolarHBondContact O-N 3.48Å; G586-C603 WeakPolarHBondContact O-CB 3.43Å; G586-C603 PolarHBondContact O-N 3.15Å
587	E	87.7	Confident	83.9	Confident	67 Å²	67	66.1 Å²	66.1	31%	0.313	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	139.9	174.1	-59.5	-177.9	146.4	0	0	111.2	C583 G584 C600 V601 P602 L609	C583-E587 HydrophobicContact CB-CB 3.95Å; G584-E587 PolarHBondContact N-OE2 3.5Å; G584-E587 PolarHBondContact O-N 3.11Å; G584-E587 VanDerWaalsContact O-N 3.15Å; E587-C600 HydrophobicContact CB-CB 4.17Å; E587-C600 WeakPolarHBondContact OE2-CB 3.23Å; E587-V601 CarbonylContact C-O 3.59Å; E587-V601 VanDerWaalsContact CA-O 3.27Å; E587-V601 WeakPolarHBondContact CA-O 3.03Å; E587-P602 HydrophobicContact CG-CB 4.44Å; E587-L609 WeakPolarHBondContact O-CD1 3.47Å
588	I	88.4	Confident	84	Confident	30 Å²	30	68.1 Å²	68.1	15%	0.154	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	148.9	173.7	55.4	167.9	0	0	0	111.6	K590 C600 V601 L609 C615	I588-K590 PolarHBondContact O-N 2.58Å; I588-C600 WeakPolarHBondContact O-CA 3.47Å; I588-V601 HydrophobicContact CG1-CB 4.06Å; I588-V601 WeakPolarHBondContact CG1-O 3.4Å; I588-V601 PolarHBondContact N-O 3.4Å; I588-V601 PolarHBondContact O-N 3.47Å; I588-L609 HydrophobicContact CB-CD1 4.47Å; I588-L609 HydrophobicContact CG2-CD1 3.38Å; I588-C615 WeakPolarHBondContact CG2-SG 3.49Å
589	K	87.8	Confident	84.1	Confident	29 Å²	29	68.6 Å²	68.6	13%	0.126	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	112	168.7	-60.9	-179.6	-174.8	169.3	0	109.1	W598 E612 Y613	K589-W598 HydrophobicContact CB-CB 3.99Å; K589-W598 HydrophobicContact CB-CD2 4.43Å; K589-W598 HydrophobicContact CB-CG 3.84Å; K589-W598 HydrophobicContact CD-CD2 3.99Å; K589-W598 HydrophobicContact CD-CE3 4.5Å; K589-W598 HydrophobicContact CD-CG 4.23Å; K589-W598 HydrophobicContact CD-CZ2 4.35Å; K589-W598 HydrophobicContact CG-CD2 4.22Å; K589-W598 HydrophobicContact CG-CG 3.94Å; K589-E612 WeakPolarHBondContact CB-O 3.37Å; K589-E612 HydrophobicContact CD-CB 4.15Å; K589-E612 WeakPolarHBondContact CE-OE2 3.44Å; K589-E612 HydrophobicContact CG-CB 4.48Å; K589-E612 PolarHBondContact N-O 2.97Å; K589-E612 IonicContact NZ-OE1 3.14Å; K589-E612 PolarHBondContact NZ-OE1 3.41Å; K589-E612 IonicContact NZ-OE2 2.61Å; K589-E612 PolarHBondContact NZ-OE2 3.06Å; K589-Y613 HydrophobicContact CB-CD1 4.03Å; K589-Y613 HydrophobicContact CB-CE1 3.96Å; K589-Y613 HydrophobicContact CD-CE1 4.45Å; K589-Y613 WeakPolarHBondContact O-CD1 3.36Å
590	K	88.8	Confident	84.3	Confident	135 Å²	135	70.3 Å²	70.3	59%	0.587	37%	0.365	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.6	104.5	167.7	-172.3	172.7	-175.7	173.7	0	109.3	I588 W598 T599 V601	I588-K590 PolarHBondContact O-N 2.58Å; K590-W598 CarbonylContact O-C 3.54Å; K590-W598 WeakPolarHBondContact O-CA 3.46Å; K590-W598 WeakPolarHBondContact O-CB 3.3Å; K590-T599 PolarHBondContact N-O 3.3Å; K590-T599 PolarHBondContact O-N 3.08Å; K590-T599 PolarHBondContact O-OG1 3.1Å; K590-V601 HydrophobicContact CB-CG2 3.95Å; K590-V601 HydrophobicContact CD-CG2 4.1Å
591	I	82.7	Confident	84.4	Confident	81 Å²	81	71.9 Å²	71.9	42%	0.415	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.3	135	-178.9	-54.1	176.8	0	0	0	109.5	Y613	I591-Y613 HydrophobicContact CD1-CD1 4.27Å; I591-Y613 HydrophobicContact CD1-CE1 3.72Å; I591-Y613 HydrophobicContact CG1-CD1 4.26Å; I591-Y613 HydrophobicContact CG1-CE1 3.84Å
592	Q	79.1	Confident	84.7	Confident	107 Å²	107	68 Å²	68	50%	0.5	37%	0.37	S	S	.	.			trans	-87.5	-145.5	173.8	-62.4	-169.2	-37.2	0	0	110.3	M594 C597 T599	Q592-M594 VanDerWaalsContact C-N 3.31Å; Q592-M594 PolarHBondContact O-N 2.81Å; Q592-C597 HydrophobicContact CB-CB 4.41Å; Q592-C597 WeakPolarHBondContact CB-O 3.19Å; Q592-C597 PolarHBondContact N-O 2.94Å; Q592-T599 HydrophobicContact CG-CG2 4.22Å; Q592-T599 VanDerWaalsContact NE2-CG2 3.26Å
593	A	77.9	Confident	84.8	Confident	110 Å²	110	61.7 Å²	61.7	91%	0.909	34%	0.341	S	S	*	.	S	Bend	trans	-68.1	-27.6	177.5	0	0	0	0	0	113.4
594	M	77.5	Confident	84.8	Confident	60 Å²	60	66.9 Å²	66.9	30%	0.296	36%	0.36	S	S	.	.	S	Bend	trans	-114.4	141.6	-178.1	-59.7	177.9	77.6	0	0	111.1	Y235 C264 I265 Q592 C596 C597	Y235-M594 HydrophobicContact CE2-CE 4.27Å; Y235-M594 HydrophobicContact CE2-SD 4Å; C264-M594 HydrophobicContact CB-CE 3.54Å; I265-M594 WeakPolarHBondContact O-CE 3.48Å; Q592-M594 VanDerWaalsContact C-N 3.31Å; Q592-M594 PolarHBondContact O-N 2.81Å; M594-C596 VanDerWaalsContact C-N 3.31Å; M594-C596 PolarHBondContact O-N 3.39Å; M594-C597 HydrophobicContact CB-CB 4.25Å; M594-C597 PolarHBondContact O-N 2.81Å; M594-C597 VanDerWaalsContact O-O 3.12Å
595	K	79	Confident	84.9	Confident	177 Å²	177	71.2 Å²	71.2	77%	0.77	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-36.1	-175.1	-67.4	-177.6	179.5	178.5	0	114.2	C597	K595-C597 VanDerWaalsContact C-N 3.33Å
596	C	86.2	Confident	85.1	Confident	2 Å²	2	67.7 Å²	67.7	1%	0.014	35%	0.353	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.6	-7.4	178.5	63.6	0	0	0	0	114.6	C264 M594 W598	C264-C596 HydrophobicContact CB-CB 3.95Å; C264-C596 WeakPolarHBondContact CB-SG 3.33Å; C264-C596 WeakPolarHBondContact SG-CB 3.45Å; C264-C596 CovalentContact SG-SG 2Å; C264-C596 PolarHBondContact SG-SG 3.05Å; M594-C596 VanDerWaalsContact C-N 3.31Å; M594-C596 PolarHBondContact O-N 3.39Å; C596-W598 VanDerWaalsContact O-CZ3 3.23Å; C596-W598 WeakPolarHBondContact O-CZ3 3.23Å
597	C	87.3	Confident	85.6	Confident	5 Å²	5	68.7 Å²	68.7	3%	0.034	36%	0.357	C	S	.	.			trans	-110.4	113.3	-175.8	-65.8	0	0	0	0	108.9	C579 Q592 M594 K595	C579-C597 HydrophobicContact CB-CB 4.02Å; C579-C597 WeakPolarHBondContact CB-SG 3.42Å; C579-C597 WeakPolarHBondContact SG-CB 3.44Å; C579-C597 CovalentContact SG-SG 2.03Å; C579-C597 PolarHBondContact SG-SG 3.5Å; Q592-C597 HydrophobicContact CB-CB 4.41Å; Q592-C597 WeakPolarHBondContact CB-O 3.19Å; Q592-C597 PolarHBondContact N-O 2.94Å; M594-C597 HydrophobicContact CB-CB 4.25Å; M594-C597 PolarHBondContact O-N 2.81Å; M594-C597 VanDerWaalsContact O-O 3.12Å; K595-C597 VanDerWaalsContact C-N 3.33Å
598	W	88.7	Confident	85.3	Confident	43 Å²	43	65.7 Å²	65.7	16%	0.163	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	155.9	175.7	56.3	82.3	0	0	0	112.1	S580 Y581 C583 K589 K590 C596	S580-W598 WeakPolarHBondContact CB-O 3.18Å; S580-W598 PolarHBondContact OG-N 2.76Å; S580-W598 PolarHBondContact OG-O 3.48Å; Y581-W598 PolarHBondContact O-NE1 2.86Å; C583-W598 VanDerWaalsContact SG-CD1 3.59Å; K589-W598 HydrophobicContact CB-CB 3.99Å; K589-W598 HydrophobicContact CB-CD2 4.43Å; K589-W598 HydrophobicContact CB-CG 3.84Å; K589-W598 HydrophobicContact CD-CD2 3.99Å; K589-W598 HydrophobicContact CD-CE3 4.5Å; K589-W598 HydrophobicContact CD-CG 4.23Å; K589-W598 HydrophobicContact CD-CZ2 4.35Å; K589-W598 HydrophobicContact CG-CD2 4.22Å; K589-W598 HydrophobicContact CG-CG 3.94Å; K590-W598 CarbonylContact O-C 3.54Å; K590-W598 WeakPolarHBondContact O-CA 3.46Å; K590-W598 WeakPolarHBondContact O-CB 3.3Å; C596-W598 VanDerWaalsContact O-CZ3 3.23Å; C596-W598 WeakPolarHBondContact O-CZ3 3.23Å
599	T	89.5	Confident	85.1	Confident	58 Å²	58	66 Å²	66	36%	0.356	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	138.6	167.1	52.1	0	0	0	0	109.1	K590 Q592	K590-T599 PolarHBondContact N-O 3.3Å; K590-T599 PolarHBondContact O-N 3.08Å; K590-T599 PolarHBondContact O-OG1 3.1Å; Q592-T599 HydrophobicContact CG-CG2 4.22Å; Q592-T599 VanDerWaalsContact NE2-CG2 3.26Å
600	C	90.9	Very high	84.7	Confident	46 Å²	46	68.1 Å²	68.1	31%	0.311	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	123.4	175.4	-56.5	0	0	0	0	109.3	C583 E587 I588	C583-C600 WeakPolarHBondContact CA-SG 3.49Å; C583-C600 HydrophobicContact CB-CB 3.69Å; C583-C600 WeakPolarHBondContact CB-SG 3.34Å; C583-C600 WeakPolarHBondContact SG-CA 3.32Å; C583-C600 WeakPolarHBondContact SG-CB 3.3Å; C583-C600 CovalentContact SG-SG 2.05Å; C583-C600 PolarHBondContact SG-SG 3.14Å; E587-C600 HydrophobicContact CB-CB 4.17Å; E587-C600 WeakPolarHBondContact OE2-CB 3.23Å; I588-C600 WeakPolarHBondContact O-CA 3.47Å
601	V	90.2	Very high	84.2	Confident	51 Å²	51	65.3 Å²	65.3	31%	0.309	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	125.1	179.7	-178.5	0	0	0	0	108.1	E587 I588 K590	E587-V601 CarbonylContact C-O 3.59Å; E587-V601 VanDerWaalsContact CA-O 3.27Å; E587-V601 WeakPolarHBondContact CA-O 3.03Å; I588-V601 HydrophobicContact CG1-CB 4.06Å; I588-V601 WeakPolarHBondContact CG1-O 3.4Å; I588-V601 PolarHBondContact N-O 3.4Å; I588-V601 PolarHBondContact O-N 3.47Å; K590-V601 HydrophobicContact CB-CG2 3.95Å; K590-V601 HydrophobicContact CD-CG2 4.1Å
602	P	89.2	Confident	84.2	Confident	90 Å²	90	66.1 Å²	66.1	58%	0.584	35%	0.35	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69	138.5	-179.9	28.6	-34.6	0	0	0	111.4	E587	E587-P602 HydrophobicContact CG-CB 4.44Å
603	C	87.3	Confident	84.5	Confident	8 Å²	8	66.8 Å²	66.8	5%	0.054	35%	0.349	C	S	.	.	P	Polyproline II helix	trans	-69.6	153.6	167.7	-60.4	0	0	0	0	110.8	G586 E607 C615 R628	G586-C603 WeakPolarHBondContact O-CB 3.43Å; G586-C603 PolarHBondContact O-N 3.15Å; C603-E607 HydrophobicContact CB-CB 4.03Å; C603-C615 VanDerWaalsContact CA-SG 3.5Å; C603-C615 HydrophobicContact CB-CB 3.76Å; C603-C615 WeakPolarHBondContact CB-SG 3.27Å; C603-C615 WeakPolarHBondContact SG-CB 3.02Å; C603-C615 CovalentContact SG-SG 2.03Å; C603-C615 PolarHBondContact SG-SG 2.85Å; C603-R628 PolarHBondContact O-NH1 3.4Å
604	F	86.1	Confident	84.9	Confident	137 Å²	137	67.7 Å²	67.7	60%	0.601	33%	0.332	S	S	*	.	P	Polyproline II helix	trans	-64	161.3	173.8	-69.3	-76.3	0	0	0	111.8	N606 E607 R628	F604-N606 WeakPolarHBondContact CB-OD1 3.49Å; F604-N606 PolarHBondContact O-N 3.08Å; F604-E607 HydrophobicContact CB-CB 4.49Å; F604-E607 HydrophobicContact CB-CG 4Å; F604-E607 WeakPolarHBondContact CD2-OE2 3.48Å; F604-E607 PolarHBondContact N-OE2 2.9Å; F604-E607 WeakPolarHBondContact O-CB 3.24Å; F604-E607 PolarHBondContact O-N 2.94Å; F604-R628 PolarHBondContact O-NH1 3.33Å
605	E	82.7	Confident	85.4	Confident	128 Å²	128	65.8 Å²	65.8	60%	0.598	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-25	-173.9	-61.5	-172.6	170.8	0	0	114.3	E607 W623 P624	E605-E607 VanDerWaalsContact C-N 3.34Å; E605-W623 HydrophobicContact CB-CH2 4.36Å; E605-W623 HydrophobicContact CB-CZ2 3.86Å; E605-W623 WeakPolarHBondContact O-CZ2 3.46Å; E605-P624 WeakPolarHBondContact O-CG 3.36Å
606	N	83	Confident	85.7	Confident	54 Å²	54	61.1 Å²	61.1	29%	0.289	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91	5.3	176.1	64.7	-49.4	0	0	0	113	F604 C618 W623	F604-N606 WeakPolarHBondContact CB-OD1 3.49Å; F604-N606 PolarHBondContact O-N 3.08Å; N606-C618 PolarHBondContact O-N 3.4Å; N606-W623 HydrophobicContact CB-CH2 4.12Å; N606-W623 HydrophobicContact CB-CZ3 4.02Å
607	E	86.5	Confident	85.7	Confident	24 Å²	24	66.7 Å²	66.7	11%	0.112	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	152.2	-177.9	-67.6	178.4	156.3	0	0	112.4	C603 F604 E605 C615 K616 E617	C603-E607 HydrophobicContact CB-CB 4.03Å; F604-E607 HydrophobicContact CB-CB 4.49Å; F604-E607 HydrophobicContact CB-CG 4Å; F604-E607 WeakPolarHBondContact CD2-OE2 3.48Å; F604-E607 PolarHBondContact N-OE2 2.9Å; F604-E607 WeakPolarHBondContact O-CB 3.24Å; F604-E607 PolarHBondContact O-N 2.94Å; E605-E607 VanDerWaalsContact C-N 3.34Å; E607-C615 HydrophobicContact CB-CB 4.06Å; E607-C615 HydrophobicContact CG-CB 4.4Å; E607-C615 VanDerWaalsContact OE2-CB 3.27Å; E607-C615 WeakPolarHBondContact OE2-CB 3.35Å; E607-K616 CarbonylContact C-O 3.54Å; E607-K616 WeakPolarHBondContact CA-O 3.04Å; E607-E617 HydrophobicContact CG-CB 4.39Å; E607-E617 HydrophobicContact CG-CG 3.67Å
608	Y	82.2	Confident	85.5	Confident	4 Å²	4	67.2 Å²	67.2	2%	0.016	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	159.9	170.2	69	-81.3	0	0	0	111.1	L610 C615 K616 L657 A660	Y608-L610 PolarHBondContact O-N 3.07Å; Y608-C615 CarbonylContact O-C 3.48Å; Y608-C615 WeakPolarHBondContact O-CA 3.44Å; Y608-K616 HydrophobicContact CD1-CB 4.42Å; Y608-K616 WeakPolarHBondContact CD1-O 3.41Å; Y608-K616 HydrophobicContact CE1-CB 3.94Å; Y608-K616 HydrophobicContact CE1-CD 4.19Å; Y608-K616 HydrophobicContact CE1-CG 3.96Å; Y608-K616 PolarHBondContact N-O 2.77Å; Y608-K616 PolarHBondContact O-N 3.5Å; Y608-K616 WeakPolarHBondContact OH-CD 3.1Å; Y608-K616 PolarHBondContact OH-NZ 2.85Å; Y608-L657 PolarHBondContact OH-O 3.23Å; Y608-A660 HydrophobicContact CD1-CB 4.39Å; Y608-A660 HydrophobicContact CD2-CB 3.58Å; Y608-A660 HydrophobicContact CE2-CB 3.72Å; Y608-A660 HydrophobicContact CG-CB 3.91Å
609	L	83.8	Confident	85.1	Confident	36 Å²	36	68.8 Å²	68.8	19%	0.188	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	110.2	179.2	-161.7	78.6	0	0	0	109.8	E587 I588 N611 R628 G630	E587-L609 WeakPolarHBondContact O-CD1 3.47Å; I588-L609 HydrophobicContact CB-CD1 4.47Å; I588-L609 HydrophobicContact CG2-CD1 3.38Å; L609-N611 WeakPolarHBondContact CD1-O 3.46Å; L609-N611 WeakPolarHBondContact CG-O 3.42Å; L609-R628 WeakPolarHBondContact CB-O 3.2Å; L609-R628 PolarHBondContact N-O 3.47Å; L609-G630 PolarHBondContact O-N 3.24Å
610	L	79.8	Confident	84.6	Confident	75 Å²	75	71.6 Å²	71.6	39%	0.393	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	-45.7	175.5	-179.2	68.8	0	0	0	110.6	Y608 K614 K616 L657	Y608-L610 PolarHBondContact O-N 3.07Å; L610-K614 WeakPolarHBondContact CB-O 3.27Å; L610-K614 PolarHBondContact N-O 3.43Å; L610-K614 VanDerWaalsContact N-O 3.07Å; L610-K616 HydrophobicContact CB-CB 4.15Å; L610-K616 HydrophobicContact CD1-CD 4.33Å; L610-L657 HydrophobicContact CD1-CD2 4.1Å
611	N	79.2	Confident	83.7	Confident	76 Å²	76	70.3 Å²	70.3	41%	0.406	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	178.1	172.5	64.8	24.7	0	0	0	109.1	L609 Y613 K614	L609-N611 WeakPolarHBondContact CD1-O 3.46Å; L609-N611 WeakPolarHBondContact CG-O 3.42Å; N611-Y613 PolarHBondContact O-N 3.26Å; N611-Y613 WeakPolarHBondContact OD1-CA 3.23Å; N611-Y613 PolarHBondContact OD1-N 3.46Å; N611-K614 PolarHBondContact N-O 2.05Å; N611-K614 PolarHBondContact O-N 2.96Å; N611-K614 WeakPolarHBondContact OD1-CB 3.42Å; N611-K614 PolarHBondContact OD1-N 2.87Å
612	E	81.4	Confident	83.2	Confident	98 Å²	98	68.4 Å²	68.4	46%	0.458	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-10.2	-178.3	-58.1	-169.1	140.6	0	0	114.5	K589	K589-E612 WeakPolarHBondContact CB-O 3.37Å; K589-E612 HydrophobicContact CD-CB 4.15Å; K589-E612 WeakPolarHBondContact CE-OE2 3.44Å; K589-E612 HydrophobicContact CG-CB 4.48Å; K589-E612 PolarHBondContact N-O 2.97Å; K589-E612 IonicContact NZ-OE1 3.14Å; K589-E612 PolarHBondContact NZ-OE1 3.41Å; K589-E612 IonicContact NZ-OE2 2.61Å; K589-E612 PolarHBondContact NZ-OE2 3.06Å
613	Y	85.6	Confident	82.8	Confident	120 Å²	120	65.8 Å²	65.8	47%	0.471	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-119.8	-7.8	-173.7	-56.9	-78.1	0	0	0	114	K589 I591 N611	K589-Y613 HydrophobicContact CB-CD1 4.03Å; K589-Y613 HydrophobicContact CB-CE1 3.96Å; K589-Y613 HydrophobicContact CD-CE1 4.45Å; K589-Y613 WeakPolarHBondContact O-CD1 3.36Å; I591-Y613 HydrophobicContact CD1-CD1 4.27Å; I591-Y613 HydrophobicContact CD1-CE1 3.72Å; I591-Y613 HydrophobicContact CG1-CD1 4.26Å; I591-Y613 HydrophobicContact CG1-CE1 3.84Å; N611-Y613 PolarHBondContact O-N 3.26Å; N611-Y613 WeakPolarHBondContact OD1-CA 3.23Å; N611-Y613 PolarHBondContact OD1-N 3.46Å
614	K	86.7	Confident	82.5	Confident	129 Å²	129	65.7 Å²	65.7	56%	0.561	33%	0.33	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-148.1	132.3	-170.8	-168.9	172.5	-178.4	179.8	0	112.6	L610 N611	L610-K614 WeakPolarHBondContact CB-O 3.27Å; L610-K614 PolarHBondContact N-O 3.43Å; L610-K614 VanDerWaalsContact N-O 3.07Å; N611-K614 PolarHBondContact N-O 2.05Å; N611-K614 PolarHBondContact O-N 2.96Å; N611-K614 WeakPolarHBondContact OD1-CB 3.42Å; N611-K614 PolarHBondContact OD1-N 2.87Å
615	C	88.4	Confident	82	Confident	21 Å²	21	62.2 Å²	62.2	14%	0.142	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	153.5	169.1	-47.4	0	0	0	0	110.2	I588 C603 E607 Y608	I588-C615 WeakPolarHBondContact CG2-SG 3.49Å; C603-C615 VanDerWaalsContact CA-SG 3.5Å; C603-C615 HydrophobicContact CB-CB 3.76Å; C603-C615 WeakPolarHBondContact CB-SG 3.27Å; C603-C615 WeakPolarHBondContact SG-CB 3.02Å; C603-C615 CovalentContact SG-SG 2.03Å; C603-C615 PolarHBondContact SG-SG 2.85Å; E607-C615 HydrophobicContact CB-CB 4.06Å; E607-C615 HydrophobicContact CG-CB 4.4Å; E607-C615 VanDerWaalsContact OE2-CB 3.27Å; E607-C615 WeakPolarHBondContact OE2-CB 3.35Å; Y608-C615 CarbonylContact O-C 3.48Å; Y608-C615 WeakPolarHBondContact O-CA 3.44Å
616	K	85.5	Confident	81.5	Confident	79 Å²	79	65 Å²	65	34%	0.343	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	136.9	174.3	-178.6	174.9	167.6	-151.2	0	110.1	E607 Y608 L610	E607-K616 CarbonylContact C-O 3.54Å; E607-K616 WeakPolarHBondContact CA-O 3.04Å; Y608-K616 HydrophobicContact CD1-CB 4.42Å; Y608-K616 WeakPolarHBondContact CD1-O 3.41Å; Y608-K616 HydrophobicContact CE1-CB 3.94Å; Y608-K616 HydrophobicContact CE1-CD 4.19Å; Y608-K616 HydrophobicContact CE1-CG 3.96Å; Y608-K616 PolarHBondContact N-O 2.77Å; Y608-K616 PolarHBondContact O-N 3.5Å; Y608-K616 WeakPolarHBondContact OH-CD 3.1Å; Y608-K616 PolarHBondContact OH-NZ 2.85Å; L610-K616 HydrophobicContact CB-CB 4.15Å; L610-K616 HydrophobicContact CD1-CD 4.33Å
617	E	86	Confident	80.9	Confident	118 Å²	118	65.9 Å²	65.9	55%	0.551	34%	0.335	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.5	142	178	-62.5	-178.7	171	0	0	111.6	E607	E607-E617 HydrophobicContact CG-CB 4.39Å; E607-E617 HydrophobicContact CG-CG 3.67Å
618	C	82.7	Confident	80	Confident	16 Å²	16	67.9 Å²	67.9	11%	0.108	34%	0.341	C	S	.	.	P	Polyproline II helix	trans	-73.1	155	165.9	-68.3	0	0	0	0	110.8	N606 P624 C661	N606-C618 PolarHBondContact O-N 3.4Å; C618-P624 VanDerWaalsContact SG-CD 3.57Å; C618-P624 VanDerWaalsContact SG-N 3.4Å; C618-C661 HydrophobicContact CB-CB 3.92Å; C618-C661 WeakPolarHBondContact CB-SG 3.49Å; C618-C661 WeakPolarHBondContact SG-CB 3.44Å; C618-C661 CovalentContact SG-SG 2.05Å; C618-C661 PolarHBondContact SG-SG 3.25Å
619	S	80	Confident	79.2	Confident	76 Å²	76	70 Å²	70	53%	0.531	36%	0.355	S	S	.	.	P	Polyproline II helix	trans	-68.4	154.4	176.8	56.5	0	0	0	0	111.9	G621 S622	S619-G621 PolarHBondContact O-N 3.32Å; S619-S622 PolarHBondContact N-OG 3.09Å; S619-S622 PolarHBondContact O-N 3.49Å; S619-S622 PolarHBondContact O-OG 3.41Å; S619-S622 PolarHBondContact OG-OG 2.73Å
620	V	78.4	Confident	77.9	Confident	118 Å²	118	69.9 Å²	69.9	72%	0.715	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.9	129.3	179.5	-176.3	0	0	0	0	110	H818	V620-H818 HydrophobicContact CG1-CB 3.91Å; V620-H818 VanDerWaalsContact CG1-CD2 3.44Å; V620-H818 WeakPolarHBondContact CG1-CD2 3.41Å; V620-H818 VanDerWaalsContact CG1-CG 3.49Å
621	G	73.7	Confident	76.6	Confident	19 Å²	19	74.6 Å²	74.6	20%	0.196	38%	0.379	C	S	.	.	T	Hydrogen-bonded Turn	trans	87.8	3.4	-174.8	0	0	0	0	0	115	S619 L664	S619-G621 PolarHBondContact O-N 3.32Å; G621-L664 WeakPolarHBondContact O-CB 3.35Å; G621-L664 PolarHBondContact O-N 3.46Å
622	S	80.1	Confident	75.2	Confident	11 Å²	11	75.8 Å²	75.8	8%	0.077	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	161.3	173	65.5	0	0	0	0	112.2	S619 Y662	S619-S622 PolarHBondContact N-OG 3.09Å; S619-S622 PolarHBondContact O-N 3.49Å; S619-S622 PolarHBondContact O-OG 3.41Å; S619-S622 PolarHBondContact OG-OG 2.73Å; S622-Y662 CarbonylContact C-O 3.56Å; S622-Y662 WeakPolarHBondContact CA-O 3.36Å; S622-Y662 WeakPolarHBondContact CB-O 3.47Å
623	W	80.6	Confident	73.3	Confident	34 Å²	34	77.2 Å²	77.2	13%	0.129	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	145	-173.2	-155.1	-97.1	0	0	0	111.9	E605 N606 C661 Y662 L664 R822	E605-W623 HydrophobicContact CB-CH2 4.36Å; E605-W623 HydrophobicContact CB-CZ2 3.86Å; E605-W623 WeakPolarHBondContact O-CZ2 3.46Å; N606-W623 HydrophobicContact CB-CH2 4.12Å; N606-W623 HydrophobicContact CB-CZ3 4.02Å; W623-C661 CarbonylContact O-C 3.6Å; W623-C661 VanDerWaalsContact O-CA 3.26Å; W623-C661 WeakPolarHBondContact O-CA 3.37Å; W623-Y662 HydrophobicContact CB-CD1 4.49Å; W623-Y662 HydrophobicContact CB-CE1 3.92Å; W623-Y662 HydrophobicContact CB-CE2 4.38Å; W623-Y662 HydrophobicContact CG-CE1 4.49Å; W623-Y662 PolarHBondContact N-O 2.69Å; W623-Y662 WeakPolarHBondContact O-CD1 3.4Å; W623-Y662 PolarHBondContact O-N 3.02Å; W623-L664 HydrophobicContact CB-CD2 4.02Å; W623-L664 HydrophobicContact CB-CG 4.33Å; W623-R822 HydrophobicContact CD2-CG 3.74Å; W623-R822 HydrophobicContact CE3-CG 3.82Å; W623-R822 HydrophobicContact CH2-CG 3.57Å; W623-R822 HydrophobicContact CZ2-CG 3.49Å; W623-R822 VanDerWaalsContact CZ2-CG 3.49Å; W623-R822 HydrophobicContact CZ3-CG 3.74Å
624	P	80.2	Confident	71.2	Confident	7 Å²	7	77.1 Å²	77.1	5%	0.045	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	149.8	-179.1	27.3	-35.3	0	0	0	112.6	E605 C618 A660	E605-P624 WeakPolarHBondContact O-CG 3.36Å; C618-P624 VanDerWaalsContact SG-CD 3.57Å; C618-P624 VanDerWaalsContact SG-N 3.4Å; P624-A660 WeakPolarHBondContact CA-O 3.49Å
625	I	76.5	Confident	68.8	Low	63 Å²	63	76.6 Å²	76.6	32%	0.323	41%	0.411	S	S	.	.			trans	-64.7	154.7	173.8	-60.3	165.8	0	0	0	110.4	N627 R628 L632 A659 A660	I625-N627 VanDerWaalsContact C-N 3.29Å; I625-N627 PolarHBondContact O-N 3.22Å; I625-R628 WeakPolarHBondContact O-CA 3.48Å; I625-R628 PolarHBondContact O-N 3.35Å; I625-L632 HydrophobicContact CD1-CD1 4.15Å; I625-A659 WeakPolarHBondContact CD1-O 3.31Å; I625-A660 WeakPolarHBondContact CG1-O 3.37Å; I625-A660 PolarHBondContact N-O 2.88Å
626	E	72.1	Confident	66.6	Low	187 Å²	187	82.7 Å²	82.7	87%	0.874	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.1	-39.4	-178.4	-80	-176.2	162.6	0	0	114.2	R628	E626-R628 PolarHBondContact O-N 2.97Å
627	N	69.2	Low	64.8	Low	72 Å²	72	83.2 Å²	83.2	39%	0.385	45%	0.447	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-9.5	177.1	-74.3	2.5	0	0	0	112.7	I585 I625 T629	I585-N627 WeakPolarHBondContact CG2-O 3.14Å; I625-N627 VanDerWaalsContact C-N 3.29Å; I625-N627 PolarHBondContact O-N 3.22Å; N627-T629 WeakPolarHBondContact CB-OG1 3.31Å; N627-T629 WeakPolarHBondContact O-CG2 3.39Å; N627-T629 PolarHBondContact O-N 3.26Å
628	R	68.6	Low	62.9	Low	67 Å²	67	85 Å²	85	25%	0.253	46%	0.461	S	S	.	.			trans	46.5	17.1	-176.7	-60.1	-168.3	-179.8	-164	3.1	114.6	C603 F604 L609 I625 E626	C603-R628 PolarHBondContact O-NH1 3.4Å; F604-R628 PolarHBondContact O-NH1 3.33Å; L609-R628 WeakPolarHBondContact CB-O 3.2Å; L609-R628 PolarHBondContact N-O 3.47Å; I625-R628 WeakPolarHBondContact O-CA 3.48Å; I625-R628 PolarHBondContact O-N 3.35Å; E626-R628 PolarHBondContact O-N 2.97Å
629	T	64.9	Low	61.3	Low	48 Å²	48	92.5 Å²	92.5	29%	0.294	49%	0.493	S	S	.	.	B	Isolated β-bridge	trans	-91.8	129.5	-179.4	45.1	0	0	0	0	108.2	N627 K631	N627-T629 WeakPolarHBondContact CB-OG1 3.31Å; N627-T629 WeakPolarHBondContact O-CG2 3.39Å; N627-T629 PolarHBondContact O-N 3.26Å; T629-K631 PolarHBondContact O-N 3.11Å; T629-K631 PolarHBondContact OG1-O 2.81Å; T629-K631 VanDerWaalsContact OG1-O 3.13Å
630	G	56.5	Low	60	Low	33 Å²	33	92.6 Å²	92.6	34%	0.34	49%	0.491	S	S	.	.	S	Bend	trans	-63.8	-4.4	169.7	0	0	0	0	0	114.4	L609	L609-G630 PolarHBondContact O-N 3.24Å
631	K	53.3	Low	58.8	Low	174 Å²	174	89 Å²	89	76%	0.757	47%	0.474	S	S	*	.	S	Bend	trans	-105.9	122.3	175.7	-75.5	-178.9	175.9	-179.5	0	109.2	T629 D633	T629-K631 PolarHBondContact O-N 3.11Å; T629-K631 PolarHBondContact OG1-O 2.81Å; T629-K631 VanDerWaalsContact OG1-O 3.13Å; K631-D633 PolarHBondContact O-N 3.37Å
632	L	47.9	Very low	57.8	Low	101 Å²	101	92.7 Å²	92.7	53%	0.529	50%	0.496	S	S	.	.			trans	-67.2	121.6	164.4	-133.4	89.4	0	0	0	107.5	I625 M634 A659	I625-L632 HydrophobicContact CD1-CD1 4.15Å; L632-M634 HydrophobicContact CD2-CB 4.37Å; L632-M634 HydrophobicContact CD2-SD 4Å; L632-M634 PolarHBondContact O-N 2.94Å; L632-A659 HydrophobicContact CD1-CB 4.22Å; L632-A659 WeakPolarHBondContact CD1-O 3.21Å
633	D	42.9	Very low	56.7	Low	128 Å²	128	98 Å²	98	68%	0.684	52%	0.522	S	S	*	.			trans	-69.4	80.6	166.2	-73	-40.8	0	0	0	108.3	K631 P635	K631-D633 PolarHBondContact O-N 3.37Å; D633-P635 WeakPolarHBondContact O-CD 3.49Å
634	M	41.5	Very low	55.5	Low	118 Å²	118	100 Å²	100	58%	0.581	54%	0.538	S	S	*	.			trans	-109.3	98	176.3	-155.9	81.3	-173.7	0	0	109.4	L632 L636 I637	L632-M634 HydrophobicContact CD2-CB 4.37Å; L632-M634 HydrophobicContact CD2-SD 4Å; L632-M634 PolarHBondContact O-N 2.94Å; M634-L636 VanDerWaalsContact C-N 3.26Å; M634-L636 PolarHBondContact O-N 2.94Å; M634-I637 HydrophobicContact CG-CD1 4.24Å
635	P	35.7	Very low	54.3	Low	119 Å²	119	108 Å²	108	77%	0.773	58%	0.575	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.6	75.7	175.1	32.9	-31.6	0	0	0	109	D633	D633-P635 WeakPolarHBondContact O-CD 3.49Å
636	L	41.7	Very low	53.3	Low	149 Å²	149	109.1 Å²	109.1	78%	0.78	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-168.1	-1.9	165.1	-138.1	68.7	0	0	0	117.5	M634	M634-L636 VanDerWaalsContact C-N 3.26Å; M634-L636 PolarHBondContact O-N 2.94Å
637	I	47.6	Very low	52.5	Low	90 Å²	90	106.5 Å²	106.5	46%	0.462	59%	0.585	S	S	.	*			trans	-114.3	-3.4	-164.1	-62	178.2	0	0	0	114.9	M634 H639 V640 A641	M634-I637 HydrophobicContact CG-CD1 4.24Å; I637-H639 PolarHBondContact O-N 2.69Å; I637-H639 VanDerWaalsContact O-N 3.15Å; I637-V640 HydrophobicContact CG2-CB 4.28Å; I637-V640 PolarHBondContact O-N 3.39Å; I637-A641 HydrophobicContact CG2-CB 4.36Å; I637-A641 WeakPolarHBondContact O-CB 3.48Å; I637-A641 PolarHBondContact O-N 3.34Å
638	D	46.3	Very low	51.8	Low	156 Å²	156	109.6 Å²	109.6	83%	0.834	60%	0.598	S	S	*	*	H	α-helix	trans	-63.8	-24.5	177.8	-72.8	-21.3	0	0	0	113.5
639	H	49.9	Very low	50.9	Low	172 Å²	172	111.3 Å²	111.3	80%	0.796	62%	0.621	S	S	*	*	H	α-helix	trans	-81	-22.6	171.8	-94.3	-47.9	0	0	0	114.4	I637	I637-H639 PolarHBondContact O-N 2.69Å; I637-H639 VanDerWaalsContact O-N 3.15Å
640	V	53.2	Low	50.4	Low	79 Å²	79	113.7 Å²	113.7	48%	0.479	64%	0.639	S	S	.	*	H	α-helix	trans	-93.4	-33.8	-178.7	-174.5	0	0	0	0	110.6	I637 S642 I643 V644	I637-V640 HydrophobicContact CG2-CB 4.28Å; I637-V640 PolarHBondContact O-N 3.39Å; V640-S642 VanDerWaalsContact C-N 3.32Å; V640-S642 PolarHBondContact O-N 3.02Å; V640-I643 PolarHBondContact O-N 2.96Å; V640-I643 VanDerWaalsContact O-N 3.12Å; V640-V644 HydrophobicContact CG1-CG2 4.25Å; V640-V644 WeakPolarHBondContact O-CG2 3.42Å; V640-V644 PolarHBondContact O-N 3.5Å; V640-V644 VanDerWaalsContact O-N 3.12Å
641	A	51.6	Low	50.4	Low	43 Å²	43	118.9 Å²	118.9	36%	0.355	66%	0.659	S	S	.	*	H	α-helix	trans	-61	-37.5	179.1	0	0	0	0	0	112.5	I637 I643 V644 H645	I637-A641 HydrophobicContact CG2-CB 4.36Å; I637-A641 WeakPolarHBondContact O-CB 3.48Å; I637-A641 PolarHBondContact O-N 3.34Å; A641-I643 VanDerWaalsContact C-N 3.26Å; A641-I643 PolarHBondContact O-N 3.24Å; A641-V644 PolarHBondContact O-N 2.93Å; A641-H645 WeakPolarHBondContact O-CB 2.83Å; A641-H645 PolarHBondContact O-N 3.49Å
642	S	52.6	Low	50.2	Low	96 Å²	96	115 Å²	115	67%	0.671	65%	0.646	S	S	*	*	H	α-helix	trans	-70.7	-19.7	178.6	-154.8	0	0	0	0	113.7	V640	V640-S642 VanDerWaalsContact C-N 3.32Å; V640-S642 PolarHBondContact O-N 3.02Å
643	I	57	Low	50.3	Low	121 Å²	121	115.1 Å²	115.1	62%	0.621	65%	0.65	S	S	*	*	H	α-helix	trans	-87.8	-33.8	176.6	-62.3	173.5	0	0	0	110.4	V640 A641	V640-I643 PolarHBondContact O-N 2.96Å; V640-I643 VanDerWaalsContact O-N 3.12Å; A641-I643 VanDerWaalsContact C-N 3.26Å; A641-I643 PolarHBondContact O-N 3.24Å
644	V	56.1	Low	50.5	Low	76 Å²	76	116.9 Å²	116.9	46%	0.461	65%	0.652	S	S	.	*	H	α-helix	trans	-79.1	-27.3	178	179.3	0	0	0	0	112	V640 A641 A646 L647	V640-V644 HydrophobicContact CG1-CG2 4.25Å; V640-V644 WeakPolarHBondContact O-CG2 3.42Å; V640-V644 PolarHBondContact O-N 3.5Å; V640-V644 VanDerWaalsContact O-N 3.12Å; A641-V644 PolarHBondContact O-N 2.93Å; V644-A646 PolarHBondContact O-N 3.43Å; V644-A646 VanDerWaalsContact O-N 3.14Å; V644-L647 PolarHBondContact O-N 3.08Å
645	H	54.2	Low	50.9	Low	176 Å²	176	118.3 Å²	118.3	82%	0.815	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.7	-15.4	178.5	-135.1	-91.5	0	0	0	114.4	A641	A641-H645 WeakPolarHBondContact O-CB 2.83Å; A641-H645 PolarHBondContact O-N 3.49Å
646	A	55.8	Low	51.5	Low	87 Å²	87	118.5 Å²	118.5	72%	0.719	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.8	-10	179.1	0	0	0	0	0	114.1	V644	V644-A646 PolarHBondContact O-N 3.43Å; V644-A646 VanDerWaalsContact O-N 3.14Å
647	L	56.9	Low	51.8	Low	131 Å²	131	114.9 Å²	114.9	69%	0.686	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-122.5	-12.9	-165	-76.3	168.8	0	0	0	116.5	V644	V644-L647 PolarHBondContact O-N 3.08Å
648	M	52.5	Low	52	Low	137 Å²	137	115 Å²	115	68%	0.675	63%	0.633	S	S	*	*			trans	-134.1	98.1	-171.3	-71.7	-82.2	122.2	0	0	112.4	L652	M648-L652 HydrophobicContact CB-CD1 4.21Å; M648-L652 HydrophobicContact CG-CD1 4.41Å
649	S	49.8	Very low	52.6	Low	103 Å²	103	109.5 Å²	109.5	72%	0.72	61%	0.61	S	S	*	*			trans	-63.5	127.9	173.7	56.8	0	0	0	0	112.6	L651	S649-L651 PolarHBondContact O-N 2.93Å
650	S	56	Low	53.4	Low	98 Å²	98	101.5 Å²	101.5	69%	0.685	57%	0.574	S	S	*	*	S	Bend	trans	66.2	-16.3	149.7	64.8	0	0	0	0	122.2
651	L	55.2	Low	54.4	Low	143 Å²	143	98.9 Å²	98.9	75%	0.749	56%	0.558	S	S	*	*	S	Bend	trans	-103.5	-20	-174.7	-90.7	137.7	0	0	0	116.2	S649	S649-L651 PolarHBondContact O-N 2.93Å
652	L	49.9	Very low	55.8	Low	92 Å²	92	101.8 Å²	101.8	48%	0.482	56%	0.561	S	S	.	*	S	Bend	trans	-86.4	-14	-174.5	-102.6	144.7	0	0	0	115.1	M648 F654 H655	M648-L652 HydrophobicContact CB-CD1 4.21Å; M648-L652 HydrophobicContact CG-CD1 4.41Å; L652-F654 VanDerWaalsContact C-N 3.29Å; L652-F654 PolarHBondContact O-N 3.45Å; L652-H655 PolarHBondContact O-N 3.05Å
653	V	49.7	Very low	57	Low	103 Å²	103	106 Å²	106	62%	0.624	57%	0.567	S	S	*	*	H	α-helix	trans	-70.8	-26	-178.7	-177.1	0	0	0	0	111.9
654	F	47.2	Very low	58.1	Low	166 Å²	166	101.5 Å²	101.5	73%	0.728	54%	0.544	S	S	*	.	H	α-helix	trans	-73.4	-30.5	177.2	-83.9	-81.8	0	0	0	113.5	L652	L652-F654 VanDerWaalsContact C-N 3.29Å; L652-F654 PolarHBondContact O-N 3.45Å
655	H	48.9	Very low	59.3	Low	148 Å²	148	104.8 Å²	104.8	69%	0.685	56%	0.559	S	S	*	*	H	α-helix	trans	-80.8	-20.9	178.4	-82.4	-58.3	0	0	0	114.2	L652	L652-H655 PolarHBondContact O-N 3.05Å
656	L	48.5	Very low	60.6	Low	123 Å²	123	98.9 Å²	98.9	64%	0.644	54%	0.535	S	S	*	.	H	α-helix	trans	-77.3	-20.3	178	-82.4	155.9	0	0	0	113.3	A659	L656-A659 WeakPolarHBondContact O-CB 3.11Å
657	L	48.8	Very low	62	Low	73 Å²	73	98.5 Å²	98.5	38%	0.382	52%	0.519	S	S	.	.	G	3₁₀ helix	trans	-79.3	-19.2	179.3	-86.2	156.5	0	0	0	114.1	Y608 L610 A659	Y608-L657 PolarHBondContact OH-O 3.23Å; L610-L657 HydrophobicContact CD1-CD2 4.1Å; L657-A659 VanDerWaalsContact C-N 3.34Å
658	D	52.3	Low	63.4	Low	91 Å²	91	96.2 Å²	96.2	49%	0.487	50%	0.501	S	S	.	.	G	3₁₀ helix	trans	-87.3	-3	175.1	-82.5	-15.2	0	0	0	113	A660 C661	D658-A660 PolarHBondContact O-N 2.84Å; D658-C661 PolarHBondContact O-N 3.15Å; D658-C661 VanDerWaalsContact O-O 3.14Å
659	A	57.8	Low	65	Low	42 Å²	42	90.6 Å²	90.6	35%	0.347	47%	0.474	S	S	.	.	G	3₁₀ helix	trans	-63.9	-12.4	177.2	0	0	0	0	0	113.4	I625 L632 L656 L657	I625-A659 WeakPolarHBondContact CD1-O 3.31Å; L632-A659 HydrophobicContact CD1-CB 4.22Å; L632-A659 WeakPolarHBondContact CD1-O 3.21Å; L656-A659 WeakPolarHBondContact O-CB 3.11Å; L657-A659 VanDerWaalsContact C-N 3.34Å
660	A	66.8	Low	66.8	Low	4 Å²	4	92.1 Å²	92.1	3%	0.033	46%	0.464	C	S	.	.	G	3₁₀ helix	trans	-87.9	-13.2	179.8	0	0	0	0	0	114.4	Y608 P624 I625 D658	Y608-A660 HydrophobicContact CD1-CB 4.39Å; Y608-A660 HydrophobicContact CD2-CB 3.58Å; Y608-A660 HydrophobicContact CE2-CB 3.72Å; Y608-A660 HydrophobicContact CG-CB 3.91Å; P624-A660 WeakPolarHBondContact CA-O 3.49Å; I625-A660 WeakPolarHBondContact CG1-O 3.37Å; I625-A660 PolarHBondContact N-O 2.88Å; D658-A660 PolarHBondContact O-N 2.84Å
661	C	75.3	Confident	68.4	Low	23 Å²	23	93.7 Å²	93.7	16%	0.155	46%	0.455	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	135.3	-176.7	-56.5	0	0	0	0	110.2	C618 W623 D658	C618-C661 HydrophobicContact CB-CB 3.92Å; C618-C661 WeakPolarHBondContact CB-SG 3.49Å; C618-C661 WeakPolarHBondContact SG-CB 3.44Å; C618-C661 CovalentContact SG-SG 2.05Å; C618-C661 PolarHBondContact SG-SG 3.25Å; W623-C661 CarbonylContact O-C 3.6Å; W623-C661 VanDerWaalsContact O-CA 3.26Å; W623-C661 WeakPolarHBondContact O-CA 3.37Å; D658-C661 PolarHBondContact O-N 3.15Å; D658-C661 VanDerWaalsContact O-O 3.14Å
662	Y	79.8	Confident	69.9	Low	104 Å²	104	89.9 Å²	89.9	41%	0.408	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	145	172.7	69.7	-87.4	0	0	0	110.6	S622 W623 L664	S622-Y662 CarbonylContact C-O 3.56Å; S622-Y662 WeakPolarHBondContact CA-O 3.36Å; S622-Y662 WeakPolarHBondContact CB-O 3.47Å; W623-Y662 HydrophobicContact CB-CD1 4.49Å; W623-Y662 HydrophobicContact CB-CE1 3.92Å; W623-Y662 HydrophobicContact CB-CE2 4.38Å; W623-Y662 HydrophobicContact CG-CE1 4.49Å; W623-Y662 PolarHBondContact N-O 2.69Å; W623-Y662 WeakPolarHBondContact O-CD1 3.4Å; W623-Y662 PolarHBondContact O-N 3.02Å; Y662-L664 HydrophobicContact CE2-CD2 4.21Å
663	K	77.7	Confident	71.8	Confident	184 Å²	184	88.8 Å²	88.8	80%	0.8	45%	0.445	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.6	136.8	176.2	-71	-173.1	177.1	-176.3	0	110.2
664	L	80.6	Confident	73.7	Confident	28 Å²	28	87.4 Å²	87.4	15%	0.147	44%	0.444	C	S	.	.	P	Polyproline II helix	trans	-76	142.3	175.9	-67.4	165.2	0	0	0	110.2	G621 W623 Y662 R822 V824	G621-L664 WeakPolarHBondContact O-CB 3.35Å; G621-L664 PolarHBondContact O-N 3.46Å; W623-L664 HydrophobicContact CB-CD2 4.02Å; W623-L664 HydrophobicContact CB-CG 4.33Å; Y662-L664 HydrophobicContact CE2-CD2 4.21Å; L664-R822 HydrophobicContact CD2-CB 4.47Å; L664-V824 HydrophobicContact CB-CG2 3.71Å; L664-V824 HydrophobicContact CD1-CG2 4.14Å
665	D	81	Confident	75.8	Confident	145 Å²	145	82.8 Å²	82.8	78%	0.775	43%	0.425	S	S	*	.	P	Polyproline II helix	trans	-68.7	142.8	177	-68.8	-37.3	0	0	0	111.6
666	V	82.7	Confident	77.8	Confident	51 Å²	51	75.8 Å²	75.8	31%	0.309	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	122.2	178.4	-178.6	0	0	0	0	110.3	F816 V824 L826	V666-F816 HydrophobicContact CB-CE1 4.45Å; V666-F816 HydrophobicContact CG1-CD1 4.15Å; V666-F816 HydrophobicContact CG1-CE1 3.81Å; V666-F816 HydrophobicContact CG2-CD1 4.23Å; V666-F816 HydrophobicContact CG2-CE1 3.72Å; V666-V824 CarbonylContact C-O 3.51Å; V666-V824 WeakPolarHBondContact CA-O 3.35Å; V666-V824 HydrophobicContact CG2-CG1 4.18Å; V666-L826 HydrophobicContact CG1-CB 3.65Å
667	E	84.7	Confident	79.9	Confident	80 Å²	80	74 Å²	74	37%	0.374	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	133.4	177.4	-71.6	-177.9	-162.1	0	0	110.9	R823 V824 L825 L826	E667-R823 IonicContact OE2-NH1 3.14Å; E667-V824 PolarHBondContact N-O 2.89Å; E667-L825 HydrophobicContact CB-CD2 3.85Å; E667-L825 CarbonylContact O-C 3.57Å; E667-L825 WeakPolarHBondContact O-CA 3.48Å; E667-L826 PolarHBondContact O-N 3.31Å
668	Y	86.6	Confident	82	Confident	82 Å²	82	75.1 Å²	75.1	32%	0.322	39%	0.393	S	S	.	.			trans	-152.5	163	170.1	56.8	-86	0	0	0	108.5	R670 P734	Y668-R670 HydrophobicContact CD2-CG 4.09Å; Y668-R670 HydrophobicContact CE2-CG 3.71Å; Y668-R670 PolarHBondContact O-N 2.96Å; Y668-R670 VanDerWaalsContact O-N 3.1Å; Y668-P734 HydrophobicContact CD2-CB 4.3Å; Y668-P734 HydrophobicContact CD2-CG 4.26Å; Y668-P734 HydrophobicContact CE2-CB 4.21Å; Y668-P734 HydrophobicContact CE2-CG 3.84Å
669	M	86.5	Confident	84	Confident	20 Å²	20	71 Å²	71	10%	0.099	37%	0.371	C	S	.	.			trans	-65.7	111.5	177.2	-177.8	173.1	-111.2	0	0	110	E675 A676 V732 T895	M669-E675 HydrophobicContact CE-CB 3.87Å; M669-A676 HydrophobicContact CE-CB 4.19Å; M669-A676 HydrophobicContact CG-CB 3.85Å; M669-A676 HydrophobicContact SD-CB 4Å; M669-V732 HydrophobicContact SD-CG2 3.99Å; M669-T895 HydrophobicContact CE-CG2 4.35Å; M669-T895 WeakPolarHBondContact CE-OG1 3.04Å
670	R	87.8	Confident	85.8	Confident	135 Å²	135	70.3 Å²	70.3	51%	0.509	36%	0.362	S	S	.	.			trans	-90.7	149.8	178.7	-65.8	-179	179.1	-175.3	2.3	110	Y668 G672 D673 A676	Y668-R670 HydrophobicContact CD2-CG 4.09Å; Y668-R670 HydrophobicContact CE2-CG 3.71Å; Y668-R670 PolarHBondContact O-N 2.96Å; Y668-R670 VanDerWaalsContact O-N 3.1Å; R670-G672 PolarHBondContact O-N 2.87Å; R670-D673 PolarHBondContact N-OD2 3.31Å; R670-D673 WeakPolarHBondContact O-CB 3.23Å; R670-D673 PolarHBondContact O-N 2.03Å; R670-A676 WeakPolarHBondContact O-CB 3.43Å
671	W	88.4	Confident	87.2	Confident	131 Å²	131	74.6 Å²	74.6	50%	0.496	39%	0.388	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.9	-24.9	175.1	-68.1	90.3	0	0	0	114	V680 F729 V732	W671-V680 HydrophobicContact CZ3-CG2 4.21Å; W671-F729 HydrophobicContact CH2-CD1 4.13Å; W671-F729 HydrophobicContact CZ3-CD1 4.25Å; W671-V732 HydrophobicContact CD2-CG1 3.61Å; W671-V732 HydrophobicContact CE3-CG1 3.69Å; W671-V732 HydrophobicContact CG-CG1 4.1Å; W671-V732 HydrophobicContact CH2-CB 4.43Å; W671-V732 HydrophobicContact CH2-CG1 4.23Å; W671-V732 HydrophobicContact CZ2-CB 4.48Å; W671-V732 HydrophobicContact CZ2-CG1 4.16Å; W671-V732 HydrophobicContact CZ3-CG1 4.01Å
672	G	87.8	Confident	88.1	Confident	63 Å²	63	77.6 Å²	77.6	65%	0.649	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.9	-7.5	177.3	0	0	0	0	0	115.2	R670	R670-G672 PolarHBondContact O-N 2.87Å
673	D	88.8	Confident	88.9	Confident	68 Å²	68	72.7 Å²	72.7	36%	0.364	38%	0.379	S	S	.	.	S	Bend	trans	-70.9	137.8	179.6	-66.2	-24.1	0	0	0	110.3	R670 E675 A676 I677	R670-D673 PolarHBondContact N-OD2 3.31Å; R670-D673 WeakPolarHBondContact O-CB 3.23Å; R670-D673 PolarHBondContact O-N 2.03Å; D673-E675 PolarHBondContact O-N 2.86Å; D673-E675 VanDerWaalsContact O-N 3.15Å; D673-A676 HydrophobicContact CB-CB 4.29Å; D673-A676 WeakPolarHBondContact O-CB 3.38Å; D673-A676 PolarHBondContact O-N 3.3Å; D673-I677 WeakPolarHBondContact O-CG1 3.21Å; D673-I677 PolarHBondContact O-N 2.86Å
674	A	90.5	Very high	89.8	Confident	75 Å²	75	66.4 Å²	66.4	62%	0.62	36%	0.358	S	S	*	.	H	α-helix	trans	-55.9	-37.1	-177.8	0	0	0	0	0	112.6	I677 V678	A674-I677 PolarHBondContact O-N 3.32Å; A674-V678 VanDerWaalsContact O-CG2 3.32Å; A674-V678 WeakPolarHBondContact O-CG2 3.44Å; A674-V678 PolarHBondContact O-N 3.34Å; A674-V678 VanDerWaalsContact O-N 3.09Å
675	E	89.7	Confident	90.5	Very high	68 Å²	68	67.8 Å²	67.8	32%	0.318	37%	0.373	S	S	.	.	H	α-helix	trans	-66.6	-39.8	177.6	-66.6	176.5	-168.1	0	0	112.5	M669 D673 V678 C679 K892 T895	M669-E675 HydrophobicContact CE-CB 3.87Å; D673-E675 PolarHBondContact O-N 2.86Å; D673-E675 VanDerWaalsContact O-N 3.15Å; E675-V678 PolarHBondContact O-N 3.36Å; E675-C679 PolarHBondContact O-N 3.07Å; E675-C679 VanDerWaalsContact O-N 3.13Å; E675-C679 PolarHBondContact O-SG 3.17Å; E675-K892 IonicContact OE1-NZ 2.77Å; E675-K892 PolarHBondContact OE1-NZ 2.88Å; E675-K892 WeakPolarHBondContact OE2-CD 3.36Å; E675-K892 IonicContact OE2-NZ 2.68Å; E675-K892 PolarHBondContact OE2-NZ 3Å; E675-T895 HydrophobicContact CB-CG2 3.97Å; E675-T895 HydrophobicContact CG-CG2 4.33Å; E675-T895 PolarHBondContact OE2-OG1 3.11Å
676	A	91.6	Very high	91.3	Very high	1 Å²	1	61.1 Å²	61.1	1%	0.008	34%	0.339	C	S	.	.	H	α-helix	trans	-65.5	-45.1	176.9	0	0	0	0	0	110.4	M669 R670 D673 V678 C679 V680 V732	M669-A676 HydrophobicContact CE-CB 4.19Å; M669-A676 HydrophobicContact CG-CB 3.85Å; M669-A676 HydrophobicContact SD-CB 4Å; R670-A676 WeakPolarHBondContact O-CB 3.43Å; D673-A676 HydrophobicContact CB-CB 4.29Å; D673-A676 WeakPolarHBondContact O-CB 3.38Å; D673-A676 PolarHBondContact O-N 3.3Å; A676-V678 VanDerWaalsContact C-N 3.35Å; A676-V678 PolarHBondContact O-N 3.47Å; A676-C679 PolarHBondContact O-N 2.96Å; A676-V680 WeakPolarHBondContact O-CB 3.49Å; A676-V680 VanDerWaalsContact O-CG2 3.29Å; A676-V680 WeakPolarHBondContact O-CG2 3.46Å; A676-V680 PolarHBondContact O-N 3.01Å; A676-V732 HydrophobicContact CB-CG1 4.05Å; A676-V732 HydrophobicContact CB-CG2 4.32Å
677	I	93.6	Very high	92	Very high	86 Å²	86	60.2 Å²	60.2	44%	0.441	33%	0.332	S	S	.	.	H	α-helix	trans	-57.9	-47.1	177.7	-64.4	168.9	0	0	0	110.8	D673 A674 C679 V680 V681	D673-I677 WeakPolarHBondContact O-CG1 3.21Å; D673-I677 PolarHBondContact O-N 2.86Å; A674-I677 PolarHBondContact O-N 3.32Å; I677-C679 VanDerWaalsContact C-N 3.35Å; I677-C679 PolarHBondContact O-N 3.32Å; I677-V680 PolarHBondContact O-N 3.46Å; I677-V681 HydrophobicContact CG2-CG2 4.31Å; I677-V681 WeakPolarHBondContact O-CB 3.13Å; I677-V681 VanDerWaalsContact O-CG2 3.29Å; I677-V681 WeakPolarHBondContact O-CG2 3.42Å; I677-V681 PolarHBondContact O-N 3.44Å
678	V	93.1	Very high	92.6	Very high	97 Å²	97	62.1 Å²	62.1	59%	0.588	34%	0.344	S	S	*	.	H	α-helix	trans	-60.1	-45.3	178.7	170.7	0	0	0	0	111.3	A674 E675 A676 F682	A674-V678 VanDerWaalsContact O-CG2 3.32Å; A674-V678 WeakPolarHBondContact O-CG2 3.44Å; A674-V678 PolarHBondContact O-N 3.34Å; A674-V678 VanDerWaalsContact O-N 3.09Å; E675-V678 PolarHBondContact O-N 3.36Å; A676-V678 VanDerWaalsContact C-N 3.35Å; A676-V678 PolarHBondContact O-N 3.47Å; V678-F682 WeakPolarHBondContact O-CB 3.44Å; V678-F682 PolarHBondContact O-N 3.41Å; V678-F682 VanDerWaalsContact O-N 3.11Å
679	C	93.5	Very high	93.1	Very high	5 Å²	5	60 Å²	60	3%	0.034	34%	0.344	C	S	.	.	H	α-helix	trans	-63.7	-44.8	178.5	-65.8	0	0	0	0	111.9	E675 A676 I677 F682 A683 T728 C898	E675-C679 PolarHBondContact O-N 3.07Å; E675-C679 VanDerWaalsContact O-N 3.13Å; E675-C679 PolarHBondContact O-SG 3.17Å; A676-C679 PolarHBondContact O-N 2.96Å; I677-C679 VanDerWaalsContact C-N 3.35Å; I677-C679 PolarHBondContact O-N 3.32Å; C679-F682 PolarHBondContact O-N 3.2Å; C679-A683 WeakPolarHBondContact O-CB 3.11Å; C679-A683 PolarHBondContact O-N 3.42Å; C679-T728 HydrophobicContact CB-CG2 3.88Å; C679-C898 HydrophobicContact CB-CB 3.89Å
680	V	95	Very high	93.5	Very high	27 Å²	27	59.1 Å²	59.1	16%	0.164	34%	0.34	C	S	.	.	H	α-helix	trans	-64.1	-45.5	180	170	0	0	0	0	111.3	W671 A676 I677 F682 A683 C684 F729 V732	W671-V680 HydrophobicContact CZ3-CG2 4.21Å; A676-V680 WeakPolarHBondContact O-CB 3.49Å; A676-V680 VanDerWaalsContact O-CG2 3.29Å; A676-V680 WeakPolarHBondContact O-CG2 3.46Å; A676-V680 PolarHBondContact O-N 3.01Å; I677-V680 PolarHBondContact O-N 3.46Å; V680-F682 VanDerWaalsContact C-N 3.32Å; V680-F682 PolarHBondContact O-N 3.27Å; V680-A683 PolarHBondContact O-N 3.03Å; V680-C684 WeakPolarHBondContact O-CB 3.37Å; V680-C684 PolarHBondContact O-N 2.97Å; V680-C684 PolarHBondContact O-SG 3.23Å; V680-F729 HydrophobicContact CG1-CE1 3.93Å; V680-F729 HydrophobicContact CG1-CZ 4.3Å; V680-V732 HydrophobicContact CG2-CG2 4.22Å
681	V	95.8	Very high	94	Very high	93 Å²	93	56.6 Å²	56.6	56%	0.564	34%	0.336	S	S	*	.	H	α-helix	trans	-60.6	-43.6	177.6	170.4	0	0	0	0	111	I677 C684 A685	I677-V681 HydrophobicContact CG2-CG2 4.31Å; I677-V681 WeakPolarHBondContact O-CB 3.13Å; I677-V681 VanDerWaalsContact O-CG2 3.29Å; I677-V681 WeakPolarHBondContact O-CG2 3.42Å; I677-V681 PolarHBondContact O-N 3.44Å; V681-C684 PolarHBondContact O-N 3Å; V681-A685 PolarHBondContact O-N 3.26Å
682	F	95.2	Very high	94.3	Very high	87 Å²	87	55.6 Å²	55.6	38%	0.382	34%	0.335	S	S	.	.	H	α-helix	trans	-63.9	-42.7	177.6	-172.4	-104.9	0	0	0	112	V678 C679 V680 A685 G686 S902 S906	V678-F682 WeakPolarHBondContact O-CB 3.44Å; V678-F682 PolarHBondContact O-N 3.41Å; V678-F682 VanDerWaalsContact O-N 3.11Å; C679-F682 PolarHBondContact O-N 3.2Å; V680-F682 VanDerWaalsContact C-N 3.32Å; V680-F682 PolarHBondContact O-N 3.27Å; F682-A685 PolarHBondContact O-N 3.06Å; F682-G686 PolarHBondContact O-N 2.82Å; F682-S902 VanDerWaalsContact CD1-CB 3.44Å; F682-S902 VanDerWaalsContact CE1-CB 3.46Å; F682-S906 VanDerWaalsContact CZ-OG 3.27Å; F682-S906 WeakPolarHBondContact CZ-OG 3.38Å
683	A	95.9	Very high	94.7	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-64.6	-42.8	175.2	0	0	0	0	0	112.3	C679 V680 A685 G686 I687 T728 F729	C679-A683 WeakPolarHBondContact O-CB 3.11Å; C679-A683 PolarHBondContact O-N 3.42Å; V680-A683 PolarHBondContact O-N 3.03Å; A683-A685 PolarHBondContact O-N 2.95Å; A683-G686 PolarHBondContact O-N 3.23Å; A683-G686 VanDerWaalsContact O-N 3.16Å; A683-I687 WeakPolarHBondContact O-CG1 3.14Å; A683-I687 PolarHBondContact O-N 3.14Å; A683-T728 HydrophobicContact CB-CG2 3.91Å; A683-F729 HydrophobicContact CB-CE2 4.13Å
684	C	96.7	Very high	95	Very high	53 Å²	53	51.4 Å²	51.4	36%	0.358	30%	0.3	S	S	.	.	H	α-helix	trans	-57.4	-46.6	174.4	-75.7	0	0	0	0	111.7	V680 V681 G686 I687 L688	V680-C684 WeakPolarHBondContact O-CB 3.37Å; V680-C684 PolarHBondContact O-N 2.97Å; V680-C684 PolarHBondContact O-SG 3.23Å; V681-C684 PolarHBondContact O-N 3Å; C684-G686 VanDerWaalsContact C-N 3.31Å; C684-G686 PolarHBondContact O-N 3.23Å; C684-I687 PolarHBondContact O-N 3.34Å; C684-L688 WeakPolarHBondContact O-CG 3.16Å; C684-L688 PolarHBondContact O-N 3.08Å
685	A	96.5	Very high	95.2	Very high	56 Å²	56	51.5 Å²	51.5	46%	0.463	29%	0.292	S	S	.	.	H	α-helix	trans	-60.6	-42.1	176	0	0	0	0	0	111.7	V681 F682 A683 L688 A689	V681-A685 PolarHBondContact O-N 3.26Å; F682-A685 PolarHBondContact O-N 3.06Å; A683-A685 PolarHBondContact O-N 2.95Å; A685-L688 PolarHBondContact O-N 2.86Å; A685-A689 WeakPolarHBondContact O-CB 3.41Å; A685-A689 PolarHBondContact O-N 3.18Å
686	G	96.5	Very high	95.4	Very high	6 Å²	6	49.4 Å²	49.4	6%	0.062	28%	0.283	C	S	.	.	H	α-helix	trans	-62.9	-43.1	175.3	0	0	0	0	0	113.9	F682 A683 C684 A689 T690 Y725	F682-G686 PolarHBondContact O-N 2.82Å; A683-G686 PolarHBondContact O-N 3.23Å; A683-G686 VanDerWaalsContact O-N 3.16Å; C684-G686 VanDerWaalsContact C-N 3.31Å; C684-G686 PolarHBondContact O-N 3.23Å; G686-A689 PolarHBondContact O-N 3.4Å; G686-T690 WeakPolarHBondContact O-CB 3.2Å; G686-T690 PolarHBondContact O-N 2.96Å; G686-T690 PolarHBondContact O-OG1 2.83Å; G686-Y725 VanDerWaalsContact CA-CZ 3.48Å; G686-Y725 WeakPolarHBondContact O-CE2 3.46Å
687	I	97.6	Very high	95.4	Very high	31 Å²	31	49.4 Å²	49.4	16%	0.159	28%	0.283	C	S	.	.	H	α-helix	trans	-61.3	-51	175.4	-70.3	169.2	0	0	0	109.9	A683 C684 A689 T690 L691 L722 Y725 V726 F729	A683-I687 WeakPolarHBondContact O-CG1 3.14Å; A683-I687 PolarHBondContact O-N 3.14Å; C684-I687 PolarHBondContact O-N 3.34Å; I687-A689 VanDerWaalsContact C-N 3.33Å; I687-A689 PolarHBondContact O-N 3.5Å; I687-T690 PolarHBondContact O-N 2.92Å; I687-T690 VanDerWaalsContact O-N 3.15Å; I687-L691 HydrophobicContact CG2-CD1 3.84Å; I687-L691 HydrophobicContact CG2-CG 4.25Å; I687-L691 WeakPolarHBondContact O-CB 3.42Å; I687-L691 WeakPolarHBondContact O-CG 3.16Å; I687-L691 PolarHBondContact O-N 3.22Å; I687-L722 HydrophobicContact CB-CD1 4.46Å; I687-L722 HydrophobicContact CG1-CD1 4.22Å; I687-L722 HydrophobicContact CG2-CD1 3.97Å; I687-Y725 HydrophobicContact CG1-CG 4.31Å; I687-V726 HydrophobicContact CD1-CG2 4.49Å; I687-F729 HydrophobicContact CD1-CE2 3.64Å; I687-F729 HydrophobicContact CD1-CZ 4.32Å
688	L	97.4	Very high	95.4	Very high	120 Å²	120	48.8 Å²	48.8	63%	0.628	28%	0.283	S	S	*	.	H	α-helix	trans	-58.6	-44.7	179.2	-70.5	173.3	0	0	0	111.7	C684 A685 T690 L691 F692	C684-L688 WeakPolarHBondContact O-CG 3.16Å; C684-L688 PolarHBondContact O-N 3.08Å; A685-L688 PolarHBondContact O-N 2.86Å; L688-T690 PolarHBondContact O-N 3.07Å; L688-L691 PolarHBondContact O-N 2.75Å; L688-F692 VanDerWaalsContact O-CB 3.31Å; L688-F692 WeakPolarHBondContact O-CB 3.26Å; L688-F692 PolarHBondContact O-N 3.38Å
689	A	96.3	Very high	95.3	Very high	39 Å²	39	50.6 Å²	50.6	32%	0.322	29%	0.287	S	S	.	.	H	α-helix	trans	-65.4	-36.5	177.4	0	0	0	0	0	112.8	A685 G686 I687 T693 L909	A685-A689 WeakPolarHBondContact O-CB 3.41Å; A685-A689 PolarHBondContact O-N 3.18Å; G686-A689 PolarHBondContact O-N 3.4Å; I687-A689 VanDerWaalsContact C-N 3.33Å; I687-A689 PolarHBondContact O-N 3.5Å; A689-T693 WeakPolarHBondContact O-CB 3.36Å; A689-T693 PolarHBondContact O-N 3.07Å; A689-T693 PolarHBondContact O-OG1 3.05Å; A689-L909 HydrophobicContact CB-CD2 3.69Å
690	T	96.5	Very high	95.2	Very high	1 Å²	1	55.5 Å²	55.5	1%	0.006	31%	0.307	C	S	.	.	H	α-helix	trans	-70.7	-43.1	177.8	-56.2	0	0	0	0	111.5	G686 I687 L688 T693 T694 L718 L721 L722 Y725	G686-T690 WeakPolarHBondContact O-CB 3.2Å; G686-T690 PolarHBondContact O-N 2.96Å; G686-T690 PolarHBondContact O-OG1 2.83Å; I687-T690 PolarHBondContact O-N 2.92Å; I687-T690 VanDerWaalsContact O-N 3.15Å; L688-T690 PolarHBondContact O-N 3.07Å; T690-T693 PolarHBondContact O-N 3.13Å; T690-T694 WeakPolarHBondContact O-CB 2.89Å; T690-T694 PolarHBondContact O-N 2.72Å; T690-T694 PolarHBondContact O-OG1 3.19Å; T690-L718 HydrophobicContact CG2-CD2 4.2Å; T690-L721 HydrophobicContact CG2-CB 4.17Å; T690-L722 HydrophobicContact CG2-CB 4.26Å; T690-Y725 WeakPolarHBondContact OG1-CE2 3.03Å
691	L	96.8	Very high	94.9	Very high	81 Å²	81	56.9 Å²	56.9	42%	0.424	31%	0.314	S	S	.	.	H	α-helix	trans	-62.8	-45.9	174.4	-69.1	176.9	0	0	0	110.8	I687 L688 T693 T694 T695 L722	I687-L691 HydrophobicContact CG2-CD1 3.84Å; I687-L691 HydrophobicContact CG2-CG 4.25Å; I687-L691 WeakPolarHBondContact O-CB 3.42Å; I687-L691 WeakPolarHBondContact O-CG 3.16Å; I687-L691 PolarHBondContact O-N 3.22Å; L688-L691 PolarHBondContact O-N 2.75Å; L691-T693 PolarHBondContact O-N 3.42Å; L691-T694 PolarHBondContact O-N 3.26Å; L691-T695 WeakPolarHBondContact O-CB 3.35Å; L691-T695 PolarHBondContact O-N 2.95Å; L691-T695 PolarHBondContact O-OG1 3.19Å; L691-L722 HydrophobicContact CD2-CD1 4.43Å
692	F	96.2	Very high	94.4	Very high	110 Å²	110	56.6 Å²	56.6	48%	0.482	31%	0.313	S	S	.	.	H	α-helix	trans	-55.9	-49	174.2	176.6	-102.2	0	0	0	111.8	L688 T694 T695 I696 L921	L688-F692 VanDerWaalsContact O-CB 3.31Å; L688-F692 WeakPolarHBondContact O-CB 3.26Å; L688-F692 PolarHBondContact O-N 3.38Å; F692-T694 VanDerWaalsContact C-N 3.33Å; F692-T694 PolarHBondContact O-N 2.97Å; F692-T695 PolarHBondContact O-N 2.05Å; F692-I696 HydrophobicContact CE1-CG1 4.27Å; F692-I696 HydrophobicContact CE2-CD1 4.36Å; F692-I696 HydrophobicContact CE2-CG1 4.19Å; F692-I696 HydrophobicContact CZ-CD1 4.41Å; F692-I696 HydrophobicContact CZ-CG1 4.03Å; F692-I696 WeakPolarHBondContact O-CG1 3.16Å; F692-I696 PolarHBondContact O-N 3.04Å; F692-L921 HydrophobicContact CE1-CD1 4.22Å; F692-L921 HydrophobicContact CZ-CD1 4.01Å
693	T	95.3	Very high	93.9	Very high	4 Å²	4	53.3 Å²	53.3	3%	0.025	30%	0.3	C	S	.	.	H	α-helix	trans	-59.2	-44.6	177.7	-57.9	0	0	0	0	111.7	A689 T690 L691 I696 F697 L718 L909 F913 L917	A689-T693 WeakPolarHBondContact O-CB 3.36Å; A689-T693 PolarHBondContact O-N 3.07Å; A689-T693 PolarHBondContact O-OG1 3.05Å; T690-T693 PolarHBondContact O-N 3.13Å; L691-T693 PolarHBondContact O-N 3.42Å; T693-I696 PolarHBondContact O-N 2.85Å; T693-F697 HydrophobicContact CG2-CD2 4.11Å; T693-F697 HydrophobicContact CG2-CE2 4.16Å; T693-F697 WeakPolarHBondContact O-CB 3.21Å; T693-F697 VanDerWaalsContact O-CD2 3.28Å; T693-F697 WeakPolarHBondContact O-CD2 3.38Å; T693-F697 PolarHBondContact O-N 3.41Å; T693-L718 HydrophobicContact CG2-CD1 4.46Å; T693-L718 HydrophobicContact CG2-CD2 3.69Å; T693-L909 HydrophobicContact CG2-CD1 4.37Å; T693-F913 HydrophobicContact CG2-CB 3.81Å; T693-F913 HydrophobicContact CG2-CD1 3.82Å; T693-F913 HydrophobicContact CG2-CG 3.96Å; T693-L917 HydrophobicContact CG2-CD1 3.92Å; T693-L917 HydrophobicContact CG2-CD2 4.37Å; T693-L917 HydrophobicContact CG2-CG 4.33Å; T693-L917 WeakPolarHBondContact OG1-CD1 3.36Å
694	T	94.4	Very high	93.3	Very high	40 Å²	40	55.5 Å²	55.5	25%	0.245	31%	0.314	C	S	.	.	H	α-helix	trans	-63.5	-47.5	179.8	-56.3	0	0	0	0	111	T690 L691 F692 I696 F697 V698	T690-T694 WeakPolarHBondContact O-CB 2.89Å; T690-T694 PolarHBondContact O-N 2.72Å; T690-T694 PolarHBondContact O-OG1 3.19Å; L691-T694 PolarHBondContact O-N 3.26Å; F692-T694 VanDerWaalsContact C-N 3.33Å; F692-T694 PolarHBondContact O-N 2.97Å; T694-I696 PolarHBondContact O-N 2.84Å; T694-F697 PolarHBondContact O-N 3.35Å; T694-F697 VanDerWaalsContact O-N 3.17Å; T694-V698 HydrophobicContact CG2-CG2 4.33Å; T694-V698 WeakPolarHBondContact O-CG2 3.37Å; T694-V698 PolarHBondContact O-N 2.96Å
695	T	94.7	Very high	92.7	Very high	76 Å²	76	53.5 Å²	53.5	47%	0.466	30%	0.3	S	S	.	.	H	α-helix	trans	-57	-47.5	177.1	-62	0	0	0	0	111.4	L691 F692 F697 V698 M699	L691-T695 WeakPolarHBondContact O-CB 3.35Å; L691-T695 PolarHBondContact O-N 2.95Å; L691-T695 PolarHBondContact O-OG1 3.19Å; F692-T695 PolarHBondContact O-N 2.05Å; T695-F697 PolarHBondContact O-N 3.35Å; T695-V698 PolarHBondContact O-N 3.12Å; T695-M699 HydrophobicContact CG2-CG 4.26Å; T695-M699 HydrophobicContact CG2-SD 3.65Å; T695-M699 WeakPolarHBondContact O-CB 3.29Å; T695-M699 VanDerWaalsContact O-CG 3.23Å; T695-M699 WeakPolarHBondContact O-CG 3.47Å; T695-M699 PolarHBondContact O-N 3.29Å
696	I	94	Very high	92.2	Very high	24 Å²	24	50.9 Å²	50.9	12%	0.123	28%	0.278	C	S	.	.	H	α-helix	trans	-62.9	-42.4	177.4	-63.7	-58.6	0	0	0	111.6	F692 T693 T694 V698 K700 L917 I920 L921	F692-I696 HydrophobicContact CE1-CG1 4.27Å; F692-I696 HydrophobicContact CE2-CD1 4.36Å; F692-I696 HydrophobicContact CE2-CG1 4.19Å; F692-I696 HydrophobicContact CZ-CD1 4.41Å; F692-I696 HydrophobicContact CZ-CG1 4.03Å; F692-I696 WeakPolarHBondContact O-CG1 3.16Å; F692-I696 PolarHBondContact O-N 3.04Å; T693-I696 PolarHBondContact O-N 2.85Å; T694-I696 PolarHBondContact O-N 2.84Å; I696-V698 PolarHBondContact O-N 2.96Å; I696-K700 VanDerWaalsContact O-CB 3.32Å; I696-K700 WeakPolarHBondContact O-CB 3.34Å; I696-K700 PolarHBondContact O-N 3.15Å; I696-L917 HydrophobicContact CB-CD2 3.85Å; I696-L917 HydrophobicContact CG1-CD2 4.37Å; I696-L917 HydrophobicContact CG2-CD2 3.63Å; I696-I920 HydrophobicContact CG2-CG2 4Å; I696-L921 HydrophobicContact CD1-CD2 4.24Å; I696-L921 HydrophobicContact CG2-CD2 4.48Å
697	F	92.5	Very high	91.5	Very high	1 Å²	1	56.3 Å²	56.3	0%	0.004	30%	0.3	C	S	.	.	H	α-helix	trans	-65.1	-38.4	178.8	-92.3	-119.3	0	0	0	112.8	T693 T694 T695 N701 V706 Y715 F913 K916 L917 I920	T693-F697 HydrophobicContact CG2-CD2 4.11Å; T693-F697 HydrophobicContact CG2-CE2 4.16Å; T693-F697 WeakPolarHBondContact O-CB 3.21Å; T693-F697 VanDerWaalsContact O-CD2 3.28Å; T693-F697 WeakPolarHBondContact O-CD2 3.38Å; T693-F697 PolarHBondContact O-N 3.41Å; T694-F697 PolarHBondContact O-N 3.35Å; T694-F697 VanDerWaalsContact O-N 3.17Å; T695-F697 PolarHBondContact O-N 3.35Å; F697-N701 VanDerWaalsContact O-CA 3.3Å; F697-N701 WeakPolarHBondContact O-CA 3.43Å; F697-N701 WeakPolarHBondContact O-CB 3.47Å; F697-N701 PolarHBondContact O-N 3.34Å; F697-N701 VanDerWaalsContact O-N 3.16Å; F697-V706 HydrophobicContact CD1-CG1 4.2Å; F697-V706 HydrophobicContact CD1-CG2 4.21Å; F697-V706 HydrophobicContact CE1-CG2 4.29Å; F697-V706 HydrophobicContact CG-CG2 4.49Å; F697-Y715 HydrophobicContact CB-CE1 4.16Å; F697-F913 AromaticContact CE1-CD1 3.99Å; F697-F913 HydrophobicContact CE1-CD1 3.99Å; F697-F913 AromaticContact CE1-CE1 3.99Å; F697-F913 HydrophobicContact CE1-CE1 3.99Å; F697-F913 AromaticContact CE2-CD1 3.96Å; F697-F913 HydrophobicContact CE2-CD1 3.96Å; F697-F913 AromaticContact CZ-CD1 3.57Å; F697-F913 HydrophobicContact CZ-CD1 3.57Å; F697-F913 HydrophobicContact CZ-CE1 4.06Å; F697-K916 HydrophobicContact CE2-CB 4.46Å; F697-K916 HydrophobicContact CZ-CB 4Å; F697-K916 HydrophobicContact CZ-CD 4.02Å; F697-L917 HydrophobicContact CD2-CD2 4.12Å; F697-L917 HydrophobicContact CE2-CD2 3.94Å; F697-L917 HydrophobicContact CE2-CG 4.28Å; F697-I920 HydrophobicContact CE2-CD1 4.35Å
698	V	92.4	Very high	90.4	Very high	74 Å²	74	56.9 Å²	56.9	45%	0.448	31%	0.31	S	S	.	.	H	α-helix	trans	-69.6	-49.3	176.2	172.6	0	0	0	0	110.6	T694 T695 I696 K700 N701 Y715	T694-V698 HydrophobicContact CG2-CG2 4.33Å; T694-V698 WeakPolarHBondContact O-CG2 3.37Å; T694-V698 PolarHBondContact O-N 2.96Å; T695-V698 PolarHBondContact O-N 3.12Å; I696-V698 PolarHBondContact O-N 2.96Å; V698-K700 PolarHBondContact O-N 3.22Å; V698-N701 WeakPolarHBondContact O-CB 3.11Å; V698-N701 PolarHBondContact O-N 3.46Å; V698-N701 PolarHBondContact O-ND2 3.12Å; V698-Y715 HydrophobicContact CG2-CE1 3.81Å
699	M	92.7	Very high	89.5	Confident	134 Å²	134	51.5 Å²	51.5	66%	0.66	28%	0.282	S	S	*	.	H	α-helix	trans	-65.1	-37.9	-179.3	-70.7	178.5	75.8	0	0	112.7	T695	T695-M699 HydrophobicContact CG2-CG 4.26Å; T695-M699 HydrophobicContact CG2-SD 3.65Å; T695-M699 WeakPolarHBondContact O-CB 3.29Å; T695-M699 VanDerWaalsContact O-CG 3.23Å; T695-M699 WeakPolarHBondContact O-CG 3.47Å; T695-M699 PolarHBondContact O-N 3.29Å
700	K	90.2	Very high	89	Confident	108 Å²	108	50 Å²	50	47%	0.47	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.1	29.8	-178.5	-59.5	-63.2	-173.3	-179	0	112.4	I696 V698 T702 T703 I920	I696-K700 VanDerWaalsContact O-CB 3.32Å; I696-K700 WeakPolarHBondContact O-CB 3.34Å; I696-K700 PolarHBondContact O-N 3.15Å; V698-K700 PolarHBondContact O-N 3.22Å; K700-T702 PolarHBondContact O-N 2.99Å; K700-T703 HydrophobicContact CB-CG2 3.89Å; K700-T703 WeakPolarHBondContact O-CB 3.41Å; K700-T703 WeakPolarHBondContact O-CG2 3.4Å; K700-T703 PolarHBondContact O-N 2.57Å; K700-T703 VanDerWaalsContact O-N 3.08Å; K700-T703 PolarHBondContact O-OG1 2.93Å; K700-I920 HydrophobicContact CB-CG2 4.21Å; K700-I920 HydrophobicContact CG-CG2 4.11Å
701	N	88.1	Confident	88.6	Confident	56 Å²	56	54 Å²	54	30%	0.299	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-13.5	-175.9	73.2	24.9	0	0	0	114.8	F697 V698 R711	F697-N701 VanDerWaalsContact O-CA 3.3Å; F697-N701 WeakPolarHBondContact O-CA 3.43Å; F697-N701 WeakPolarHBondContact O-CB 3.47Å; F697-N701 PolarHBondContact O-N 3.34Å; F697-N701 VanDerWaalsContact O-N 3.16Å; V698-N701 WeakPolarHBondContact O-CB 3.11Å; V698-N701 PolarHBondContact O-N 3.46Å; V698-N701 PolarHBondContact O-ND2 3.12Å; N701-R711 PolarHBondContact O-NH1 3.24Å; N701-R711 VanDerWaalsContact O-NH1 3.07Å
702	T	85.5	Confident	88.3	Confident	88 Å²	88	54.3 Å²	54.3	54%	0.54	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.9	-13.1	179.7	56	0	0	0	0	113.1	K700 K707	K700-T702 PolarHBondContact O-N 2.99Å; T702-K707 WeakPolarHBondContact O-CD 3.28Å; T702-K707 VanDerWaalsContact O-CE 3.29Å; T702-K707 WeakPolarHBondContact O-CE 3.27Å; T702-K707 PolarHBondContact O-NZ 3.22Å
703	T	86.3	Confident	88.1	Confident	17 Å²	17	49 Å²	49	10%	0.104	26%	0.26	C	S	.	.	S	Bend	trans	-67.3	143.8	-175.7	56.7	0	0	0	0	112.6	K700 V705 V706 K707 N927	K700-T703 HydrophobicContact CB-CG2 3.89Å; K700-T703 WeakPolarHBondContact O-CB 3.41Å; K700-T703 WeakPolarHBondContact O-CG2 3.4Å; K700-T703 PolarHBondContact O-N 2.57Å; K700-T703 VanDerWaalsContact O-N 3.08Å; K700-T703 PolarHBondContact O-OG1 2.93Å; T703-V705 VanDerWaalsContact C-N 3.26Å; T703-V705 PolarHBondContact O-N 3.25Å; T703-V706 PolarHBondContact O-N 2.84Å; T703-V706 VanDerWaalsContact OG1-CG2 3.31Å; T703-V706 WeakPolarHBondContact OG1-CG2 3.31Å; T703-K707 WeakPolarHBondContact O-CB 3.16Å; T703-K707 PolarHBondContact O-N 2.83Å; T703-N927 WeakPolarHBondContact CB-ND2 3.31Å; T703-N927 VanDerWaalsContact CG2-ND2 3.33Å; T703-N927 WeakPolarHBondContact CG2-ND2 3.28Å
704	P	82.9	Confident	88	Confident	46 Å²	46	48.9 Å²	48.9	30%	0.299	26%	0.259	S	S	.	.	H	α-helix	trans	-54	-38	177.8	-30.8	37.1	0	0	0	114.2	K707 A708 N927	P704-K707 PolarHBondContact O-N 3.19Å; P704-A708 WeakPolarHBondContact O-CB 3.15Å; P704-A708 PolarHBondContact O-N 3.38Å; P704-N927 WeakPolarHBondContact CD-OD1 3.39Å; P704-N927 WeakPolarHBondContact CG-O 3.44Å
705	V	84.2	Confident	88	Confident	11 Å²	11	50 Å²	50	7%	0.067	26%	0.259	C	S	.	.	H	α-helix	trans	-61.4	-49.8	177.5	173.4	0	0	0	0	111.2	T703 A708 T709 K916 V919 I920 N927 F932	T703-V705 VanDerWaalsContact C-N 3.26Å; T703-V705 PolarHBondContact O-N 3.25Å; V705-A708 PolarHBondContact O-N 2.89Å; V705-T709 WeakPolarHBondContact O-CG2 3.33Å; V705-T709 PolarHBondContact O-N 2.93Å; V705-K916 HydrophobicContact CG1-CB 4.18Å; V705-K916 HydrophobicContact CG1-CG 4.24Å; V705-V919 HydrophobicContact CG2-CG1 3.72Å; V705-I920 HydrophobicContact CB-CG1 4.37Å; V705-I920 HydrophobicContact CG1-CD1 4.35Å; V705-I920 HydrophobicContact CG1-CG1 4.35Å; V705-N927 HydrophobicContact CG2-CB 4.37Å; V705-N927 VanDerWaalsContact CG2-OD1 3.26Å; V705-N927 WeakPolarHBondContact CG2-OD1 3.35Å; V705-N927 PolarHBondContact N-OD1 3.35Å; V705-F932 HydrophobicContact CG2-CE2 4.27Å; V705-F932 HydrophobicContact CG2-CZ 4.06Å
706	V	85.1	Confident	87.9	Confident	1 Å²	1	47.9 Å²	47.9	1%	0.006	24%	0.244	C	C	.	.	H	α-helix	trans	-68.8	-40.4	-179.8	177.5	0	0	0	0	110.8	F697 T703 T709 R711 I920	F697-V706 HydrophobicContact CD1-CG1 4.2Å; F697-V706 HydrophobicContact CD1-CG2 4.21Å; F697-V706 HydrophobicContact CE1-CG2 4.29Å; F697-V706 HydrophobicContact CG-CG2 4.49Å; T703-V706 PolarHBondContact O-N 2.84Å; T703-V706 VanDerWaalsContact OG1-CG2 3.31Å; T703-V706 WeakPolarHBondContact OG1-CG2 3.31Å; V706-T709 CarbonylContact O-C 3.59Å; V706-T709 PolarHBondContact O-N 2.98Å; V706-T709 PolarHBondContact O-OG1 2.61Å; V706-R711 HydrophobicContact CG1-CG 3.78Å; V706-R711 WeakPolarHBondContact O-CG 3.49Å; V706-I920 HydrophobicContact CG2-CD1 3.67Å
707	K	82.3	Confident	88	Confident	120 Å²	120	46.9 Å²	46.9	52%	0.522	24%	0.239	S	C	.	.	H	α-helix	trans	-68.5	-31.5	176.9	-78.7	-179.8	173	155.1	0	114.3	T702 T703 P704 T709	T702-K707 WeakPolarHBondContact O-CD 3.28Å; T702-K707 VanDerWaalsContact O-CE 3.29Å; T702-K707 WeakPolarHBondContact O-CE 3.27Å; T702-K707 PolarHBondContact O-NZ 3.22Å; T703-K707 WeakPolarHBondContact O-CB 3.16Å; T703-K707 PolarHBondContact O-N 2.83Å; P704-K707 PolarHBondContact O-N 3.19Å; K707-T709 CarbonylContact C-O 3.56Å; K707-T709 PolarHBondContact O-N 2.93Å
708	A	74	Confident	88.2	Confident	44 Å²	44	47 Å²	47	36%	0.364	24%	0.24	S	C	.	.	H	α-helix	trans	-65.8	-33	175.7	0	0	0	0	0	110.9	P704 V705 F932	P704-A708 WeakPolarHBondContact O-CB 3.15Å; P704-A708 PolarHBondContact O-N 3.38Å; V705-A708 PolarHBondContact O-N 2.89Å; A708-F932 HydrophobicContact CB-CD1 4.43Å; A708-F932 HydrophobicContact CB-CE1 4.36Å
709	T	79.8	Confident	88.4	Confident	7 Å²	7	44.8 Å²	44.8	4%	0.043	23%	0.231	C	C	.	.	S	Bend	trans	-80.9	149.4	170.9	71.7	0	0	0	0	111.2	V705 V706 K707 R711 E865 K916	V705-T709 WeakPolarHBondContact O-CG2 3.33Å; V705-T709 PolarHBondContact O-N 2.93Å; V706-T709 CarbonylContact O-C 3.59Å; V706-T709 PolarHBondContact O-N 2.98Å; V706-T709 PolarHBondContact O-OG1 2.61Å; K707-T709 CarbonylContact C-O 3.56Å; K707-T709 PolarHBondContact O-N 2.93Å; T709-R711 PolarHBondContact O-N 3.39Å; T709-E865 WeakPolarHBondContact CG2-OE1 3.47Å; T709-K916 HydrophobicContact CG2-CD 4.25Å
710	T	85	Confident	88.5	Confident	8 Å²	8	38.4 Å²	38.4	5%	0.049	20%	0.2	C	C	.	.			trans	-70.7	100.3	172.5	-49.7	0	0	0	0	109.1	E712 L713 S714 R764 T785 Q788	T710-E712 VanDerWaalsContact C-N 3.35Å; T710-E712 PolarHBondContact O-N 3.3Å; T710-L713 HydrophobicContact CG2-CB 4.3Å; T710-L713 HydrophobicContact CG2-CD1 4.01Å; T710-L713 HydrophobicContact CG2-CG 3.77Å; T710-L713 PolarHBondContact O-N 2.88Å; T710-L713 VanDerWaalsContact O-N 3.16Å; T710-S714 PolarHBondContact O-N 3.27Å; T710-S714 VanDerWaalsContact O-N 3.09Å; T710-S714 PolarHBondContact O-OG 3.18Å; T710-R764 PolarHBondContact OG1-NH1 3.3Å; T710-T785 HydrophobicContact CG2-CG2 3.9Å; T710-Q788 VanDerWaalsContact CG2-OE1 3.3Å; T710-Q788 PolarHBondContact OG1-OE1 3.11Å
711	R	87.8	Confident	88.9	Confident	85 Å²	85	33.2 Å²	33.2	32%	0.321	18%	0.178	S	C	.	.	H	α-helix	trans	-53.2	-46.9	-174.2	-62	-174.8	-63.4	175.8	7.1	113.3	N701 V706 T709 L713 S714 Y715	N701-R711 PolarHBondContact O-NH1 3.24Å; N701-R711 VanDerWaalsContact O-NH1 3.07Å; V706-R711 HydrophobicContact CG1-CG 3.78Å; V706-R711 WeakPolarHBondContact O-CG 3.49Å; T709-R711 PolarHBondContact O-N 3.39Å; R711-L713 VanDerWaalsContact C-N 3.34Å; R711-L713 PolarHBondContact O-N 3.2Å; R711-S714 WeakPolarHBondContact O-CA 3.17Å; R711-S714 WeakPolarHBondContact O-CB 3.37Å; R711-S714 PolarHBondContact O-N 3.03Å; R711-Y715 HydrophobicContact CB-CE2 4.24Å; R711-Y715 WeakPolarHBondContact O-CD2 3.41Å; R711-Y715 PolarHBondContact O-N 3.33Å
712	E	91.1	Very high	89.3	Confident	86 Å²	86	33.2 Å²	33.2	40%	0.402	18%	0.177	S	C	.	.	H	α-helix	trans	-59.1	-42.6	179.6	-47.8	-45	137.1	0	0	112.8	T710 S714 Y715 M716 T785 V789	T710-E712 VanDerWaalsContact C-N 3.35Å; T710-E712 PolarHBondContact O-N 3.3Å; E712-S714 VanDerWaalsContact C-N 3.33Å; E712-S714 PolarHBondContact O-N 2.78Å; E712-Y715 PolarHBondContact O-N 2.88Å; E712-M716 PolarHBondContact O-N 3.29Å; E712-T785 HydrophobicContact CG-CG2 4.11Å; E712-V789 HydrophobicContact CB-CG2 3.58Å; E712-V789 HydrophobicContact CG-CG2 4.07Å
713	L	91.7	Very high	89.8	Confident	0 Å²	0	32 Å²	32	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-66.2	-38.1	176	-63	-178.3	0	0	0	111.3	T710 R711 Y715 M716 I717 A757 T760 K761 Q788 T792	T710-L713 HydrophobicContact CG2-CB 4.3Å; T710-L713 HydrophobicContact CG2-CD1 4.01Å; T710-L713 HydrophobicContact CG2-CG 3.77Å; T710-L713 PolarHBondContact O-N 2.88Å; T710-L713 VanDerWaalsContact O-N 3.16Å; R711-L713 VanDerWaalsContact C-N 3.34Å; R711-L713 PolarHBondContact O-N 3.2Å; L713-Y715 VanDerWaalsContact C-N 3.34Å; L713-M716 HydrophobicContact CD2-CE 3.34Å; L713-M716 HydrophobicContact CG-CE 4.38Å; L713-M716 PolarHBondContact O-N 3.12Å; L713-I717 WeakPolarHBondContact O-CG1 3.36Å; L713-I717 PolarHBondContact O-N 2.97Å; L713-A757 HydrophobicContact CB-CB 4.43Å; L713-A757 HydrophobicContact CD2-CB 4.39Å; L713-T760 HydrophobicContact CD1-CG2 4.04Å; L713-T760 HydrophobicContact CD2-CG2 4.26Å; L713-K761 HydrophobicContact CD1-CB 4.15Å; L713-Q788 HydrophobicContact CD1-CB 4.32Å; L713-Q788 HydrophobicContact CD2-CB 4.42Å; L713-T792 WeakPolarHBondContact CD2-OG1 3.49Å
714	S	92.8	Very high	90.3	Very high	1 Å²	1	31.1 Å²	31.1	1%	0.007	16%	0.162	C	C	.	.	H	α-helix	trans	-63.8	-39.4	177.2	-60.8	0	0	0	0	111.7	T710 R711 E712 I717 L718	T710-S714 PolarHBondContact O-N 3.27Å; T710-S714 VanDerWaalsContact O-N 3.09Å; T710-S714 PolarHBondContact O-OG 3.18Å; R711-S714 WeakPolarHBondContact O-CA 3.17Å; R711-S714 WeakPolarHBondContact O-CB 3.37Å; R711-S714 PolarHBondContact O-N 3.03Å; E712-S714 VanDerWaalsContact C-N 3.33Å; E712-S714 PolarHBondContact O-N 2.78Å; S714-I717 PolarHBondContact O-N 3.19Å; S714-L718 WeakPolarHBondContact O-CG 3.46Å; S714-L718 PolarHBondContact O-N 3.03Å
715	Y	93.9	Very high	90.9	Very high	64 Å²	64	29 Å²	29	25%	0.251	15%	0.148	S	C	.	.	H	α-helix	trans	-67.7	-38.4	175	-64.2	-45.7	0	0	0	112.6	F697 V698 R711 E712 L713 I717 L718 G719	F697-Y715 HydrophobicContact CB-CE1 4.16Å; V698-Y715 HydrophobicContact CG2-CE1 3.81Å; R711-Y715 HydrophobicContact CB-CE2 4.24Å; R711-Y715 WeakPolarHBondContact O-CD2 3.41Å; R711-Y715 PolarHBondContact O-N 3.33Å; E712-Y715 PolarHBondContact O-N 2.88Å; L713-Y715 VanDerWaalsContact C-N 3.34Å; Y715-I717 VanDerWaalsContact C-N 3.33Å; Y715-I717 PolarHBondContact O-N 3.08Å; Y715-L718 HydrophobicContact CD1-CD1 4.39Å; Y715-L718 PolarHBondContact O-N 2.76Å; Y715-G719 PolarHBondContact O-N 3.26Å
716	M	94.6	Very high	91.5	Very high	31 Å²	31	31.2 Å²	31.2	15%	0.153	16%	0.161	C	C	.	.	H	α-helix	trans	-61.9	-40.3	173.1	-73.1	-171.4	-73.8	0	0	112.3	E712 L713 G719 G720 M753 A757 V789 T792	E712-M716 PolarHBondContact O-N 3.29Å; L713-M716 HydrophobicContact CD2-CE 3.34Å; L713-M716 HydrophobicContact CG-CE 4.38Å; L713-M716 PolarHBondContact O-N 3.12Å; M716-G719 PolarHBondContact O-N 3.25Å; M716-G720 PolarHBondContact O-N 2.83Å; M716-M753 WeakPolarHBondContact O-CE 3.41Å; M716-A757 HydrophobicContact CB-CB 4.43Å; M716-V789 HydrophobicContact CE-CG1 4.41Å; M716-V789 HydrophobicContact CE-CG2 4.35Å; M716-T792 HydrophobicContact CE-CG2 3.8Å; M716-T792 HydrophobicContact SD-CG2 3.84Å
717	I	95.3	Very high	91.9	Very high	3 Å²	3	31.2 Å²	31.2	2%	0.015	16%	0.161	C	C	.	.	H	α-helix	trans	-62.7	-49.2	174.1	-64.8	167	0	0	0	110.1	L713 S714 Y715 G719 G720 L721 I754 A757 L758 F913	L713-I717 WeakPolarHBondContact O-CG1 3.36Å; L713-I717 PolarHBondContact O-N 2.97Å; S714-I717 PolarHBondContact O-N 3.19Å; Y715-I717 VanDerWaalsContact C-N 3.33Å; Y715-I717 PolarHBondContact O-N 3.08Å; I717-G719 VanDerWaalsContact C-N 3.3Å; I717-G719 PolarHBondContact O-N 2.83Å; I717-G720 PolarHBondContact O-N 2.86Å; I717-G720 VanDerWaalsContact O-N 3.12Å; I717-L721 HydrophobicContact CG2-CD1 4.09Å; I717-L721 HydrophobicContact CG2-CG 4.21Å; I717-L721 VanDerWaalsContact O-CG 3.3Å; I717-L721 WeakPolarHBondContact O-CG 3.31Å; I717-L721 PolarHBondContact O-N 3.01Å; I717-I754 HydrophobicContact CG2-CG2 4.48Å; I717-A757 HydrophobicContact CD1-CB 4.1Å; I717-A757 HydrophobicContact CG1-CB 3.57Å; I717-L758 HydrophobicContact CD1-CD2 3.99Å; I717-L758 HydrophobicContact CD1-CG 4.07Å; I717-F913 HydrophobicContact CB-CE2 4.43Å; I717-F913 HydrophobicContact CB-CZ 4.19Å; I717-F913 HydrophobicContact CG2-CE2 3.69Å; I717-F913 HydrophobicContact CG2-CZ 3.96Å
718	L	96.1	Very high	92.5	Very high	4 Å²	4	25.5 Å²	25.5	2%	0.021	14%	0.136	C	C	.	.	H	α-helix	trans	-60.2	-38.6	179.5	-72.8	165.3	0	0	0	112.6	T690 T693 S714 Y715 L721 L722 L909 F913	T690-L718 HydrophobicContact CG2-CD2 4.2Å; T693-L718 HydrophobicContact CG2-CD1 4.46Å; T693-L718 HydrophobicContact CG2-CD2 3.69Å; S714-L718 WeakPolarHBondContact O-CG 3.46Å; S714-L718 PolarHBondContact O-N 3.03Å; Y715-L718 HydrophobicContact CD1-CD1 4.39Å; Y715-L718 PolarHBondContact O-N 2.76Å; L718-L721 HydrophobicContact CD2-CD1 4.44Å; L718-L721 PolarHBondContact O-N 3.23Å; L718-L722 PolarHBondContact O-N 2.95Å; L718-L909 HydrophobicContact CD2-CD1 4.41Å; L718-F913 HydrophobicContact CD1-CE1 3.95Å; L718-F913 HydrophobicContact CD1-CZ 4.32Å; L718-F913 HydrophobicContact CD2-CD1 4.26Å; L718-F913 HydrophobicContact CD2-CD2 4.4Å; L718-F913 HydrophobicContact CD2-CE1 4.01Å; L718-F913 HydrophobicContact CD2-CE2 4.15Å; L718-F913 HydrophobicContact CD2-CG 4.46Å; L718-F913 HydrophobicContact CD2-CZ 3.94Å; L718-F913 HydrophobicContact CG-CE1 3.84Å; L718-F913 HydrophobicContact CG-CE2 4.36Å; L718-F913 HydrophobicContact CG-CZ 3.73Å
719	G	96.2	Very high	93.5	Very high	26 Å²	26	26.1 Å²	26.1	27%	0.268	13%	0.131	S	C	.	.	H	α-helix	trans	-62.5	-43.9	172.8	0	0	0	0	0	112.6	Y715 M716 I717 L722 L723	Y715-G719 PolarHBondContact O-N 3.26Å; M716-G719 PolarHBondContact O-N 3.25Å; I717-G719 VanDerWaalsContact C-N 3.3Å; I717-G719 PolarHBondContact O-N 2.83Å; G719-L722 PolarHBondContact O-N 2.69Å; G719-L723 WeakPolarHBondContact O-CG 3.46Å; G719-L723 PolarHBondContact O-N 3.26Å; G719-L723 VanDerWaalsContact O-N 3.11Å
720	G	96.3	Very high	94.2	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-64.4	-40.3	175.8	0	0	0	0	0	112.5	M716 I717 L722 L723 C724	M716-G720 PolarHBondContact O-N 2.83Å; I717-G720 PolarHBondContact O-N 2.86Å; I717-G720 VanDerWaalsContact O-N 3.12Å; G720-L722 VanDerWaalsContact C-N 3.33Å; G720-L722 PolarHBondContact O-N 3.46Å; G720-L723 PolarHBondContact O-N 3Å; G720-C724 PolarHBondContact O-N 2.93Å; G720-C724 PolarHBondContact O-SG 3.44Å; G720-C724 VanDerWaalsContact O-SG 3.41Å
721	L	97	Very high	94.6	Very high	0 Å²	0	27 Å²	27	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-61	-41.8	175.2	-65.5	177.1	0	0	0	112	T690 I717 L718 C724 Y725 I754 A905 A908 L909 F913	T690-L721 HydrophobicContact CG2-CB 4.17Å; I717-L721 HydrophobicContact CG2-CD1 4.09Å; I717-L721 HydrophobicContact CG2-CG 4.21Å; I717-L721 VanDerWaalsContact O-CG 3.3Å; I717-L721 WeakPolarHBondContact O-CG 3.31Å; I717-L721 PolarHBondContact O-N 3.01Å; L718-L721 HydrophobicContact CD2-CD1 4.44Å; L718-L721 PolarHBondContact O-N 3.23Å; L721-C724 PolarHBondContact O-N 3.11Å; L721-Y725 WeakPolarHBondContact O-CD2 3.44Å; L721-Y725 PolarHBondContact O-N 3.47Å; L721-I754 HydrophobicContact CD2-CD1 3.76Å; L721-I754 HydrophobicContact CD2-CG1 4.29Å; L721-I754 HydrophobicContact CG-CD1 4.38Å; L721-A905 HydrophobicContact CD2-CB 3.9Å; L721-A905 WeakPolarHBondContact CD2-O 3.42Å; L721-A908 HydrophobicContact CD2-CB 3.77Å; L721-L909 HydrophobicContact CD1-CB 4.16Å; L721-L909 HydrophobicContact CD1-CD1 4.1Å; L721-F913 HydrophobicContact CD1-CD2 4.41Å; L721-F913 HydrophobicContact CD1-CE2 4.08Å
722	L	96.9	Very high	94.8	Very high	56 Å²	56	23 Å²	23	29%	0.293	12%	0.12	S	C	.	.	H	α-helix	trans	-61.5	-46.1	176.1	-175.8	66.9	0	0	0	111.3	I687 T690 L691 L718 G719 G720 C724 Y725 V726	I687-L722 HydrophobicContact CB-CD1 4.46Å; I687-L722 HydrophobicContact CG1-CD1 4.22Å; I687-L722 HydrophobicContact CG2-CD1 3.97Å; T690-L722 HydrophobicContact CG2-CB 4.26Å; L691-L722 HydrophobicContact CD2-CD1 4.43Å; L718-L722 PolarHBondContact O-N 2.95Å; G719-L722 PolarHBondContact O-N 2.69Å; G720-L722 VanDerWaalsContact C-N 3.33Å; G720-L722 PolarHBondContact O-N 3.46Å; L722-C724 VanDerWaalsContact C-N 3.34Å; L722-C724 PolarHBondContact O-N 3.45Å; L722-Y725 PolarHBondContact O-N 2.97Å; L722-V726 WeakPolarHBondContact O-CG2 3.34Å; L722-V726 PolarHBondContact O-N 3.26Å
723	L	96.3	Very high	94.7	Very high	61 Å²	61	21 Å²	21	32%	0.319	11%	0.113	S	C	.	.	H	α-helix	trans	-63.2	-37	178	-69.2	174.2	0	0	0	112.7	G719 G720 Y725 V726 T727 V746 A750 M753	G719-L723 WeakPolarHBondContact O-CG 3.46Å; G719-L723 PolarHBondContact O-N 3.26Å; G719-L723 VanDerWaalsContact O-N 3.11Å; G720-L723 PolarHBondContact O-N 3Å; L723-Y725 VanDerWaalsContact C-N 3.34Å; L723-Y725 PolarHBondContact O-N 3.07Å; L723-V726 PolarHBondContact O-N 3.35Å; L723-T727 PolarHBondContact O-N 2.95Å; L723-T727 PolarHBondContact O-OG1 2.94Å; L723-V746 HydrophobicContact CB-CG1 4.42Å; L723-A750 HydrophobicContact CB-CB 3.62Å; L723-M753 HydrophobicContact CD1-CE 4.45Å; L723-M753 HydrophobicContact CD1-SD 3.81Å
724	C	96.3	Very high	94.6	Very high	0 Å²	0	23 Å²	23	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-59.4	-42.4	172.9	-73.5	0	0	0	0	112.2	G720 L721 L722 T727 A905	G720-C724 PolarHBondContact O-N 2.93Å; G720-C724 PolarHBondContact O-SG 3.44Å; G720-C724 VanDerWaalsContact O-SG 3.41Å; L721-C724 PolarHBondContact O-N 3.11Å; L722-C724 VanDerWaalsContact C-N 3.34Å; L722-C724 PolarHBondContact O-N 3.45Å; C724-T727 VanDerWaalsContact O-CB 3.31Å; C724-T727 WeakPolarHBondContact O-CB 3.28Å; C724-T727 PolarHBondContact O-N 3.32Å; C724-A905 HydrophobicContact CB-CB 3.75Å
725	Y	96.9	Very high	94.5	Very high	2 Å²	2	24.2 Å²	24.2	1%	0.008	13%	0.134	C	C	.	.	H	α-helix	trans	-73.2	-34.6	177.5	-64.7	-61.6	0	0	0	113.1	G686 I687 T690 L721 L722 L723 T727 T728 S902 A905 S906	G686-Y725 VanDerWaalsContact CA-CZ 3.48Å; G686-Y725 WeakPolarHBondContact O-CE2 3.46Å; I687-Y725 HydrophobicContact CG1-CG 4.31Å; T690-Y725 WeakPolarHBondContact OG1-CE2 3.03Å; L721-Y725 WeakPolarHBondContact O-CD2 3.44Å; L721-Y725 PolarHBondContact O-N 3.47Å; L722-Y725 PolarHBondContact O-N 2.97Å; L723-Y725 VanDerWaalsContact C-N 3.34Å; L723-Y725 PolarHBondContact O-N 3.07Å; Y725-T727 PolarHBondContact O-N 3.35Å; Y725-T728 WeakPolarHBondContact O-CB 3.37Å; Y725-T728 PolarHBondContact O-N 3.29Å; Y725-T728 PolarHBondContact O-OG1 3.31Å; Y725-S902 WeakPolarHBondContact CE1-O 3.35Å; Y725-A905 HydrophobicContact CD1-CB 4.44Å; Y725-A905 HydrophobicContact CD2-CB 4.48Å; Y725-A905 HydrophobicContact CE1-CB 3.92Å; Y725-A905 HydrophobicContact CE2-CB 3.93Å; Y725-S906 WeakPolarHBondContact OH-CA 3.43Å; Y725-S906 PolarHBondContact OH-N 3.4Å; Y725-S906 VanDerWaalsContact OH-N 3.13Å; Y725-S906 PolarHBondContact OH-OG 3.23Å; Y725-S906 VanDerWaalsContact OH-OG 3.1Å
726	V	95.8	Very high	94.3	Very high	56 Å²	56	22.3 Å²	22.3	34%	0.339	13%	0.13	S	C	.	.	H	α-helix	trans	-61.8	-32	174.6	169.9	0	0	0	0	111.6	I687 L722 L723 T728 F729	I687-V726 HydrophobicContact CD1-CG2 4.49Å; L722-V726 WeakPolarHBondContact O-CG2 3.34Å; L722-V726 PolarHBondContact O-N 3.26Å; L723-V726 PolarHBondContact O-N 3.35Å; V726-T728 PolarHBondContact O-N 3.25Å; V726-T728 VanDerWaalsContact O-N 3.14Å; V726-F729 PolarHBondContact O-N 3.06Å
727	T	94.6	Very high	94	Very high	1 Å²	1	24.9 Å²	24.9	1%	0.006	15%	0.147	C	C	.	.	H	α-helix	trans	-53.2	-35.1	177.2	-60.9	0	0	0	0	113	L723 C724 Y725 F729 I730 I731 L743 P747 F901	L723-T727 PolarHBondContact O-N 2.95Å; L723-T727 PolarHBondContact O-OG1 2.94Å; C724-T727 VanDerWaalsContact O-CB 3.31Å; C724-T727 WeakPolarHBondContact O-CB 3.28Å; C724-T727 PolarHBondContact O-N 3.32Å; Y725-T727 PolarHBondContact O-N 3.35Å; T727-F729 VanDerWaalsContact C-N 3.26Å; T727-F729 PolarHBondContact O-N 3.5Å; T727-I730 WeakPolarHBondContact O-CB 3.01Å; T727-I730 PolarHBondContact O-N 2.78Å; T727-I731 HydrophobicContact CG2-CD1 3.86Å; T727-I731 HydrophobicContact CG2-CG1 4.27Å; T727-I731 WeakPolarHBondContact O-CG1 3.49Å; T727-I731 PolarHBondContact O-N 3.11Å; T727-L743 HydrophobicContact CG2-CD1 4.44Å; T727-P747 HydrophobicContact CG2-CB 4.43Å; T727-P747 HydrophobicContact CG2-CG 3.61Å; T727-F901 HydrophobicContact CG2-CD2 3.74Å; T727-F901 HydrophobicContact CG2-CE2 4.18Å
728	T	94.4	Very high	93.8	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-57.6	-38.4	178.4	-58.3	0	0	0	0	112.4	C679 A683 Y725 V726 I730 I731 V732 C898 S902	C679-T728 HydrophobicContact CB-CG2 3.88Å; A683-T728 HydrophobicContact CB-CG2 3.91Å; Y725-T728 WeakPolarHBondContact O-CB 3.37Å; Y725-T728 PolarHBondContact O-N 3.29Å; Y725-T728 PolarHBondContact O-OG1 3.31Å; V726-T728 PolarHBondContact O-N 3.25Å; V726-T728 VanDerWaalsContact O-N 3.14Å; T728-I730 VanDerWaalsContact C-N 3.34Å; T728-I731 PolarHBondContact O-N 2.81Å; T728-V732 VanDerWaalsContact O-CG2 3.32Å; T728-V732 WeakPolarHBondContact O-CG2 3.28Å; T728-V732 PolarHBondContact O-N 3.5Å; T728-V732 VanDerWaalsContact O-N 3.17Å; T728-C898 HydrophobicContact CG2-CB 4.37Å; T728-S902 PolarHBondContact OG1-OG 3.2Å; T728-S902 VanDerWaalsContact OG1-OG 3.08Å
729	F	94.7	Very high	93.6	Very high	58 Å²	58	30 Å²	30	25%	0.254	18%	0.179	S	C	.	.	H	α-helix	trans	-70.9	-32.4	178.5	-62.3	-91.9	0	0	0	112.1	W671 V680 A683 I687 V726 T727 T733	W671-F729 HydrophobicContact CH2-CD1 4.13Å; W671-F729 HydrophobicContact CZ3-CD1 4.25Å; V680-F729 HydrophobicContact CG1-CE1 3.93Å; V680-F729 HydrophobicContact CG1-CZ 4.3Å; A683-F729 HydrophobicContact CB-CE2 4.13Å; I687-F729 HydrophobicContact CD1-CE2 3.64Å; I687-F729 HydrophobicContact CD1-CZ 4.32Å; V726-F729 PolarHBondContact O-N 3.06Å; T727-F729 VanDerWaalsContact C-N 3.26Å; T727-F729 PolarHBondContact O-N 3.5Å; F729-T733 PolarHBondContact O-N 2.97Å; F729-T733 PolarHBondContact O-OG1 3.44Å
730	I	94.1	Very high	93.4	Very high	23 Å²	23	28.8 Å²	28.8	12%	0.118	17%	0.166	C	C	.	.	H	α-helix	trans	-66.3	-42.5	175.4	-60.6	167.3	0	0	0	109.9	T727 T728 T733 L742 L743 V746	T727-I730 WeakPolarHBondContact O-CB 3.01Å; T727-I730 PolarHBondContact O-N 2.78Å; T728-I730 VanDerWaalsContact C-N 3.34Å; I730-T733 PolarHBondContact O-N 3.18Å; I730-L742 HydrophobicContact CD1-CB 4.14Å; I730-L742 HydrophobicContact CG2-CB 3.79Å; I730-L743 HydrophobicContact CG2-CB 4.28Å; I730-V746 HydrophobicContact CD1-CB 4.13Å; I730-V746 HydrophobicContact CD1-CG1 4.21Å; I730-V746 HydrophobicContact CD1-CG2 3.95Å
731	I	92.8	Very high	93.2	Very high	11 Å²	11	31.4 Å²	31.4	6%	0.056	18%	0.182	C	C	.	.	H	α-helix	trans	-66.7	-39.4	-179.8	-64.7	166.5	0	0	0	112.2	T727 T728 T733 L743 D894 M897 C898 F901	T727-I731 HydrophobicContact CG2-CD1 3.86Å; T727-I731 HydrophobicContact CG2-CG1 4.27Å; T727-I731 WeakPolarHBondContact O-CG1 3.49Å; T727-I731 PolarHBondContact O-N 3.11Å; T728-I731 PolarHBondContact O-N 2.81Å; I731-T733 VanDerWaalsContact C-N 3.28Å; I731-T733 PolarHBondContact O-N 2.82Å; I731-L743 HydrophobicContact CD1-CD1 4.05Å; I731-L743 HydrophobicContact CG1-CD1 3.44Å; I731-L743 VanDerWaalsContact CG1-CD1 3.44Å; I731-D894 HydrophobicContact CG2-CB 3.77Å; I731-M897 HydrophobicContact CD1-CB 3.93Å; I731-C898 VanDerWaalsContact CB-SG 3.55Å; I731-C898 VanDerWaalsContact CD1-SG 3.58Å; I731-C898 WeakPolarHBondContact CG2-SG 3.49Å; I731-F901 HydrophobicContact CD1-CD2 4.26Å; I731-F901 HydrophobicContact CD1-CE2 4.42Å
732	V	92.1	Very high	93	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-75.3	-18.9	-178.3	177.2	0	0	0	0	112.3	M669 W671 A676 V680 T728	M669-V732 HydrophobicContact SD-CG2 3.99Å; W671-V732 HydrophobicContact CD2-CG1 3.61Å; W671-V732 HydrophobicContact CE3-CG1 3.69Å; W671-V732 HydrophobicContact CG-CG1 4.1Å; W671-V732 HydrophobicContact CH2-CB 4.43Å; W671-V732 HydrophobicContact CH2-CG1 4.23Å; W671-V732 HydrophobicContact CZ2-CB 4.48Å; W671-V732 HydrophobicContact CZ2-CG1 4.16Å; W671-V732 HydrophobicContact CZ3-CG1 4.01Å; A676-V732 HydrophobicContact CB-CG1 4.05Å; A676-V732 HydrophobicContact CB-CG2 4.32Å; V680-V732 HydrophobicContact CG2-CG2 4.22Å; T728-V732 VanDerWaalsContact O-CG2 3.32Å; T728-V732 WeakPolarHBondContact O-CG2 3.28Å; T728-V732 PolarHBondContact O-N 3.5Å; T728-V732 VanDerWaalsContact O-N 3.17Å
733	T	90.8	Very high	92.8	Very high	44 Å²	44	32.9 Å²	32.9	27%	0.27	19%	0.19	S	C	.	.	S	Bend	trans	-71.2	139	176.6	-57.8	0	0	0	0	109.8	F729 I730 I731 T739	F729-T733 PolarHBondContact O-N 2.97Å; F729-T733 PolarHBondContact O-OG1 3.44Å; I730-T733 PolarHBondContact O-N 3.18Å; I731-T733 VanDerWaalsContact C-N 3.28Å; I731-T733 PolarHBondContact O-N 2.82Å; T733-T739 HydrophobicContact CG2-CG2 3.78Å
734	P	89.3	Confident	92.5	Very high	43 Å²	43	31 Å²	31	28%	0.279	18%	0.179	S	C	.	.			trans	-51.3	132.9	178.6	-27.7	34.7	0	0	0	112.1	Y668 C736	Y668-P734 HydrophobicContact CD2-CB 4.3Å; Y668-P734 HydrophobicContact CD2-CG 4.26Å; Y668-P734 HydrophobicContact CE2-CB 4.21Å; Y668-P734 HydrophobicContact CE2-CG 3.84Å; P734-C736 PolarHBondContact O-N 3.28Å
735	P	89.6	Confident	92.3	Very high	25 Å²	25	32.6 Å²	32.6	16%	0.162	19%	0.188	C	C	.	.			trans	-61	112.1	-179.4	-26.6	36.3	0	0	0	112.1	T739 A814 L826	P735-T739 WeakPolarHBondContact CA-OG1 3.41Å; P735-A814 HydrophobicContact CB-CB 4.32Å; P735-A814 VanDerWaalsContact O-CB 3.28Å; P735-A814 WeakPolarHBondContact O-CB 3.37Å; P735-L826 HydrophobicContact CB-CG 4.23Å; P735-L826 HydrophobicContact CG-CG 4.39Å
736	C	90.1	Very high	92.2	Very high	24 Å²	24	33.7 Å²	33.7	16%	0.162	20%	0.195	C	C	.	.			trans	-126.7	166.5	161.7	67.9	0	0	0	0	109.7	P734 V738 T739 C740 C1154	P734-C736 PolarHBondContact O-N 3.28Å; C736-V738 PolarHBondContact O-N 3.42Å; C736-T739 PolarHBondContact N-OG1 3.18Å; C736-T739 PolarHBondContact O-N 3.09Å; C736-T739 PolarHBondContact O-OG1 3.49Å; C736-C740 PolarHBondContact O-N 3.49Å; C736-C740 PolarHBondContact O-SG 2.88Å; C736-C740 VanDerWaalsContact O-SG 3.38Å; C736-C1154 HydrophobicContact CB-CB 4.3Å; C736-C1154 WeakPolarHBondContact CB-SG 3.39Å; C736-C1154 WeakPolarHBondContact SG-CB 3.29Å; C736-C1154 CovalentContact SG-SG 2.09Å; C736-C1154 PolarHBondContact SG-SG 3.38Å
737	T	89.1	Confident	92.1	Very high	85 Å²	85	31.1 Å²	31.1	52%	0.521	18%	0.179	S	C	.	.	H	α-helix	trans	-46.3	-44	-175.3	-52.3	0	0	0	0	112.9	C740 V741	T737-C740 PolarHBondContact O-N 2.94Å; T737-V741 VanDerWaalsContact O-CG2 3.31Å; T737-V741 WeakPolarHBondContact O-CG2 3.43Å; T737-V741 PolarHBondContact O-N 3.33Å; T737-V741 VanDerWaalsContact O-N 3.07Å
738	V	90.6	Very high	92	Very high	98 Å²	98	31.2 Å²	31.2	59%	0.594	18%	0.18	S	C	*	.	H	α-helix	trans	-64.5	-48	179.1	-178.9	0	0	0	0	112.1	C736 C740 V741 L742	C736-V738 PolarHBondContact O-N 3.42Å; V738-C740 VanDerWaalsContact C-N 3.27Å; V738-C740 PolarHBondContact O-N 3.24Å; V738-V741 WeakPolarHBondContact O-CB 3.3Å; V738-V741 PolarHBondContact O-N 2.94Å; V738-L742 HydrophobicContact CG1-CD1 4.26Å; V738-L742 WeakPolarHBondContact O-CG 3.38Å; V738-L742 PolarHBondContact O-N 3.48Å
739	T	91.7	Very high	92	Very high	16 Å²	16	33 Å²	33	10%	0.098	19%	0.189	C	C	.	.	H	α-helix	trans	-62.8	-35.5	178.8	61.1	0	0	0	0	111.8	T733 P735 C736 L742 L743	T733-T739 HydrophobicContact CG2-CG2 3.78Å; P735-T739 WeakPolarHBondContact CA-OG1 3.41Å; C736-T739 PolarHBondContact N-OG1 3.18Å; C736-T739 PolarHBondContact O-N 3.09Å; C736-T739 PolarHBondContact O-OG1 3.49Å; T739-L742 PolarHBondContact O-N 3.11Å; T739-L743 WeakPolarHBondContact O-CB 3.38Å; T739-L743 PolarHBondContact O-N 2.88Å
740	C	92.4	Very high	92.1	Very high	2 Å²	2	30.2 Å²	30.2	1%	0.014	18%	0.177	C	C	.	.	H	α-helix	trans	-69	-35.9	177	-60.9	0	0	0	0	112.6	C736 T737 V738 R744 P812 C828	C736-C740 PolarHBondContact O-N 3.49Å; C736-C740 PolarHBondContact O-SG 2.88Å; C736-C740 VanDerWaalsContact O-SG 3.38Å; T737-C740 PolarHBondContact O-N 2.94Å; V738-C740 VanDerWaalsContact C-N 3.27Å; V738-C740 PolarHBondContact O-N 3.24Å; C740-R744 PolarHBondContact O-N 3.38Å; C740-P812 HydrophobicContact CB-CB 3.9Å; C740-C828 WeakPolarHBondContact CA-SG 3.28Å; C740-C828 HydrophobicContact CB-CB 3.71Å; C740-C828 WeakPolarHBondContact CB-SG 3.16Å; C740-C828 WeakPolarHBondContact SG-CA 3.44Å; C740-C828 WeakPolarHBondContact SG-CB 3.34Å; C740-C828 CovalentContact SG-SG 2.04Å; C740-C828 PolarHBondContact SG-SG 2.96Å
741	V	91.9	Very high	92.1	Very high	55 Å²	55	29.1 Å²	29.1	33%	0.333	17%	0.172	S	C	.	.	H	α-helix	trans	-61.3	-50.9	169.4	175.8	0	0	0	0	109.8	T737 V738 L743 R744 V745 P812	T737-V741 VanDerWaalsContact O-CG2 3.31Å; T737-V741 WeakPolarHBondContact O-CG2 3.43Å; T737-V741 PolarHBondContact O-N 3.33Å; T737-V741 VanDerWaalsContact O-N 3.07Å; V738-V741 WeakPolarHBondContact O-CB 3.3Å; V738-V741 PolarHBondContact O-N 2.94Å; V741-L743 VanDerWaalsContact C-N 3.34Å; V741-L743 PolarHBondContact O-N 3.4Å; V741-R744 PolarHBondContact O-N 3.46Å; V741-R744 VanDerWaalsContact O-N 3.14Å; V741-V745 HydrophobicContact CG1-CG2 4.39Å; V741-V745 WeakPolarHBondContact O-CG2 3.46Å; V741-V745 PolarHBondContact O-N 2.04Å; V741-V745 VanDerWaalsContact O-N 3.11Å; V741-P812 HydrophobicContact CB-CG 4.26Å; V741-P812 HydrophobicContact CG2-CB 4.08Å; V741-P812 HydrophobicContact CG2-CG 3.29Å
742	L	93.4	Very high	92.2	Very high	73 Å²	73	28.6 Å²	28.6	38%	0.382	17%	0.169	S	C	.	.	H	α-helix	trans	-61.6	-40.8	-177.4	-69.2	176	0	0	0	112.2	I730 V738 T739 R744 V745 V746	I730-L742 HydrophobicContact CD1-CB 4.14Å; I730-L742 HydrophobicContact CG2-CB 3.79Å; V738-L742 HydrophobicContact CG1-CD1 4.26Å; V738-L742 WeakPolarHBondContact O-CG 3.38Å; V738-L742 PolarHBondContact O-N 3.48Å; T739-L742 PolarHBondContact O-N 3.11Å; L742-R744 PolarHBondContact O-N 3.27Å; L742-V745 PolarHBondContact O-N 3.32Å; L742-V746 HydrophobicContact CD2-CG2 4.37Å; L742-V746 WeakPolarHBondContact O-CB 3.44Å; L742-V746 WeakPolarHBondContact O-CG2 3.34Å; L742-V746 PolarHBondContact O-N 3.32Å
743	L	92	Very high	92.4	Very high	13 Å²	13	30.5 Å²	30.5	7%	0.068	18%	0.178	C	C	.	.	H	α-helix	trans	-64.5	-27.6	177.8	-176.8	56.6	0	0	0	112.9	T727 I730 I731 T739 V741 P747 F830	T727-L743 HydrophobicContact CG2-CD1 4.44Å; I730-L743 HydrophobicContact CG2-CB 4.28Å; I731-L743 HydrophobicContact CD1-CD1 4.05Å; I731-L743 HydrophobicContact CG1-CD1 3.44Å; I731-L743 VanDerWaalsContact CG1-CD1 3.44Å; T739-L743 WeakPolarHBondContact O-CB 3.38Å; T739-L743 PolarHBondContact O-N 2.88Å; V741-L743 VanDerWaalsContact C-N 3.34Å; V741-L743 PolarHBondContact O-N 3.4Å; L743-P747 HydrophobicContact CD1-CG 4.44Å; L743-P747 WeakPolarHBondContact O-CD 3.45Å; L743-P747 VanDerWaalsContact O-CG 3.23Å; L743-P747 WeakPolarHBondContact O-CG 3.48Å; L743-F830 HydrophobicContact CD2-CE2 3.98Å; L743-F830 HydrophobicContact CD2-CZ 3.82Å; L743-F830 HydrophobicContact CG-CZ 4.08Å
744	R	90.2	Very high	92.6	Very high	22 Å²	22	28.5 Å²	28.5	8%	0.083	17%	0.166	C	C	.	.	H	α-helix	trans	-82.1	-32.4	175.4	-81.4	-178.8	168.8	175.8	-17	113.7	C740 V741 L742 C748 L807 E810 R829 F830	C740-R744 PolarHBondContact O-N 3.38Å; V741-R744 PolarHBondContact O-N 3.46Å; V741-R744 VanDerWaalsContact O-N 3.14Å; L742-R744 PolarHBondContact O-N 3.27Å; R744-C748 PolarHBondContact O-SG 3.1Å; R744-L807 HydrophobicContact CB-CD2 4.03Å; R744-E810 PolarHBondContact NH1-O 3.43Å; R744-E810 IonicContact NH2-OE2 3.27Å; R744-E810 PolarHBondContact NH2-OE2 3.05Å; R744-R829 VanDerWaalsContact CZ-O 3.25Å; R744-R829 PolarHBondContact NH2-O 3.05Å; R744-F830 HydrophobicContact CG-CD1 4.46Å; R744-F830 HydrophobicContact CG-CE1 3.51Å; R744-F830 HydrophobicContact CG-CZ 4.18Å; R744-F830 VanDerWaalsContact NE-CE1 3.3Å
745	V	92.3	Very high	92.9	Very high	33 Å²	33	26.7 Å²	26.7	20%	0.2	15%	0.154	C	C	.	.	H	α-helix	trans	-91.6	-51.5	-172.8	176.4	0	0	0	0	112.4	V741 L742 L749 T803 L807	V741-V745 HydrophobicContact CG1-CG2 4.39Å; V741-V745 WeakPolarHBondContact O-CG2 3.46Å; V741-V745 PolarHBondContact O-N 2.04Å; V741-V745 VanDerWaalsContact O-N 3.11Å; L742-V745 PolarHBondContact O-N 3.32Å; V745-L749 HydrophobicContact CG1-CD1 3.58Å; V745-L749 HydrophobicContact CG1-CG 4.25Å; V745-L749 WeakPolarHBondContact O-CG 3.22Å; V745-L749 PolarHBondContact O-N 2.95Å; V745-T803 HydrophobicContact CB-CG2 4.48Å; V745-T803 HydrophobicContact CG2-CG2 4.01Å; V745-L807 HydrophobicContact CG2-CD1 3.6Å
746	V	94.6	Very high	93.1	Very high	26 Å²	26	25.5 Å²	25.5	16%	0.158	15%	0.146	C	C	.	.	H	α-helix	trans	-62.4	-46	-168.8	176.6	0	0	0	0	112.5	L723 I730 L742 A750	L723-V746 HydrophobicContact CB-CG1 4.42Å; I730-V746 HydrophobicContact CD1-CB 4.13Å; I730-V746 HydrophobicContact CD1-CG1 4.21Å; I730-V746 HydrophobicContact CD1-CG2 3.95Å; L742-V746 HydrophobicContact CD2-CG2 4.37Å; L742-V746 WeakPolarHBondContact O-CB 3.44Å; L742-V746 WeakPolarHBondContact O-CG2 3.34Å; L742-V746 PolarHBondContact O-N 3.32Å; V746-A750 VanDerWaalsContact O-CB 3.27Å; V746-A750 WeakPolarHBondContact O-CB 3.36Å; V746-A750 PolarHBondContact O-N 2.9Å
747	P	93.3	Very high	93.3	Very high	1 Å²	1	24.3 Å²	24.3	1%	0.006	14%	0.138	C	C	.	.	H	α-helix	trans	-65.2	-44.7	-177.5	-22.2	35.8	0	0	0	112.6	T727 L743 A750 F751 F839 F901	T727-P747 HydrophobicContact CG2-CB 4.43Å; T727-P747 HydrophobicContact CG2-CG 3.61Å; L743-P747 HydrophobicContact CD1-CG 4.44Å; L743-P747 WeakPolarHBondContact O-CD 3.45Å; L743-P747 VanDerWaalsContact O-CG 3.23Å; L743-P747 WeakPolarHBondContact O-CG 3.48Å; P747-A750 WeakPolarHBondContact O-CB 3.08Å; P747-A750 PolarHBondContact O-N 3.18Å; P747-F751 WeakPolarHBondContact O-CD2 3.35Å; P747-F751 PolarHBondContact O-N 3.17Å; P747-F839 HydrophobicContact CB-CE1 4.21Å; P747-F839 HydrophobicContact CB-CZ 3.95Å; P747-F901 HydrophobicContact CB-CD2 4.48Å; P747-F901 HydrophobicContact CB-CE2 4.03Å; P747-F901 HydrophobicContact CB-CZ 4.31Å; P747-F901 HydrophobicContact CG-CE2 4.16Å
748	C	93.1	Very high	93.5	Very high	3 Å²	3	20.3 Å²	20.3	2%	0.02	11%	0.114	C	C	.	.	H	α-helix	trans	-60.7	-47.9	-179.3	-54.2	0	0	0	0	110.8	R744 A750 F751 A752 E799	R744-C748 PolarHBondContact O-SG 3.1Å; C748-A750 PolarHBondContact O-N 3.38Å; C748-F751 PolarHBondContact O-N 2.99Å; C748-A752 WeakPolarHBondContact O-CB 3.39Å; C748-A752 PolarHBondContact O-N 3.36Å; C748-E799 HydrophobicContact CB-CG 4.3Å
749	L	94.3	Very high	93.6	Very high	38 Å²	38	17.1 Å²	17.1	20%	0.199	9%	0.092	C	C	.	.	H	α-helix	trans	-64.7	-38.9	176.8	-65.9	-179.1	0	0	0	112.4	V745 A752 M753 L800	V745-L749 HydrophobicContact CG1-CD1 3.58Å; V745-L749 HydrophobicContact CG1-CG 4.25Å; V745-L749 WeakPolarHBondContact O-CG 3.22Å; V745-L749 PolarHBondContact O-N 2.95Å; L749-A752 PolarHBondContact O-N 2.98Å; L749-M753 WeakPolarHBondContact O-CB 3.47Å; L749-M753 VanDerWaalsContact O-CG 3.24Å; L749-M753 WeakPolarHBondContact O-CG 3.37Å; L749-M753 PolarHBondContact O-N 3.32Å; L749-L800 HydrophobicContact CD1-CD1 4.15Å; L749-L800 HydrophobicContact CD2-CB 4.02Å; L749-L800 HydrophobicContact CD2-CD1 3.97Å
750	A	96	Very high	93.6	Very high	0 Å²	0	16.4 Å²	16.4	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-61.6	-45.8	178.3	0	0	0	0	0	112	L723 V746 P747 C748 M753 I754	L723-A750 HydrophobicContact CB-CB 3.62Å; V746-A750 VanDerWaalsContact O-CB 3.27Å; V746-A750 WeakPolarHBondContact O-CB 3.36Å; V746-A750 PolarHBondContact O-N 2.9Å; P747-A750 WeakPolarHBondContact O-CB 3.08Å; P747-A750 PolarHBondContact O-N 3.18Å; C748-A750 PolarHBondContact O-N 3.38Å; A750-M753 WeakPolarHBondContact O-CB 3.19Å; A750-M753 PolarHBondContact O-N 3.18Å; A750-I754 WeakPolarHBondContact O-CG1 3.34Å; A750-I754 PolarHBondContact O-N 3.42Å
751	F	94.8	Very high	93.4	Very high	0 Å²	0	16.8 Å²	16.8	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-69.9	-39.9	178	-75.4	-61.2	0	0	0	112.8	P747 C748 M753 I754 Y755 F839 D842 W880 F901	P747-F751 WeakPolarHBondContact O-CD2 3.35Å; P747-F751 PolarHBondContact O-N 3.17Å; C748-F751 PolarHBondContact O-N 2.99Å; F751-M753 VanDerWaalsContact C-N 3.27Å; F751-M753 PolarHBondContact O-N 3.25Å; F751-I754 HydrophobicContact CD1-CD1 4.43Å; F751-I754 PolarHBondContact O-N 3.19Å; F751-I754 VanDerWaalsContact O-N 3.11Å; F751-Y755 HydrophobicContact CB-CD2 4.02Å; F751-Y755 HydrophobicContact CB-CE2 3.85Å; F751-Y755 HydrophobicContact CD1-CD2 4.42Å; F751-Y755 AromaticContact CD1-CE2 3.51Å; F751-Y755 HydrophobicContact CD1-CE2 3.51Å; F751-Y755 AromaticContact CD1-CZ 3.9Å; F751-Y755 HydrophobicContact CE1-CE2 4.44Å; F751-Y755 HydrophobicContact CG-CE2 4.01Å; F751-Y755 VanDerWaalsContact O-CD2 3.28Å; F751-Y755 WeakPolarHBondContact O-CD2 3.46Å; F751-Y755 PolarHBondContact O-N 3.27Å; F751-F839 HydrophobicContact CD2-CD1 4.37Å; F751-F839 AromaticContact CD2-CE1 3.83Å; F751-F839 HydrophobicContact CD2-CE1 3.83Å; F751-F839 HydrophobicContact CE2-CE1 4.16Å; F751-D842 HydrophobicContact CB-CB 4.45Å; F751-D842 WeakPolarHBondContact CB-OD2 3.37Å; F751-W880 AromaticContact CD1-CZ2 3.97Å; F751-W880 HydrophobicContact CD1-CZ2 3.97Å; F751-W880 HydrophobicContact CD2-CH2 4.1Å; F751-W880 AromaticContact CD2-CZ2 3.91Å; F751-W880 HydrophobicContact CD2-CZ2 3.91Å; F751-W880 AromaticContact CE1-CZ2 3.8Å; F751-W880 HydrophobicContact CE1-CZ2 3.8Å; F751-W880 AromaticContact CE2-CH2 3.89Å; F751-W880 HydrophobicContact CE2-CH2 3.89Å; F751-W880 AromaticContact CE2-CZ2 3.73Å; F751-W880 HydrophobicContact CE2-CZ2 3.73Å; F751-W880 HydrophobicContact CG-CZ2 4.02Å; F751-W880 HydrophobicContact CZ-CH2 4.23Å; F751-W880 AromaticContact CZ-CZ2 3.67Å; F751-W880 HydrophobicContact CZ-CZ2 3.67Å; F751-F901 AromaticContact CE2-CD1 3.6Å; F751-F901 HydrophobicContact CE2-CD1 3.6Å; F751-F901 AromaticContact CE2-CE1 3.93Å; F751-F901 HydrophobicContact CE2-CE1 3.93Å; F751-F901 HydrophobicContact CE2-CG 4.17Å; F751-F901 HydrophobicContact CZ-CB 4.33Å; F751-F901 AromaticContact CZ-CD1 3.75Å; F751-F901 HydrophobicContact CZ-CD1 3.75Å; F751-F901 HydrophobicContact CZ-CE1 4.46Å; F751-F901 HydrophobicContact CZ-CG 4.29Å
752	A	95.2	Very high	93.2	Very high	0 Å²	0	14.3 Å²	14.3	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-62.2	-35.9	175.2	0	0	0	0	0	112.2	C748 L749 G756 E799 D842	C748-A752 WeakPolarHBondContact O-CB 3.39Å; C748-A752 PolarHBondContact O-N 3.36Å; L749-A752 PolarHBondContact O-N 2.98Å; A752-G756 VanDerWaalsContact O-CA 3.3Å; A752-G756 WeakPolarHBondContact O-CA 3.49Å; A752-G756 PolarHBondContact O-N 2.98Å; A752-E799 HydrophobicContact CB-CB 3.65Å; A752-E799 HydrophobicContact CB-CG 3.69Å; A752-D842 VanDerWaalsContact CA-OD1 3.28Å; A752-D842 WeakPolarHBondContact CA-OD1 3.29Å; A752-D842 PolarHBondContact N-OD1 3Å
753	M	95.4	Very high	92.9	Very high	39 Å²	39	11.9 Å²	11.9	19%	0.192	6%	0.061	C	C	.	.	H	α-helix	trans	-61.4	-46	172.1	-75.8	174.1	61.9	0	0	112.2	M716 L723 L749 A750 F751 A757 I796	M716-M753 WeakPolarHBondContact O-CE 3.41Å; L723-M753 HydrophobicContact CD1-CE 4.45Å; L723-M753 HydrophobicContact CD1-SD 3.81Å; L749-M753 WeakPolarHBondContact O-CB 3.47Å; L749-M753 VanDerWaalsContact O-CG 3.24Å; L749-M753 WeakPolarHBondContact O-CG 3.37Å; L749-M753 PolarHBondContact O-N 3.32Å; A750-M753 WeakPolarHBondContact O-CB 3.19Å; A750-M753 PolarHBondContact O-N 3.18Å; F751-M753 VanDerWaalsContact C-N 3.27Å; F751-M753 PolarHBondContact O-N 3.25Å; M753-A757 VanDerWaalsContact O-CB 3.27Å; M753-A757 WeakPolarHBondContact O-CB 3.31Å; M753-A757 PolarHBondContact O-N 2.9Å; M753-I796 HydrophobicContact CB-CD1 4.4Å; M753-I796 HydrophobicContact CG-CD1 3.75Å; M753-I796 HydrophobicContact CG-CG1 4.18Å
754	I	95.6	Very high	92.6	Very high	3 Å²	3	14.7 Å²	14.7	2%	0.015	7%	0.071	C	C	.	.	H	α-helix	trans	-67	-56.7	-179.6	-64.5	162.6	0	0	0	110.6	I717 L721 A750 F751 A757 L758	I717-I754 HydrophobicContact CG2-CG2 4.48Å; L721-I754 HydrophobicContact CD2-CD1 3.76Å; L721-I754 HydrophobicContact CD2-CG1 4.29Å; L721-I754 HydrophobicContact CG-CD1 4.38Å; A750-I754 WeakPolarHBondContact O-CG1 3.34Å; A750-I754 PolarHBondContact O-N 3.42Å; F751-I754 HydrophobicContact CD1-CD1 4.43Å; F751-I754 PolarHBondContact O-N 3.19Å; F751-I754 VanDerWaalsContact O-N 3.11Å; I754-A757 PolarHBondContact O-N 3.43Å; I754-L758 HydrophobicContact CG2-CD1 3.95Å; I754-L758 WeakPolarHBondContact O-CB 3.39Å; I754-L758 WeakPolarHBondContact O-CG 3.35Å; I754-L758 PolarHBondContact O-N 3.44Å
755	Y	94.7	Very high	92.2	Very high	4 Å²	4	15 Å²	15	2%	0.016	7%	0.074	C	C	.	.	H	α-helix	trans	-75.6	-32	-172.9	-58.8	-49.1	0	0	0	112.6	F751 L758 F759 D842 V846 M873 T876 W880 S904	F751-Y755 HydrophobicContact CB-CD2 4.02Å; F751-Y755 HydrophobicContact CB-CE2 3.85Å; F751-Y755 HydrophobicContact CD1-CD2 4.42Å; F751-Y755 AromaticContact CD1-CE2 3.51Å; F751-Y755 HydrophobicContact CD1-CE2 3.51Å; F751-Y755 AromaticContact CD1-CZ 3.9Å; F751-Y755 HydrophobicContact CE1-CE2 4.44Å; F751-Y755 HydrophobicContact CG-CE2 4.01Å; F751-Y755 VanDerWaalsContact O-CD2 3.28Å; F751-Y755 WeakPolarHBondContact O-CD2 3.46Å; F751-Y755 PolarHBondContact O-N 3.27Å; Y755-L758 HydrophobicContact CD1-CD1 4.26Å; Y755-L758 PolarHBondContact O-N 3Å; Y755-F759 WeakPolarHBondContact O-CB 3.24Å; Y755-F759 PolarHBondContact O-N 3.48Å; Y755-D842 HydrophobicContact CD2-CB 4.33Å; Y755-V846 HydrophobicContact CD1-CG2 3.69Å; Y755-V846 HydrophobicContact CD2-CG2 3.59Å; Y755-V846 HydrophobicContact CE1-CG2 3.69Å; Y755-V846 HydrophobicContact CE2-CG2 3.57Å; Y755-V846 HydrophobicContact CG-CG2 3.66Å; Y755-M873 HydrophobicContact CD1-CE 4.46Å; Y755-T876 HydrophobicContact CE1-CG2 3.79Å; Y755-T876 WeakPolarHBondContact OH-CG2 3.45Å; Y755-W880 AromaticContact CZ-NE1 4Å; Y755-W880 PolarHBondContact OH-NE1 3.14Å; Y755-W880 VanDerWaalsContact OH-NE1 3.14Å; Y755-S904 PolarHBondContact OH-OG 2.83Å
756	G	94.8	Very high	91.6	Very high	0 Å²	0	14.1 Å²	14.1	0%	0	7%	0.07	C	C	.	.	H	α-helix	trans	-61.6	-44.4	171.7	0	0	0	0	0	111.8	A752 F759 T760	A752-G756 VanDerWaalsContact O-CA 3.3Å; A752-G756 WeakPolarHBondContact O-CA 3.49Å; A752-G756 PolarHBondContact O-N 2.98Å; G756-F759 PolarHBondContact O-N 2.58Å; G756-T760 PolarHBondContact O-N 2.97Å; G756-T760 PolarHBondContact O-OG1 2.94Å; G756-T760 VanDerWaalsContact O-OG1 3.08Å
757	A	94.4	Very high	90.9	Very high	0 Å²	0	15.8 Å²	15.8	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-68.2	-41.3	176.9	0	0	0	0	0	112.5	L713 M716 I717 M753 I754 T760 K761 T792	L713-A757 HydrophobicContact CB-CB 4.43Å; L713-A757 HydrophobicContact CD2-CB 4.39Å; M716-A757 HydrophobicContact CB-CB 4.43Å; I717-A757 HydrophobicContact CD1-CB 4.1Å; I717-A757 HydrophobicContact CG1-CB 3.57Å; M753-A757 VanDerWaalsContact O-CB 3.27Å; M753-A757 WeakPolarHBondContact O-CB 3.31Å; M753-A757 PolarHBondContact O-N 2.9Å; I754-A757 PolarHBondContact O-N 3.43Å; A757-T760 PolarHBondContact O-N 3.28Å; A757-K761 WeakPolarHBondContact O-CB 3.28Å; A757-K761 PolarHBondContact O-N 3.36Å; A757-T792 HydrophobicContact CB-CG2 4.09Å
758	L	92.9	Very high	90.2	Very high	1 Å²	1	19 Å²	19	1%	0.005	9%	0.09	C	C	.	.	H	α-helix	trans	-63.7	-40.2	174.7	-77.2	172.8	0	0	0	112.5	I717 I754 Y755 K761 T762 M873 L912	I717-L758 HydrophobicContact CD1-CD2 3.99Å; I717-L758 HydrophobicContact CD1-CG 4.07Å; I754-L758 HydrophobicContact CG2-CD1 3.95Å; I754-L758 WeakPolarHBondContact O-CB 3.39Å; I754-L758 WeakPolarHBondContact O-CG 3.35Å; I754-L758 PolarHBondContact O-N 3.44Å; Y755-L758 HydrophobicContact CD1-CD1 4.26Å; Y755-L758 PolarHBondContact O-N 3Å; L758-K761 WeakPolarHBondContact O-CB 3.42Å; L758-K761 PolarHBondContact O-N 3.24Å; L758-T762 WeakPolarHBondContact O-CG2 3.15Å; L758-T762 PolarHBondContact O-N 2.89Å; L758-T762 PolarHBondContact O-OG1 3.38Å; L758-M873 HydrophobicContact CD1-SD 4.12Å; L758-L912 HydrophobicContact CD1-CD1 4.24Å; L758-L912 HydrophobicContact CD2-CD1 3.79Å; L758-L912 HydrophobicContact CD2-CD2 4.28Å; L758-L912 HydrophobicContact CG-CD1 4.5Å
759	F	92.9	Very high	89.2	Confident	31 Å²	31	21.2 Å²	21.2	14%	0.136	10%	0.101	C	C	.	.	H	α-helix	trans	-61.9	-50.6	175.5	177.2	-107.7	0	0	0	111	Y755 G756 K761 T762 N763 L795 M848 C849 Y852	Y755-F759 WeakPolarHBondContact O-CB 3.24Å; Y755-F759 PolarHBondContact O-N 3.48Å; G756-F759 PolarHBondContact O-N 2.58Å; F759-K761 PolarHBondContact O-N 3.27Å; F759-T762 WeakPolarHBondContact CA-OG1 3.23Å; F759-T762 PolarHBondContact O-N 3.38Å; F759-T762 PolarHBondContact O-OG1 2.83Å; F759-N763 WeakPolarHBondContact O-CB 3.35Å; F759-N763 PolarHBondContact O-N 3.38Å; F759-L795 HydrophobicContact CD1-CD1 3.71Å; F759-L795 HydrophobicContact CE1-CD1 4.38Å; F759-M848 HydrophobicContact CD2-CB 3.98Å; F759-M848 HydrophobicContact CE2-CB 3.78Å; F759-C849 WeakPolarHBondContact CA-SG 3.4Å; F759-C849 WeakPolarHBondContact CB-SG 3.46Å; F759-C849 PolarHBondContact N-SG 3.38Å; F759-Y852 HydrophobicContact CD2-CD2 4.28Å; F759-Y852 AromaticContact CE2-CD2 3.67Å; F759-Y852 HydrophobicContact CE2-CD2 3.67Å; F759-Y852 AromaticContact CE2-CE2 3.57Å; F759-Y852 HydrophobicContact CE2-CE2 3.57Å; F759-Y852 HydrophobicContact CZ-CE2 4.13Å
760	T	91.5	Very high	88.1	Confident	1 Å²	1	22.1 Å²	22.1	1%	0.006	11%	0.114	C	C	.	.	H	α-helix	trans	-57.3	-38.3	177.5	-64	0	0	0	0	111.3	L713 G756 A757 R764 Q788 T792	L713-T760 HydrophobicContact CD1-CG2 4.04Å; L713-T760 HydrophobicContact CD2-CG2 4.26Å; G756-T760 PolarHBondContact O-N 2.97Å; G756-T760 PolarHBondContact O-OG1 2.94Å; G756-T760 VanDerWaalsContact O-OG1 3.08Å; A757-T760 PolarHBondContact O-N 3.28Å; T760-R764 WeakPolarHBondContact O-CB 3.44Å; T760-R764 PolarHBondContact O-N 3.14Å; T760-Q788 HydrophobicContact CG2-CB 3.64Å; T760-Q788 HydrophobicContact CG2-CG 3.95Å; T760-Q788 WeakPolarHBondContact CG2-O 3.38Å; T760-T792 WeakPolarHBondContact CB-OG1 3.05Å; T760-T792 PolarHBondContact OG1-OG1 2.75Å
761	K	88.7	Confident	86.7	Confident	10 Å²	10	25.4 Å²	25.4	4%	0.043	14%	0.141	C	C	.	.	H	α-helix	trans	-69.7	-46.5	178.9	-167.9	173.4	-177.8	176.3	0	113.1	L713 A757 L758 F759 R764 I765 E865 I869	L713-K761 HydrophobicContact CD1-CB 4.15Å; A757-K761 WeakPolarHBondContact O-CB 3.28Å; A757-K761 PolarHBondContact O-N 3.36Å; L758-K761 WeakPolarHBondContact O-CB 3.42Å; L758-K761 PolarHBondContact O-N 3.24Å; F759-K761 PolarHBondContact O-N 3.27Å; K761-R764 WeakPolarHBondContact O-CB 3.49Å; K761-R764 PolarHBondContact O-N 3.11Å; K761-I765 WeakPolarHBondContact O-CG1 3.38Å; K761-I765 PolarHBondContact O-N 3.16Å; K761-I765 VanDerWaalsContact O-N 3.14Å; K761-E865 WeakPolarHBondContact CE-OE1 3.28Å; K761-E865 IonicContact NZ-OE1 2.64Å; K761-E865 PolarHBondContact NZ-OE1 3.15Å; K761-I869 HydrophobicContact CD-CD1 4.18Å; K761-I869 HydrophobicContact CG-CD1 4.41Å
762	T	87.9	Confident	85.3	Confident	2 Å²	2	29.4 Å²	29.4	1%	0.012	17%	0.169	C	C	.	.	H	α-helix	trans	-66.5	-40.2	176.5	50	0	0	0	0	111.7	L758 F759 R764 I765 A766 I869	L758-T762 WeakPolarHBondContact O-CG2 3.15Å; L758-T762 PolarHBondContact O-N 2.89Å; L758-T762 PolarHBondContact O-OG1 3.38Å; F759-T762 WeakPolarHBondContact CA-OG1 3.23Å; F759-T762 PolarHBondContact O-N 3.38Å; F759-T762 PolarHBondContact O-OG1 2.83Å; T762-R764 VanDerWaalsContact C-N 3.35Å; T762-R764 PolarHBondContact O-N 3.17Å; T762-I765 PolarHBondContact O-N 3.45Å; T762-A766 WeakPolarHBondContact O-CB 3.39Å; T762-A766 PolarHBondContact O-N 3.5Å; T762-I869 HydrophobicContact CG2-CG2 3.49Å; T762-I869 VanDerWaalsContact CG2-CG2 3.49Å
763	N	87.1	Confident	83.6	Confident	23 Å²	23	38.3 Å²	38.3	12%	0.123	21%	0.208	C	C	.	.	H	α-helix	trans	-61.9	-41.2	174.4	-172.7	2.3	0	0	0	111.3	F759 I765 A766 R767	F759-N763 WeakPolarHBondContact O-CB 3.35Å; F759-N763 PolarHBondContact O-N 3.38Å; N763-I765 PolarHBondContact O-N 2.9Å; N763-A766 PolarHBondContact O-N 2.83Å; N763-R767 PolarHBondContact ND2-NH1 2.88Å; N763-R767 WeakPolarHBondContact O-CB 3.49Å; N763-R767 WeakPolarHBondContact O-CG 3.42Å; N763-R767 PolarHBondContact O-N 2.91Å; N763-R767 PolarHBondContact OD1-NH1 3.31Å
764	R	85	Confident	81.5	Confident	72 Å²	72	43.8 Å²	43.8	27%	0.272	23%	0.231	S	C	.	.	H	α-helix	trans	-57.1	-48.7	172	-179.7	-164.6	173.3	-156.2	-12.6	111.2	T710 T760 K761 T762 R767 I768 L783	T710-R764 PolarHBondContact OG1-NH1 3.3Å; T760-R764 WeakPolarHBondContact O-CB 3.44Å; T760-R764 PolarHBondContact O-N 3.14Å; K761-R764 WeakPolarHBondContact O-CB 3.49Å; K761-R764 PolarHBondContact O-N 3.11Å; T762-R764 VanDerWaalsContact C-N 3.35Å; T762-R764 PolarHBondContact O-N 3.17Å; R764-R767 PolarHBondContact O-N 3.03Å; R764-I768 HydrophobicContact CG-CD1 3.92Å; R764-I768 VanDerWaalsContact O-CG1 3.28Å; R764-I768 WeakPolarHBondContact O-CG1 3.41Å; R764-I768 PolarHBondContact O-N 3.1Å; R764-L783 HydrophobicContact CG-CD1 4.34Å
765	I	81.7	Confident	79.4	Confident	29 Å²	29	51.7 Å²	51.7	15%	0.149	27%	0.271	C	S	.	.	H	α-helix	trans	-60.9	-46.5	179.1	-64.7	166.9	0	0	0	110.5	K761 T762 N763 R767 I768 L769 T856 L859 I869	K761-I765 WeakPolarHBondContact O-CG1 3.38Å; K761-I765 PolarHBondContact O-N 3.16Å; K761-I765 VanDerWaalsContact O-N 3.14Å; T762-I765 PolarHBondContact O-N 3.45Å; N763-I765 PolarHBondContact O-N 2.9Å; I765-R767 VanDerWaalsContact C-N 3.34Å; I765-R767 PolarHBondContact O-N 2.87Å; I765-I768 PolarHBondContact O-N 3.11Å; I765-L769 HydrophobicContact CG2-CD1 4.12Å; I765-L769 WeakPolarHBondContact O-CG 3.31Å; I765-L769 PolarHBondContact O-N 3Å; I765-T856 HydrophobicContact CB-CG2 4.44Å; I765-T856 HydrophobicContact CG2-CG2 3.79Å; I765-L859 HydrophobicContact CG2-CD1 3.97Å; I765-L859 HydrophobicContact CG2-CD2 4.4Å; I765-I869 HydrophobicContact CD1-CD1 4.17Å
766	A	79.9	Confident	77.3	Confident	14 Å²	14	58.7 Å²	58.7	12%	0.116	31%	0.307	C	S	.	.	H	α-helix	trans	-61.9	-39.1	178.2	0	0	0	0	0	112.6	T762 N763 L769 A770 Y852 T856	T762-A766 WeakPolarHBondContact O-CB 3.39Å; T762-A766 PolarHBondContact O-N 3.5Å; N763-A766 PolarHBondContact O-N 2.83Å; A766-L769 PolarHBondContact O-N 3.13Å; A766-A770 WeakPolarHBondContact O-CB 3.45Å; A766-A770 PolarHBondContact O-N 2.87Å; A766-Y852 HydrophobicContact CB-CD1 3.62Å; A766-Y852 HydrophobicContact CB-CE1 3.97Å; A766-T856 HydrophobicContact CB-CG2 4.34Å
767	R	80.6	Confident	74.8	Confident	60 Å²	60	65.4 Å²	65.4	23%	0.226	35%	0.348	C	S	.	.	H	α-helix	trans	-66.1	-38.2	175	-73.7	-162.2	-63.8	-104.7	12.9	112.4	N763 R764 I765 A770 A771 F782 L783	N763-R767 PolarHBondContact ND2-NH1 2.88Å; N763-R767 WeakPolarHBondContact O-CB 3.49Å; N763-R767 WeakPolarHBondContact O-CG 3.42Å; N763-R767 PolarHBondContact O-N 2.91Å; N763-R767 PolarHBondContact OD1-NH1 3.31Å; R764-R767 PolarHBondContact O-N 3.03Å; I765-R767 VanDerWaalsContact C-N 3.34Å; I765-R767 PolarHBondContact O-N 2.87Å; R767-A770 PolarHBondContact O-N 3.43Å; R767-A771 PolarHBondContact O-N 3.16Å; R767-A771 VanDerWaalsContact O-N 3.09Å; R767-F782 PolarHBondContact NH2-O 3.33Å; R767-L783 HydrophobicContact CB-CD1 4.48Å
768	I	77.1	Confident	72.3	Confident	70 Å²	70	74.2 Å²	74.2	36%	0.359	39%	0.387	S	S	.	.	H	α-helix	trans	-65.6	-42.5	176.5	-67.6	165.8	0	0	0	110.5	R764 I765 A771 S772 L783	R764-I768 HydrophobicContact CG-CD1 3.92Å; R764-I768 VanDerWaalsContact O-CG1 3.28Å; R764-I768 WeakPolarHBondContact O-CG1 3.41Å; R764-I768 PolarHBondContact O-N 3.1Å; I765-I768 PolarHBondContact O-N 3.11Å; I768-A771 WeakPolarHBondContact O-CB 3.45Å; I768-A771 PolarHBondContact O-N 3.06Å; I768-S772 PolarHBondContact O-N 3.47Å; I768-S772 VanDerWaalsContact O-N 3.15Å; I768-L783 HydrophobicContact CG1-CD1 4.21Å; I768-L783 HydrophobicContact CG1-CD2 4.34Å
769	L	73.5	Confident	70.2	Confident	49 Å²	49	86 Å²	86	26%	0.257	43%	0.431	S	S	.	.	H	α-helix	trans	-69.6	-35.7	176.6	-68.8	168.3	0	0	0	113.6	I765 A766 A771 S772 K773 T856 L859	I765-L769 HydrophobicContact CG2-CD1 4.12Å; I765-L769 WeakPolarHBondContact O-CG 3.31Å; I765-L769 PolarHBondContact O-N 3Å; A766-L769 PolarHBondContact O-N 3.13Å; L769-A771 PolarHBondContact O-N 3.42Å; L769-S772 PolarHBondContact O-N 3.5Å; L769-S772 PolarHBondContact O-OG 2.97Å; L769-K773 PolarHBondContact O-N 3.19Å; L769-T856 HydrophobicContact CD1-CG2 3.95Å; L769-L859 HydrophobicContact CD1-CD1 3.46Å; L769-L859 VanDerWaalsContact CD1-CD1 3.46Å; L769-L859 HydrophobicContact CD1-CD2 4.03Å; L769-L859 HydrophobicContact CD1-CG 3.71Å; L769-L859 HydrophobicContact CD2-CD2 3.82Å; L769-L859 HydrophobicContact CD2-CG 3.97Å; L769-L859 HydrophobicContact CG-CD2 4.27Å; L769-L859 HydrophobicContact CG-CG 4.38Å
770	A	71.4	Confident	68.3	Low	56 Å²	56	94 Å²	94	46%	0.463	46%	0.46	S	S	.	.	H	α-helix	trans	-65.1	-30.5	173.3	0	0	0	0	0	111.5	A766 R767	A766-A770 WeakPolarHBondContact O-CB 3.45Å; A766-A770 PolarHBondContact O-N 2.87Å; R767-A770 PolarHBondContact O-N 3.43Å
771	A	66	Low	66.4	Low	69 Å²	69	104.1 Å²	104.1	57%	0.57	50%	0.498	S	S	*	.	H	α-helix	trans	-72.7	-31.2	174.4	0	0	0	0	0	112.6	R767 I768 L769	R767-A771 PolarHBondContact O-N 3.16Å; R767-A771 VanDerWaalsContact O-N 3.09Å; I768-A771 WeakPolarHBondContact O-CB 3.45Å; I768-A771 PolarHBondContact O-N 3.06Å; L769-A771 PolarHBondContact O-N 3.42Å
772	S	64.2	Low	65.1	Low	85 Å²	85	109.8 Å²	109.8	59%	0.594	52%	0.524	S	S	*	.	H	α-helix	trans	-75.3	-23.8	177.6	68.6	0	0	0	0	113.9	I768 L769	I768-S772 PolarHBondContact O-N 3.47Å; I768-S772 VanDerWaalsContact O-N 3.15Å; L769-S772 PolarHBondContact O-N 3.5Å; L769-S772 PolarHBondContact O-OG 2.97Å
773	K	61.4	Low	64.2	Low	186 Å²	186	113.9 Å²	113.9	81%	0.809	55%	0.545	S	S	*	.	H	α-helix	trans	-87.3	-13.9	-179.8	-73.7	-170	176.9	-172.5	0	115.6	L769	L769-K773 PolarHBondContact O-N 3.19Å
774	K	51.2	Low	63.9	Low	154 Å²	154	116.7 Å²	116.7	67%	0.67	57%	0.566	S	S	*	*			trans	-119.6	104.2	176.6	-79.3	-172.8	174.8	-172.5	0	109.3	I776	K774-I776 PolarHBondContact O-N 3.23Å
775	I	50.9	Low	63.7	Low	170 Å²	170	116.8 Å²	116.8	87%	0.872	58%	0.575	S	S	*	*			trans	-62.7	-2.2	177.1	-67.5	168.8	0	0	0	112.7	T777	I775-T777 PolarHBondContact O-N 3.47Å
776	I	49.6	Very low	63.9	Low	150 Å²	150	117.4 Å²	117.4	77%	0.769	59%	0.589	S	S	*	*	S	Bend	trans	-89.1	115.5	-178	-59.6	173.4	0	0	0	111	K774 K778	K774-I776 PolarHBondContact O-N 3.23Å; I776-K778 PolarHBondContact O-N 3.29Å
777	T	42.8	Very low	64.3	Low	141 Å²	141	117.8 Å²	117.8	87%	0.865	59%	0.592	S	S	*	*			trans	-56.3	98.8	-179.7	41.7	0	0	0	0	114	I775	I775-T777 PolarHBondContact O-N 3.47Å
778	K	42.9	Very low	64.7	Low	185 Å²	185	115 Å²	115	80%	0.804	58%	0.581	S	S	*	*			trans	-144.1	112.5	151.9	-162.1	170.7	-174.1	173.1	0	110.1	I776 R780	I776-K778 PolarHBondContact O-N 3.29Å; K778-R780 PolarHBondContact O-N 2.98Å
779	R	46.9	Very low	65.5	Low	249 Å²	249	113.6 Å²	113.6	94%	0.94	58%	0.576	S	S	*	*			trans	-59.2	103.3	175.8	-169.9	179.8	-172.3	-174.7	2.8	109
780	R	53.3	Low	66.4	Low	199 Å²	199	115.3 Å²	115.3	75%	0.751	59%	0.588	S	S	*	*			trans	-77.8	132.6	-178.7	-66.4	-168.4	178.9	-156.3	-1.5	110.6	K778	K778-R780 PolarHBondContact O-N 2.98Å
781	R	52	Low	67.4	Low	213 Å²	213	114.6 Å²	114.6	80%	0.804	58%	0.576	S	S	*	*	S	Bend	trans	-64.5	159.9	175	-68.7	-175.4	-84.4	173.8	-3.1	111
782	F	62.1	Low	68.7	Low	130 Å²	130	111.3 Å²	111.3	57%	0.57	55%	0.549	S	S	*	.			trans	76.6	30.8	178.9	-49.9	-77.7	0	0	0	118.5	R767 A787	R767-F782 PolarHBondContact NH2-O 3.33Å; F782-A787 HydrophobicContact CB-CB 4.45Å; F782-A787 HydrophobicContact CD1-CB 4.15Å
783	L	68.5	Low	70.2	Confident	88 Å²	88	110.4 Å²	110.4	46%	0.461	54%	0.542	S	S	.	.			trans	-99.3	-9.7	171	-142.4	71.1	0	0	0	114.1	R764 R767 I768 Q788	R764-L783 HydrophobicContact CG-CD1 4.34Å; R767-L783 HydrophobicContact CB-CD1 4.48Å; I768-L783 HydrophobicContact CG1-CD1 4.21Å; I768-L783 HydrophobicContact CG1-CD2 4.34Å; L783-Q788 PolarHBondContact O-NE2 3.48Å
784	S	80.9	Confident	71.8	Confident	82 Å²	82	106.6 Å²	106.6	57%	0.573	53%	0.529	S	S	*	.	S	Bend	trans	-65.3	147.5	177.6	-179.2	0	0	0	0	111.9	G786 A787 Q788	S784-G786 VanDerWaalsContact C-N 3.31Å; S784-G786 PolarHBondContact O-N 3.03Å; S784-A787 WeakPolarHBondContact O-CB 3.4Å; S784-A787 PolarHBondContact O-N 3.4Å; S784-Q788 PolarHBondContact O-N 3.38Å
785	T	81.3	Confident	73.9	Confident	73 Å²	73	100.5 Å²	100.5	45%	0.448	50%	0.504	S	S	.	.	H	α-helix	trans	-57.4	-42.5	175.7	-55.8	0	0	0	0	111.9	T710 E712 A787 Q788 V789	T710-T785 HydrophobicContact CG2-CG2 3.9Å; E712-T785 HydrophobicContact CG-CG2 4.11Å; T785-A787 VanDerWaalsContact C-N 3.31Å; T785-A787 PolarHBondContact O-N 3.21Å; T785-Q788 WeakPolarHBondContact O-CB 3.34Å; T785-Q788 PolarHBondContact O-N 3.18Å; T785-Q788 VanDerWaalsContact O-N 3.08Å; T785-V789 PolarHBondContact O-N 3.33Å; T785-V789 VanDerWaalsContact O-N 3.17Å
786	G	85.6	Confident	76.1	Confident	43 Å²	43	94 Å²	94	44%	0.443	47%	0.471	S	S	.	.	H	α-helix	trans	-61.6	-39.8	177.4	0	0	0	0	0	112.5	S784 Q788 V789 V790	S784-G786 VanDerWaalsContact C-N 3.31Å; S784-G786 PolarHBondContact O-N 3.03Å; G786-Q788 VanDerWaalsContact C-N 3.28Å; G786-Q788 PolarHBondContact O-N 3.27Å; G786-V789 PolarHBondContact O-N 3.14Å; G786-V790 WeakPolarHBondContact O-CG2 3.09Å; G786-V790 PolarHBondContact O-N 2.86Å
787	A	87.6	Confident	78.3	Confident	22 Å²	22	88.3 Å²	88.3	18%	0.182	45%	0.449	C	S	.	.	H	α-helix	trans	-64.1	-32.9	175.5	0	0	0	0	0	112.5	F782 S784 T785 I791	F782-A787 HydrophobicContact CB-CB 4.45Å; F782-A787 HydrophobicContact CD1-CB 4.15Å; S784-A787 WeakPolarHBondContact O-CB 3.4Å; S784-A787 PolarHBondContact O-N 3.4Å; T785-A787 VanDerWaalsContact C-N 3.31Å; T785-A787 PolarHBondContact O-N 3.21Å; A787-I791 WeakPolarHBondContact O-CD1 3.19Å; A787-I791 WeakPolarHBondContact O-CG1 3.45Å; A787-I791 PolarHBondContact O-N 2.93Å
788	Q	89.9	Confident	80.8	Confident	1 Å²	1	84.5 Å²	84.5	1%	0.005	43%	0.425	C	S	.	.	H	α-helix	trans	-67.1	-44.7	176.2	-67.7	168.4	42.3	0	0	111.2	T710 L713 T760 L783 S784 T785 G786 I791 T792	T710-Q788 VanDerWaalsContact CG2-OE1 3.3Å; T710-Q788 PolarHBondContact OG1-OE1 3.11Å; L713-Q788 HydrophobicContact CD1-CB 4.32Å; L713-Q788 HydrophobicContact CD2-CB 4.42Å; T760-Q788 HydrophobicContact CG2-CB 3.64Å; T760-Q788 HydrophobicContact CG2-CG 3.95Å; T760-Q788 WeakPolarHBondContact CG2-O 3.38Å; L783-Q788 PolarHBondContact O-NE2 3.48Å; S784-Q788 PolarHBondContact O-N 3.38Å; T785-Q788 WeakPolarHBondContact O-CB 3.34Å; T785-Q788 PolarHBondContact O-N 3.18Å; T785-Q788 VanDerWaalsContact O-N 3.08Å; G786-Q788 VanDerWaalsContact C-N 3.28Å; G786-Q788 PolarHBondContact O-N 3.27Å; Q788-I791 PolarHBondContact O-N 3Å; Q788-T792 PolarHBondContact O-N 3.38Å; Q788-T792 VanDerWaalsContact O-N 3.08Å; Q788-T792 PolarHBondContact O-OG1 2.96Å; Q788-T792 VanDerWaalsContact O-OG1 3.09Å
789	V	92.9	Very high	83.3	Confident	40 Å²	40	75.7 Å²	75.7	24%	0.242	39%	0.387	C	S	.	.	H	α-helix	trans	-62	-47.3	177.1	177.5	0	0	0	0	110.6	E712 M716 T785 G786 I791 T792 C793	E712-V789 HydrophobicContact CB-CG2 3.58Å; E712-V789 HydrophobicContact CG-CG2 4.07Å; M716-V789 HydrophobicContact CE-CG1 4.41Å; M716-V789 HydrophobicContact CE-CG2 4.35Å; T785-V789 PolarHBondContact O-N 3.33Å; T785-V789 VanDerWaalsContact O-N 3.17Å; G786-V789 PolarHBondContact O-N 3.14Å; V789-I791 VanDerWaalsContact C-N 3.35Å; V789-I791 PolarHBondContact O-N 3.27Å; V789-T792 PolarHBondContact O-N 3.02Å; V789-T792 VanDerWaalsContact O-N 3.12Å; V789-C793 PolarHBondContact O-N 3.04Å; V789-C793 PolarHBondContact O-SG 3.4Å
790	V	93.6	Very high	85.6	Confident	86 Å²	86	67.7 Å²	67.7	52%	0.521	36%	0.362	S	S	.	.	H	α-helix	trans	-58.8	-44	178.3	172.7	0	0	0	0	111.9	G786 T792 C793 I794	G786-V790 WeakPolarHBondContact O-CG2 3.09Å; G786-V790 PolarHBondContact O-N 2.86Å; V790-T792 VanDerWaalsContact C-N 3.33Å; V790-T792 PolarHBondContact O-N 2.69Å; V790-C793 PolarHBondContact O-N 2.86Å; V790-I794 HydrophobicContact CG1-CD1 3.92Å; V790-I794 VanDerWaalsContact O-CG1 3.29Å; V790-I794 WeakPolarHBondContact O-CG1 3.45Å; V790-I794 PolarHBondContact O-N 3.22Å
791	I	91.8	Very high	87.6	Confident	40 Å²	40	62.7 Å²	62.7	21%	0.205	35%	0.354	C	S	.	.	H	α-helix	trans	-59.4	-46.4	176.2	-69.9	163.6	0	0	0	110.5	A787 Q788 V789 I794 L795	A787-I791 WeakPolarHBondContact O-CD1 3.19Å; A787-I791 WeakPolarHBondContact O-CG1 3.45Å; A787-I791 PolarHBondContact O-N 2.93Å; Q788-I791 PolarHBondContact O-N 3Å; V789-I791 VanDerWaalsContact C-N 3.35Å; V789-I791 PolarHBondContact O-N 3.27Å; I791-I794 PolarHBondContact O-N 3.36Å; I791-L795 HydrophobicContact CG2-CD1 4.32Å; I791-L795 WeakPolarHBondContact O-CG 3.31Å; I791-L795 PolarHBondContact O-N 3.01Å; I791-L795 VanDerWaalsContact O-N 3.09Å
792	T	93.8	Very high	89.5	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-63.4	-43	178.9	-56.9	0	0	0	0	111.8	L713 M716 A757 T760 Q788 V789 V790 I794 L795 I796	L713-T792 WeakPolarHBondContact CD2-OG1 3.49Å; M716-T792 HydrophobicContact CE-CG2 3.8Å; M716-T792 HydrophobicContact SD-CG2 3.84Å; A757-T792 HydrophobicContact CB-CG2 4.09Å; T760-T792 WeakPolarHBondContact CB-OG1 3.05Å; T760-T792 PolarHBondContact OG1-OG1 2.75Å; Q788-T792 PolarHBondContact O-N 3.38Å; Q788-T792 VanDerWaalsContact O-N 3.08Å; Q788-T792 PolarHBondContact O-OG1 2.96Å; Q788-T792 VanDerWaalsContact O-OG1 3.09Å; V789-T792 PolarHBondContact O-N 3.02Å; V789-T792 VanDerWaalsContact O-N 3.12Å; V790-T792 VanDerWaalsContact C-N 3.33Å; V790-T792 PolarHBondContact O-N 2.69Å; T792-I794 VanDerWaalsContact C-N 3.3Å; T792-I794 PolarHBondContact O-N 2.85Å; T792-L795 PolarHBondContact O-N 3.08Å; T792-L795 VanDerWaalsContact O-N 3.17Å; T792-I796 HydrophobicContact CG2-CD1 3.93Å; T792-I796 WeakPolarHBondContact O-CG1 3.39Å; T792-I796 PolarHBondContact O-N 3.04Å
793	C	94.6	Very high	90.9	Very high	67 Å²	67	48.7 Å²	48.7	45%	0.453	30%	0.3	S	S	.	.	H	α-helix	trans	-61.7	-37	175.8	-66.7	0	0	0	0	112.5	V789 V790 I796 G797	V789-C793 PolarHBondContact O-N 3.04Å; V789-C793 PolarHBondContact O-SG 3.4Å; V790-C793 PolarHBondContact O-N 2.86Å; C793-I796 PolarHBondContact O-N 3.12Å; C793-G797 PolarHBondContact O-N 3.17Å
794	I	96	Very high	92.1	Very high	105 Å²	105	47.7 Å²	47.7	54%	0.538	30%	0.298	S	S	.	.	H	α-helix	trans	-63.6	-44.2	174.2	-69.2	165.1	0	0	0	110.5	V790 I791 T792 I796 G797 V798	V790-I794 HydrophobicContact CG1-CD1 3.92Å; V790-I794 VanDerWaalsContact O-CG1 3.29Å; V790-I794 WeakPolarHBondContact O-CG1 3.45Å; V790-I794 PolarHBondContact O-N 3.22Å; I791-I794 PolarHBondContact O-N 3.36Å; T792-I794 VanDerWaalsContact C-N 3.3Å; T792-I794 PolarHBondContact O-N 2.85Å; I794-I796 PolarHBondContact O-N 3.07Å; I794-G797 PolarHBondContact O-N 2.09Å; I794-V798 WeakPolarHBondContact O-CG2 3.33Å; I794-V798 PolarHBondContact O-N 2.7Å
795	L	95.8	Very high	92.6	Very high	27 Å²	27	47.1 Å²	47.1	14%	0.141	29%	0.291	C	S	.	.	H	α-helix	trans	-62.7	-42.7	178	-63.9	172.1	0	0	0	111.7	F759 I791 T792 G797 V798 E799 F841 L845	F759-L795 HydrophobicContact CD1-CD1 3.71Å; F759-L795 HydrophobicContact CE1-CD1 4.38Å; I791-L795 HydrophobicContact CG2-CD1 4.32Å; I791-L795 WeakPolarHBondContact O-CG 3.31Å; I791-L795 PolarHBondContact O-N 3.01Å; I791-L795 VanDerWaalsContact O-N 3.09Å; T792-L795 PolarHBondContact O-N 3.08Å; T792-L795 VanDerWaalsContact O-N 3.17Å; L795-G797 VanDerWaalsContact C-N 3.31Å; L795-G797 PolarHBondContact O-N 3.05Å; L795-V798 PolarHBondContact O-N 3.24Å; L795-E799 PolarHBondContact O-N 3.4Å; L795-F841 HydrophobicContact CD2-CZ 4.03Å; L795-F841 WeakPolarHBondContact O-CE1 3.24Å; L795-L845 HydrophobicContact CD1-CD2 4.26Å; L795-L845 HydrophobicContact CD2-CD2 4.24Å
796	I	96.1	Very high	93	Very high	34 Å²	34	46.2 Å²	46.2	17%	0.174	28%	0.281	C	S	.	.	H	α-helix	trans	-64	-38.7	174.3	-62.9	161.5	0	0	0	110.8	M753 T792 C793 I794 V798 E799 L800	M753-I796 HydrophobicContact CB-CD1 4.4Å; M753-I796 HydrophobicContact CG-CD1 3.75Å; M753-I796 HydrophobicContact CG-CG1 4.18Å; T792-I796 HydrophobicContact CG2-CD1 3.93Å; T792-I796 WeakPolarHBondContact O-CG1 3.39Å; T792-I796 PolarHBondContact O-N 3.04Å; C793-I796 PolarHBondContact O-N 3.12Å; I794-I796 PolarHBondContact O-N 3.07Å; I796-V798 VanDerWaalsContact C-N 3.34Å; I796-V798 PolarHBondContact O-N 2.98Å; I796-E799 WeakPolarHBondContact O-CB 3.3Å; I796-E799 PolarHBondContact O-N 3.01Å; I796-L800 PolarHBondContact O-N 3.47Å
797	G	95.6	Very high	93.2	Very high	30 Å²	30	45.9 Å²	45.9	31%	0.309	27%	0.269	S	S	.	.	H	α-helix	trans	-63.5	-36.5	176.8	0	0	0	0	0	113.2	C793 I794 L795 L800 V801	C793-G797 PolarHBondContact O-N 3.17Å; I794-G797 PolarHBondContact O-N 2.09Å; L795-G797 VanDerWaalsContact C-N 3.31Å; L795-G797 PolarHBondContact O-N 3.05Å; G797-L800 PolarHBondContact O-N 2.97Å; G797-V801 WeakPolarHBondContact O-CG2 3.39Å; G797-V801 PolarHBondContact O-N 3.4Å; G797-V801 VanDerWaalsContact O-N 3.1Å
798	V	95.9	Very high	93.3	Very high	61 Å²	61	51 Å²	51	37%	0.37	29%	0.292	S	S	.	.	H	α-helix	trans	-61.5	-45.5	173	171.8	0	0	0	0	110.5	I794 L795 I796 L800 V801 I802 F841	I794-V798 WeakPolarHBondContact O-CG2 3.33Å; I794-V798 PolarHBondContact O-N 2.7Å; L795-V798 PolarHBondContact O-N 3.24Å; I796-V798 VanDerWaalsContact C-N 3.34Å; I796-V798 PolarHBondContact O-N 2.98Å; V798-L800 PolarHBondContact O-N 3.07Å; V798-V801 PolarHBondContact O-N 3.48Å; V798-I802 HydrophobicContact CG1-CD1 4Å; V798-I802 WeakPolarHBondContact O-CG1 3.49Å; V798-I802 PolarHBondContact O-N 2.85Å; V798-I802 VanDerWaalsContact O-N 3.11Å; V798-F841 HydrophobicContact CB-CE1 4.25Å; V798-F841 HydrophobicContact CB-CZ 4.02Å; V798-F841 HydrophobicContact CG1-CD1 4.48Å; V798-F841 HydrophobicContact CG1-CD2 4.13Å; V798-F841 HydrophobicContact CG1-CE1 4.16Å; V798-F841 HydrophobicContact CG1-CE2 3.8Å; V798-F841 HydrophobicContact CG1-CG 4.45Å; V798-F841 HydrophobicContact CG1-CZ 3.8Å
799	E	95.5	Very high	93.3	Very high	0 Å²	0	56.7 Å²	56.7	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-61.8	-43.6	177.2	-174.6	59.2	-146	0	0	112.3	C748 A752 L795 I796 V801 I802 T803 P838 F841	C748-E799 HydrophobicContact CB-CG 4.3Å; A752-E799 HydrophobicContact CB-CB 3.65Å; A752-E799 HydrophobicContact CB-CG 3.69Å; L795-E799 PolarHBondContact O-N 3.4Å; I796-E799 WeakPolarHBondContact O-CB 3.3Å; I796-E799 PolarHBondContact O-N 3.01Å; E799-V801 VanDerWaalsContact C-N 3.31Å; E799-V801 PolarHBondContact O-N 3.49Å; E799-I802 PolarHBondContact O-N 3.42Å; E799-T803 WeakPolarHBondContact O-CB 3.11Å; E799-T803 PolarHBondContact O-N 2.95Å; E799-T803 PolarHBondContact O-OG1 3.41Å; E799-P838 VanDerWaalsContact OE1-O 3.08Å; E799-F841 HydrophobicContact CB-CD1 4.22Å; E799-F841 VanDerWaalsContact OE2-CB 3.31Å; E799-F841 WeakPolarHBondContact OE2-CB 3.18Å; E799-F841 VanDerWaalsContact OE2-CD1 3.24Å; E799-F841 WeakPolarHBondContact OE2-CD1 3.36Å
800	L	94.7	Very high	93.1	Very high	80 Å²	80	56.9 Å²	56.9	42%	0.419	32%	0.32	S	S	.	.	H	α-helix	trans	-59.4	-42.6	178.6	-178.5	65.7	0	0	0	111.6	L749 I796 G797 V798 T803 V804	L749-L800 HydrophobicContact CD1-CD1 4.15Å; L749-L800 HydrophobicContact CD2-CB 4.02Å; L749-L800 HydrophobicContact CD2-CD1 3.97Å; I796-L800 PolarHBondContact O-N 3.47Å; G797-L800 PolarHBondContact O-N 2.97Å; V798-L800 PolarHBondContact O-N 3.07Å; L800-T803 PolarHBondContact O-N 2.91Å; L800-V804 HydrophobicContact CD1-CG2 4.43Å; L800-V804 VanDerWaalsContact O-CG2 3.29Å; L800-V804 WeakPolarHBondContact O-CG2 3.38Å; L800-V804 PolarHBondContact O-N 2.93Å
801	V	94.9	Very high	92.8	Very high	94 Å²	94	56.4 Å²	56.4	57%	0.57	32%	0.318	S	S	*	.	H	α-helix	trans	-63.8	-45	177	171.9	0	0	0	0	111	G797 V798 E799 T803 V804 V805	G797-V801 WeakPolarHBondContact O-CG2 3.39Å; G797-V801 PolarHBondContact O-N 3.4Å; G797-V801 VanDerWaalsContact O-N 3.1Å; V798-V801 PolarHBondContact O-N 3.48Å; E799-V801 VanDerWaalsContact C-N 3.31Å; E799-V801 PolarHBondContact O-N 3.49Å; V801-T803 VanDerWaalsContact C-N 3.33Å; V801-T803 PolarHBondContact O-N 3.44Å; V801-V804 PolarHBondContact O-N 3.46Å; V801-V805 HydrophobicContact CG1-CG2 4.48Å; V801-V805 VanDerWaalsContact O-CG2 3.31Å; V801-V805 WeakPolarHBondContact O-CG2 3.32Å; V801-V805 PolarHBondContact O-N 3.45Å
802	I	93.3	Very high	92.5	Very high	46 Å²	46	55.4 Å²	55.4	24%	0.236	32%	0.315	C	S	.	.	H	α-helix	trans	-58.4	-48.9	176.9	-66.2	167.4	0	0	0	109.8	V798 E799 V804 V805 F806 F841	V798-I802 HydrophobicContact CG1-CD1 4Å; V798-I802 WeakPolarHBondContact O-CG1 3.49Å; V798-I802 PolarHBondContact O-N 2.85Å; V798-I802 VanDerWaalsContact O-N 3.11Å; E799-I802 PolarHBondContact O-N 3.42Å; I802-V804 PolarHBondContact O-N 3.23Å; I802-V805 PolarHBondContact O-N 3.48Å; I802-F806 HydrophobicContact CG2-CD2 3.89Å; I802-F806 HydrophobicContact CG2-CE2 4.03Å; I802-F806 WeakPolarHBondContact O-CD2 3.18Å; I802-F806 PolarHBondContact O-N 2.96Å; I802-F841 HydrophobicContact CD1-CB 3.82Å; I802-F841 HydrophobicContact CD1-CG 4.19Å
803	T	91.5	Very high	92.3	Very high	3 Å²	3	56.4 Å²	56.4	2%	0.018	32%	0.323	C	S	.	.	H	α-helix	trans	-59.4	-45.2	179.7	-61.8	0	0	0	0	112	V745 E799 L800 V801 F806 L807	V745-T803 HydrophobicContact CB-CG2 4.48Å; V745-T803 HydrophobicContact CG2-CG2 4.01Å; E799-T803 WeakPolarHBondContact O-CB 3.11Å; E799-T803 PolarHBondContact O-N 2.95Å; E799-T803 PolarHBondContact O-OG1 3.41Å; L800-T803 PolarHBondContact O-N 2.91Å; V801-T803 VanDerWaalsContact C-N 3.33Å; V801-T803 PolarHBondContact O-N 3.44Å; T803-F806 PolarHBondContact O-N 2.8Å; T803-L807 HydrophobicContact CG2-CD1 4.24Å; T803-L807 WeakPolarHBondContact O-CG 3.39Å; T803-L807 PolarHBondContact O-N 3.48Å
804	V	91.8	Very high	91.9	Very high	68 Å²	68	53.8 Å²	53.8	41%	0.412	31%	0.306	S	S	.	.	H	α-helix	trans	-64.2	-41.8	178.3	170	0	0	0	0	111.7	L800 V801 I802 F806 L807 I808	L800-V804 HydrophobicContact CD1-CG2 4.43Å; L800-V804 VanDerWaalsContact O-CG2 3.29Å; L800-V804 WeakPolarHBondContact O-CG2 3.38Å; L800-V804 PolarHBondContact O-N 2.93Å; V801-V804 PolarHBondContact O-N 3.46Å; I802-V804 PolarHBondContact O-N 3.23Å; V804-F806 VanDerWaalsContact C-N 3.33Å; V804-F806 PolarHBondContact O-N 3.15Å; V804-L807 PolarHBondContact O-N 3.28Å; V804-I808 HydrophobicContact CG1-CD1 4.04Å; V804-I808 WeakPolarHBondContact O-CG1 3.48Å; V804-I808 PolarHBondContact O-N 2.88Å; V804-I808 VanDerWaalsContact O-N 3.11Å
805	V	92.1	Very high	91.5	Very high	70 Å²	70	52.4 Å²	52.4	42%	0.424	30%	0.297	S	S	.	.	H	α-helix	trans	-59.6	-45.2	175.9	169.7	0	0	0	0	110.7	V801 I802 L807 I808 L809	V801-V805 HydrophobicContact CG1-CG2 4.48Å; V801-V805 VanDerWaalsContact O-CG2 3.31Å; V801-V805 WeakPolarHBondContact O-CG2 3.32Å; V801-V805 PolarHBondContact O-N 3.45Å; I802-V805 PolarHBondContact O-N 3.48Å; V805-L807 PolarHBondContact O-N 3.46Å; V805-I808 PolarHBondContact O-N 3.2Å; V805-L809 HydrophobicContact CG1-CD1 3.92Å; V805-L809 HydrophobicContact CG1-CG 4.38Å; V805-L809 WeakPolarHBondContact O-CG 3.47Å; V805-L809 PolarHBondContact O-N 2.98Å
806	F	90.2	Very high	91	Very high	54 Å²	54	55.2 Å²	55.2	24%	0.237	31%	0.308	C	S	.	.	H	α-helix	trans	-67.4	-32.4	178.2	-86.6	-78.5	0	0	0	113.7	I802 T803 V804 I808 L809 E810 A837 P838	I802-F806 HydrophobicContact CG2-CD2 3.89Å; I802-F806 HydrophobicContact CG2-CE2 4.03Å; I802-F806 WeakPolarHBondContact O-CD2 3.18Å; I802-F806 PolarHBondContact O-N 2.96Å; T803-F806 PolarHBondContact O-N 2.8Å; V804-F806 VanDerWaalsContact C-N 3.33Å; V804-F806 PolarHBondContact O-N 3.15Å; F806-I808 VanDerWaalsContact C-N 3.32Å; F806-L809 PolarHBondContact O-N 3.29Å; F806-E810 PolarHBondContact O-N 2.89Å; F806-A837 HydrophobicContact CD1-CB 4.37Å; F806-A837 HydrophobicContact CD2-CB 4.38Å; F806-A837 HydrophobicContact CE1-CB 3.58Å; F806-A837 HydrophobicContact CE2-CB 3.61Å; F806-A837 HydrophobicContact CZ-CB 3.16Å; F806-P838 HydrophobicContact CB-CG 4.23Å; F806-P838 HydrophobicContact CD2-CG 4.12Å; F806-P838 HydrophobicContact CG-CG 4.17Å
807	L	89.6	Confident	90.4	Very high	36 Å²	36	55.6 Å²	55.6	19%	0.188	31%	0.311	C	S	.	.	H	α-helix	trans	-66.8	-31.9	173.1	-76.1	168.4	0	0	0	113.1	R744 V745 T803 V804 V805 E810 P812	R744-L807 HydrophobicContact CB-CD2 4.03Å; V745-L807 HydrophobicContact CG2-CD1 3.6Å; T803-L807 HydrophobicContact CG2-CD1 4.24Å; T803-L807 WeakPolarHBondContact O-CG 3.39Å; T803-L807 PolarHBondContact O-N 3.48Å; V804-L807 PolarHBondContact O-N 3.28Å; V805-L807 PolarHBondContact O-N 3.46Å; L807-E810 CarbonylContact O-C 3.43Å; L807-P812 HydrophobicContact CD2-CG 3.96Å
808	I	90.1	Very high	89.7	Confident	129 Å²	129	58.1 Å²	58.1	66%	0.662	31%	0.314	S	S	*	.	H	α-helix	trans	-74.9	-42.9	175.6	-65.6	165.9	0	0	0	110.5	V804 V805 F806	V804-I808 HydrophobicContact CG1-CD1 4.04Å; V804-I808 WeakPolarHBondContact O-CG1 3.48Å; V804-I808 PolarHBondContact O-N 2.88Å; V804-I808 VanDerWaalsContact O-N 3.11Å; V805-I808 PolarHBondContact O-N 3.2Å; F806-I808 VanDerWaalsContact C-N 3.32Å
809	L	89.9	Confident	88.8	Confident	120 Å²	120	59.8 Å²	59.8	63%	0.628	33%	0.329	S	S	*	.	H	α-helix	trans	-68.1	-38.8	-179.7	-68.4	175.6	0	0	0	112.3	V805 F806	V805-L809 HydrophobicContact CG1-CD1 3.92Å; V805-L809 HydrophobicContact CG1-CG 4.38Å; V805-L809 WeakPolarHBondContact O-CG 3.47Å; V805-L809 PolarHBondContact O-N 2.98Å; F806-L809 PolarHBondContact O-N 3.29Å
810	E	87.9	Confident	87.8	Confident	45 Å²	45	62 Å²	62	21%	0.21	34%	0.34	C	S	.	.	S	Bend	trans	-126.5	91.9	177.9	-71.3	-176.7	-162.7	0	0	109.6	R744 F806 L807 S831	R744-E810 PolarHBondContact NH1-O 3.43Å; R744-E810 IonicContact NH2-OE2 3.27Å; R744-E810 PolarHBondContact NH2-OE2 3.05Å; F806-E810 PolarHBondContact O-N 2.89Å; L807-E810 CarbonylContact O-C 3.43Å; E810-S831 WeakPolarHBondContact OE1-CB 3.35Å; E810-S831 WeakPolarHBondContact OE2-CB 3.3Å; E810-S831 PolarHBondContact OE2-N 3.48Å
811	P	87.7	Confident	86.6	Confident	75 Å²	75	63 Å²	63	49%	0.487	35%	0.351	S	S	.	.			trans	-61.1	130.2	179.7	23.4	-32.6	0	0	0	110.5	A813	P811-A813 PolarHBondContact O-N 3.38Å
812	P	86.1	Confident	85.6	Confident	20 Å²	20	65 Å²	65	13%	0.13	35%	0.349	C	S	.	.			trans	-69.4	128.3	179.3	26.7	-31.4	0	0	0	110.3	C740 V741 L807	C740-P812 HydrophobicContact CB-CB 3.9Å; V741-P812 HydrophobicContact CB-CG 4.26Å; V741-P812 HydrophobicContact CG2-CB 4.08Å; V741-P812 HydrophobicContact CG2-CG 3.29Å; L807-P812 HydrophobicContact CD2-CG 3.96Å
813	A	88.1	Confident	85	Confident	21 Å²	21	68.8 Å²	68.8	17%	0.174	36%	0.36	C	S	.	.			trans	-142.9	155.8	175	0	0	0	0	0	109.3	P811 R829	P811-A813 PolarHBondContact O-N 3.38Å; A813-R829 WeakPolarHBondContact O-CB 3.32Å; A813-R829 PolarHBondContact O-N 3Å
814	A	88.2	Confident	84.7	Confident	11 Å²	11	69 Å²	69	9%	0.091	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	131.2	168.4	0	0	0	0	0	109.1	P735 L826 V827 P1151	P735-A814 HydrophobicContact CB-CB 4.32Å; P735-A814 VanDerWaalsContact O-CB 3.28Å; P735-A814 WeakPolarHBondContact O-CB 3.37Å; A814-L826 HydrophobicContact CB-CD1 4.27Å; A814-V827 WeakPolarHBondContact CA-O 3.46Å; A814-P1151 HydrophobicContact CB-CG 4.48Å
815	E	85.7	Confident	84.4	Confident	77 Å²	77	67.4 Å²	67.4	36%	0.36	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	152.9	-177.6	-73.5	-173.1	137.4	0	0	111.7	V827 R829	E815-V827 PolarHBondContact N-O 3.19Å; E815-V827 PolarHBondContact O-N 3.01Å; E815-R829 HydrophobicContact CG-CB 4.5Å; E815-R829 IonicContact OE1-CZ 2.58Å; E815-R829 IonicContact OE1-NE 3.3Å; E815-R829 PolarHBondContact OE1-NE 3.29Å; E815-R829 IonicContact OE1-NH2 3.8Å; E815-R829 PolarHBondContact OE1-NH2 3.13Å; E815-R829 WeakPolarHBondContact OE2-CB 3.46Å; E815-R829 VanDerWaalsContact OE2-CG 3.29Å; E815-R829 WeakPolarHBondContact OE2-CG 3.44Å; E815-R829 IonicContact OE2-CZ 3.26Å; E815-R829 IonicContact OE2-NE 3.74Å; E815-R829 PolarHBondContact OE2-NE 3.22Å
816	F	86	Confident	84.2	Confident	86 Å²	86	65.1 Å²	65.1	38%	0.377	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	117.7	169.3	-60.1	-62.7	0	0	0	110	V666 V824 L825 L826 P1151	V666-F816 HydrophobicContact CB-CE1 4.45Å; V666-F816 HydrophobicContact CG1-CD1 4.15Å; V666-F816 HydrophobicContact CG1-CE1 3.81Å; V666-F816 HydrophobicContact CG2-CD1 4.23Å; V666-F816 HydrophobicContact CG2-CE1 3.72Å; F816-V824 HydrophobicContact CB-CG1 3.95Å; F816-V824 HydrophobicContact CD1-CG1 3.77Å; F816-V824 HydrophobicContact CG-CG1 4.1Å; F816-L825 CarbonylContact C-O 3.56Å; F816-L825 WeakPolarHBondContact CA-O 3.14Å; F816-L826 HydrophobicContact CD1-CD1 4.05Å; F816-L826 HydrophobicContact CE1-CD1 3.85Å; F816-P1151 HydrophobicContact CZ-CB 4.46Å
817	D	83.2	Confident	84.1	Confident	41 Å²	41	64.4 Å²	64.4	22%	0.219	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	119.2	172.8	-179.8	14.4	0	0	0	110.1	S819 L825 V827	D817-S819 WeakPolarHBondContact OD1-CB 3.39Å; D817-S819 PolarHBondContact OD1-N 3.49Å; D817-S819 PolarHBondContact OD1-OG 3.15Å; D817-L825 HydrophobicContact CB-CB 4.23Å; D817-L825 PolarHBondContact N-O 2.84Å; D817-L825 PolarHBondContact O-N 3.47Å; D817-V827 HydrophobicContact CB-CG2 3.75Å
818	H	82.2	Confident	84.1	Confident	83 Å²	83	63.4 Å²	63.4	38%	0.384	33%	0.331	S	S	.	.			trans	-104.3	16.5	-179.8	-58.1	-65.2	0	0	0	112.9	V620 I820	V620-H818 HydrophobicContact CG1-CB 3.91Å; V620-H818 VanDerWaalsContact CG1-CD2 3.44Å; V620-H818 WeakPolarHBondContact CG1-CD2 3.41Å; V620-H818 VanDerWaalsContact CG1-CG 3.49Å; H818-I820 PolarHBondContact O-N 3.04Å
819	S	75.3	Confident	84	Confident	97 Å²	97	62 Å²	62	68%	0.678	32%	0.318	S	S	*	.			trans	-62.8	-22.9	-176.1	-63.9	0	0	0	0	114.2	D817	D817-S819 WeakPolarHBondContact OD1-CB 3.39Å; D817-S819 PolarHBondContact OD1-N 3.49Å; D817-S819 PolarHBondContact OD1-OG 3.15Å
820	I	75.1	Confident	83.7	Confident	45 Å²	45	58.6 Å²	58.6	23%	0.231	30%	0.298	C	S	.	.	S	Bend	trans	-108	125.7	-179.1	-56.3	-179.8	0	0	0	109.3	H818 R822 R823 L825 N891	H818-I820 PolarHBondContact O-N 3.04Å; I820-R822 PolarHBondContact O-N 3Å; I820-R823 HydrophobicContact CB-CB 4.32Å; I820-R823 HydrophobicContact CG2-CB 4.36Å; I820-R823 HydrophobicContact CG2-CG 4.22Å; I820-R823 PolarHBondContact O-N 2.94Å; I820-L825 HydrophobicContact CD1-CD1 4.1Å; I820-N891 HydrophobicContact CD1-CB 4.44Å
821	P	70.3	Confident	83.4	Confident	102 Å²	102	58.9 Å²	58.9	66%	0.662	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.1	139.4	176.7	-22.6	31.2	0	0	0	111.8	R823	P821-R823 PolarHBondContact O-N 3.08Å
822	R	74.1	Confident	83.1	Confident	137 Å²	137	63.2 Å²	63.2	52%	0.517	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	62	17.6	179.1	-51.7	-178.4	74.2	-175.6	2.8	115.3	W623 L664 I820	W623-R822 HydrophobicContact CD2-CG 3.74Å; W623-R822 HydrophobicContact CE3-CG 3.82Å; W623-R822 HydrophobicContact CH2-CG 3.57Å; W623-R822 HydrophobicContact CZ2-CG 3.49Å; W623-R822 VanDerWaalsContact CZ2-CG 3.49Å; W623-R822 HydrophobicContact CZ3-CG 3.74Å; L664-R822 HydrophobicContact CD2-CB 4.47Å; I820-R822 PolarHBondContact O-N 3Å
823	R	80.2	Confident	82.8	Confident	125 Å²	125	68.7 Å²	68.7	47%	0.472	34%	0.341	S	S	.	.			trans	-133.8	143.8	174.2	-59.1	-170.4	-171.5	-159.1	-0.4	110.5	E667 I820 P821	E667-R823 IonicContact OE2-NH1 3.14Å; I820-R823 HydrophobicContact CB-CB 4.32Å; I820-R823 HydrophobicContact CG2-CB 4.36Å; I820-R823 HydrophobicContact CG2-CG 4.22Å; I820-R823 PolarHBondContact O-N 2.94Å; P821-R823 PolarHBondContact O-N 3.08Å
824	V	84.6	Confident	82.4	Confident	6 Å²	6	67.9 Å²	67.9	4%	0.036	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	106.1	174.1	-180	0	0	0	0	106.5	L664 V666 E667 F816	L664-V824 HydrophobicContact CB-CG2 3.71Å; L664-V824 HydrophobicContact CD1-CG2 4.14Å; V666-V824 CarbonylContact C-O 3.51Å; V666-V824 WeakPolarHBondContact CA-O 3.35Å; V666-V824 HydrophobicContact CG2-CG1 4.18Å; E667-V824 PolarHBondContact N-O 2.89Å; F816-V824 HydrophobicContact CB-CG1 3.95Å; F816-V824 HydrophobicContact CD1-CG1 3.77Å; F816-V824 HydrophobicContact CG-CG1 4.1Å
825	L	85.7	Confident	82.2	Confident	36 Å²	36	67.8 Å²	67.8	19%	0.188	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	131	-178.1	-62.6	165.8	0	0	0	109.3	E667 F816 D817 I820 V827	E667-L825 HydrophobicContact CB-CD2 3.85Å; E667-L825 CarbonylContact O-C 3.57Å; E667-L825 WeakPolarHBondContact O-CA 3.48Å; F816-L825 CarbonylContact C-O 3.56Å; F816-L825 WeakPolarHBondContact CA-O 3.14Å; D817-L825 HydrophobicContact CB-CB 4.23Å; D817-L825 PolarHBondContact N-O 2.84Å; D817-L825 PolarHBondContact O-N 3.47Å; I820-L825 HydrophobicContact CD1-CD1 4.1Å; L825-V827 HydrophobicContact CB-CG1 4.15Å
826	L	88.6	Confident	82.3	Confident	22 Å²	22	65.9 Å²	65.9	12%	0.115	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	115.1	170.2	-178.8	68.3	0	0	0	108.9	V666 E667 P735 A814 F816	V666-L826 HydrophobicContact CG1-CB 3.65Å; E667-L826 PolarHBondContact O-N 3.31Å; P735-L826 HydrophobicContact CB-CG 4.23Å; P735-L826 HydrophobicContact CG-CG 4.39Å; A814-L826 HydrophobicContact CB-CD1 4.27Å; F816-L826 HydrophobicContact CD1-CD1 4.05Å; F816-L826 HydrophobicContact CE1-CD1 3.85Å
827	V	88.7	Confident	82.2	Confident	39 Å²	39	63.1 Å²	63.1	24%	0.236	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	159.9	-174.5	-61.4	0	0	0	0	111.7	A814 E815 D817 L825	A814-V827 WeakPolarHBondContact CA-O 3.46Å; E815-V827 PolarHBondContact N-O 3.19Å; E815-V827 PolarHBondContact O-N 3.01Å; D817-V827 HydrophobicContact CB-CG2 3.75Å; L825-V827 HydrophobicContact CB-CG1 4.15Å
828	C	89.5	Confident	82.4	Confident	15 Å²	15	61.5 Å²	61.5	10%	0.101	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	137.8	167.8	-68.6	0	0	0	0	110.7	C740 F830	C740-C828 WeakPolarHBondContact CA-SG 3.28Å; C740-C828 HydrophobicContact CB-CB 3.71Å; C740-C828 WeakPolarHBondContact CB-SG 3.16Å; C740-C828 WeakPolarHBondContact SG-CA 3.44Å; C740-C828 WeakPolarHBondContact SG-CB 3.34Å; C740-C828 CovalentContact SG-SG 2.04Å; C740-C828 PolarHBondContact SG-SG 2.96Å; C828-F830 HydrophobicContact CB-CD2 4.03Å; C828-F830 HydrophobicContact CB-CE2 3.54Å; C828-F830 HydrophobicContact CB-CZ 4.14Å; C828-F830 WeakPolarHBondContact O-CD2 3.21Å; C828-F830 PolarHBondContact O-N 3.34Å; C828-F830 VanDerWaalsContact O-N 3.08Å
829	R	87.5	Confident	82.8	Confident	98 Å²	98	57.9 Å²	57.9	37%	0.37	29%	0.291	S	S	.	.			trans	-61	111.6	176	-175	-176.9	-69.4	158.4	-0.8	110.1	R744 A813 E815	R744-R829 VanDerWaalsContact CZ-O 3.25Å; R744-R829 PolarHBondContact NH2-O 3.05Å; A813-R829 WeakPolarHBondContact O-CB 3.32Å; A813-R829 PolarHBondContact O-N 3Å; E815-R829 HydrophobicContact CG-CB 4.5Å; E815-R829 IonicContact OE1-CZ 2.58Å; E815-R829 IonicContact OE1-NE 3.3Å; E815-R829 PolarHBondContact OE1-NE 3.29Å; E815-R829 IonicContact OE1-NH2 3.8Å; E815-R829 PolarHBondContact OE1-NH2 3.13Å; E815-R829 WeakPolarHBondContact OE2-CB 3.46Å; E815-R829 VanDerWaalsContact OE2-CG 3.29Å; E815-R829 WeakPolarHBondContact OE2-CG 3.44Å; E815-R829 IonicContact OE2-CZ 3.26Å; E815-R829 IonicContact OE2-NE 3.74Å; E815-R829 PolarHBondContact OE2-NE 3.22Å
830	F	82.6	Confident	83.5	Confident	50 Å²	50	55 Å²	55	22%	0.219	28%	0.277	C	S	.	.			trans	-131	122.2	174.2	-71.1	-71.2	0	0	0	110.9	L743 R744 C828 F835	L743-F830 HydrophobicContact CD2-CE2 3.98Å; L743-F830 HydrophobicContact CD2-CZ 3.82Å; L743-F830 HydrophobicContact CG-CZ 4.08Å; R744-F830 HydrophobicContact CG-CD1 4.46Å; R744-F830 HydrophobicContact CG-CE1 3.51Å; R744-F830 HydrophobicContact CG-CZ 4.18Å; R744-F830 VanDerWaalsContact NE-CE1 3.3Å; C828-F830 HydrophobicContact CB-CD2 4.03Å; C828-F830 HydrophobicContact CB-CE2 3.54Å; C828-F830 HydrophobicContact CB-CZ 4.14Å; C828-F830 WeakPolarHBondContact O-CD2 3.21Å; C828-F830 PolarHBondContact O-N 3.34Å; C828-F830 VanDerWaalsContact O-N 3.08Å; F830-F835 HydrophobicContact CB-CB 4.34Å; F830-F835 HydrophobicContact CD1-CB 3.94Å; F830-F835 AromaticContact CD1-CD2 3.72Å; F830-F835 HydrophobicContact CD1-CD2 3.72Å; F830-F835 HydrophobicContact CD1-CG 4.31Å; F830-F835 AromaticContact CE1-CD2 3.6Å; F830-F835 HydrophobicContact CE1-CD2 3.6Å; F830-F835 HydrophobicContact CE1-CE2 4.33Å; F830-F835 HydrophobicContact CG-CB 4.35Å; F830-F835 HydrophobicContact CG-CD2 4.24Å; F830-F835 HydrophobicContact CZ-CD2 4.04Å; F830-F835 HydrophobicContact CZ-CE2 4.4Å
831	S	82.7	Confident	84.4	Confident	50 Å²	50	54.4 Å²	54.4	35%	0.35	27%	0.273	S	S	.	.			trans	-70.4	151.2	156.3	179.8	0	0	0	0	110.1	E810 M833 G834 F835	E810-S831 WeakPolarHBondContact OE1-CB 3.35Å; E810-S831 WeakPolarHBondContact OE2-CB 3.3Å; E810-S831 PolarHBondContact OE2-N 3.48Å; S831-M833 PolarHBondContact O-N 2.81Å; S831-M833 PolarHBondContact OG-N 3.43Å; S831-G834 PolarHBondContact O-N 3.41Å; S831-G834 VanDerWaalsContact O-N 3.12Å; S831-F835 PolarHBondContact O-N 3.04Å
832	K	80.2	Confident	85.4	Confident	166 Å²	166	49.6 Å²	49.6	72%	0.722	24%	0.241	S	C	*	.	H	α-helix	trans	-53.8	-39	171.5	-65.8	-179.8	-176.4	175.4	0	110.9	F836	K832-F836 WeakPolarHBondContact O-CD2 3.48Å
833	M	81.5	Confident	86.2	Confident	135 Å²	135	46 Å²	46	67%	0.665	23%	0.232	S	C	*	.	H	α-helix	trans	-76.5	-43.6	176.2	-70.3	-61.5	-67.2	0	0	111.6	S831 F835 F836 A837	S831-M833 PolarHBondContact O-N 2.81Å; S831-M833 PolarHBondContact OG-N 3.43Å; M833-F835 VanDerWaalsContact C-N 3.25Å; M833-F835 PolarHBondContact O-N 2.84Å; M833-F836 PolarHBondContact O-N 3.23Å; M833-A837 WeakPolarHBondContact O-CB 3.27Å; M833-A837 PolarHBondContact O-N 2.96Å
834	G	79.4	Confident	86.8	Confident	4 Å²	4	45.1 Å²	45.1	4%	0.041	23%	0.232	C	C	.	.	H	α-helix	trans	-60.8	-30.1	-178.6	0	0	0	0	0	114.3	S831 P838	S831-G834 PolarHBondContact O-N 3.41Å; S831-G834 VanDerWaalsContact O-N 3.12Å; G834-P838 WeakPolarHBondContact O-CD 3.49Å
835	F	83.5	Confident	87.2	Confident	10 Å²	10	45 Å²	45	4%	0.044	23%	0.231	C	C	.	.	H	α-helix	trans	-76.3	-48.3	174.1	-176.7	-101.6	0	0	0	112.9	F830 S831 M833 F839 F883 Y887 M897 F901	F830-F835 HydrophobicContact CB-CB 4.34Å; F830-F835 HydrophobicContact CD1-CB 3.94Å; F830-F835 AromaticContact CD1-CD2 3.72Å; F830-F835 HydrophobicContact CD1-CD2 3.72Å; F830-F835 HydrophobicContact CD1-CG 4.31Å; F830-F835 AromaticContact CE1-CD2 3.6Å; F830-F835 HydrophobicContact CE1-CD2 3.6Å; F830-F835 HydrophobicContact CE1-CE2 4.33Å; F830-F835 HydrophobicContact CG-CB 4.35Å; F830-F835 HydrophobicContact CG-CD2 4.24Å; F830-F835 HydrophobicContact CZ-CD2 4.04Å; F830-F835 HydrophobicContact CZ-CE2 4.4Å; S831-F835 PolarHBondContact O-N 3.04Å; M833-F835 VanDerWaalsContact C-N 3.25Å; M833-F835 PolarHBondContact O-N 2.84Å; F835-F839 HydrophobicContact CE1-CE2 4.17Å; F835-F839 HydrophobicContact CE2-CE2 4.2Å; F835-F839 AromaticContact CZ-CE2 3.92Å; F835-F839 HydrophobicContact CZ-CE2 3.92Å; F835-F839 VanDerWaalsContact O-CD2 3.28Å; F835-F839 WeakPolarHBondContact O-CD2 3.36Å; F835-F883 HydrophobicContact CE1-CE1 4.41Å; F835-F883 HydrophobicContact CE1-CZ 4.08Å; F835-F883 HydrophobicContact CZ-CZ 4.36Å; F835-Y887 HydrophobicContact CD1-CE1 4.49Å; F835-Y887 HydrophobicContact CE1-CE2 4.36Å; F835-M897 HydrophobicContact CD2-CE 4.1Å; F835-M897 HydrophobicContact CE1-CE 4.19Å; F835-M897 HydrophobicContact CE2-CE 3.38Å; F835-M897 HydrophobicContact CE2-SD 3.76Å; F835-M897 HydrophobicContact CZ-CE 3.43Å; F835-M897 VanDerWaalsContact CZ-CE 3.43Å; F835-M897 HydrophobicContact CZ-CG 4.27Å; F835-M897 HydrophobicContact CZ-SD 3.69Å; F835-F901 HydrophobicContact CZ-CZ 4.46Å
836	F	86.5	Confident	87.6	Confident	36 Å²	36	43.4 Å²	43.4	16%	0.158	22%	0.223	C	C	.	.	H	α-helix	trans	-86.5	-22.6	-171.4	-76.3	-68.8	0	0	0	114.8	K832 M833 F839 G840 F883 L884 Y887 F888	K832-F836 WeakPolarHBondContact O-CD2 3.48Å; M833-F836 PolarHBondContact O-N 3.23Å; F836-F839 PolarHBondContact O-N 3.02Å; F836-G840 PolarHBondContact O-N 3.08Å; F836-F883 AromaticContact CE1-CE1 3.88Å; F836-F883 HydrophobicContact CE1-CE1 3.88Å; F836-F883 HydrophobicContact CZ-CE1 4.44Å; F836-L884 HydrophobicContact CD1-CD2 3.77Å; F836-L884 HydrophobicContact CE1-CD2 3.25Å; F836-L884 HydrophobicContact CZ-CD2 3.8Å; F836-Y887 AromaticContact CE2-CD1 3.72Å; F836-Y887 HydrophobicContact CE2-CD1 3.72Å; F836-Y887 AromaticContact CE2-CE1 3.65Å; F836-Y887 HydrophobicContact CE2-CE1 3.65Å; F836-Y887 AromaticContact CZ-CD1 3.46Å; F836-Y887 HydrophobicContact CZ-CD1 3.46Å; F836-Y887 VanDerWaalsContact CZ-CD1 3.46Å; F836-Y887 AromaticContact CZ-CE1 3.77Å; F836-Y887 HydrophobicContact CZ-CE1 3.77Å; F836-Y887 HydrophobicContact CZ-CG 4.08Å; F836-F888 HydrophobicContact CD2-CE1 4.48Å; F836-F888 HydrophobicContact CD2-CE2 4.48Å; F836-F888 AromaticContact CD2-CZ 3.74Å; F836-F888 HydrophobicContact CD2-CZ 3.74Å; F836-F888 AromaticContact CE2-CE1 3.75Å; F836-F888 HydrophobicContact CE2-CE1 3.75Å; F836-F888 AromaticContact CE2-CE2 3.76Å; F836-F888 HydrophobicContact CE2-CE2 3.76Å; F836-F888 AromaticContact CE2-CZ 3.15Å; F836-F888 HydrophobicContact CE2-CZ 3.15Å; F836-F888 AromaticContact CZ-CE2 3.98Å; F836-F888 HydrophobicContact CZ-CE2 3.98Å; F836-F888 AromaticContact CZ-CZ 3.84Å; F836-F888 HydrophobicContact CZ-CZ 3.84Å
837	A	85.8	Confident	87.7	Confident	28 Å²	28	45.3 Å²	45.3	23%	0.231	24%	0.238	C	C	.	.	H	α-helix	trans	-64.1	-41.3	-175	0	0	0	0	0	113.8	F806 M833 G840	F806-A837 HydrophobicContact CD1-CB 4.37Å; F806-A837 HydrophobicContact CD2-CB 4.38Å; F806-A837 HydrophobicContact CE1-CB 3.58Å; F806-A837 HydrophobicContact CE2-CB 3.61Å; F806-A837 HydrophobicContact CZ-CB 3.16Å; M833-A837 WeakPolarHBondContact O-CB 3.27Å; M833-A837 PolarHBondContact O-N 2.96Å; A837-G840 PolarHBondContact O-N 3.03Å
838	P	86.2	Confident	87.8	Confident	8 Å²	8	46.1 Å²	46.1	5%	0.052	24%	0.24	C	C	.	.	H	α-helix	trans	-57.1	-48.7	172	-26.4	36.4	0	0	0	112.6	E799 F806 G834 G840 F841	E799-P838 VanDerWaalsContact OE1-O 3.08Å; F806-P838 HydrophobicContact CB-CG 4.23Å; F806-P838 HydrophobicContact CD2-CG 4.12Å; F806-P838 HydrophobicContact CG-CG 4.17Å; G834-P838 WeakPolarHBondContact O-CD 3.49Å; P838-G840 PolarHBondContact O-N 3.34Å; P838-F841 PolarHBondContact O-N 3.44Å
839	F	90.7	Very high	87.9	Confident	6 Å²	6	45.4 Å²	45.4	3%	0.026	24%	0.235	C	C	.	.	H	α-helix	trans	-61.8	-11.1	174.7	-65.2	-71.6	0	0	0	114.6	P747 F751 F835 F836 F841 D842 L843 W880 F901	P747-F839 HydrophobicContact CB-CE1 4.21Å; P747-F839 HydrophobicContact CB-CZ 3.95Å; F751-F839 HydrophobicContact CD2-CD1 4.37Å; F751-F839 AromaticContact CD2-CE1 3.83Å; F751-F839 HydrophobicContact CD2-CE1 3.83Å; F751-F839 HydrophobicContact CE2-CE1 4.16Å; F835-F839 HydrophobicContact CE1-CE2 4.17Å; F835-F839 HydrophobicContact CE2-CE2 4.2Å; F835-F839 AromaticContact CZ-CE2 3.92Å; F835-F839 HydrophobicContact CZ-CE2 3.92Å; F835-F839 VanDerWaalsContact O-CD2 3.28Å; F835-F839 WeakPolarHBondContact O-CD2 3.36Å; F836-F839 PolarHBondContact O-N 3.02Å; F839-F841 VanDerWaalsContact C-N 3.28Å; F839-F841 PolarHBondContact O-N 3.47Å; F839-D842 WeakPolarHBondContact O-CB 3.42Å; F839-D842 PolarHBondContact O-N 2.84Å; F839-L843 WeakPolarHBondContact O-CG 2.84Å; F839-L843 PolarHBondContact O-N 3.48Å; F839-W880 AromaticContact CD1-CH2 3.63Å; F839-W880 HydrophobicContact CD1-CH2 3.63Å; F839-W880 HydrophobicContact CD1-CZ3 4.17Å; F839-W880 AromaticContact CE1-CH2 3.91Å; F839-W880 HydrophobicContact CE1-CH2 3.91Å; F839-W880 HydrophobicContact CG-CH2 4.32Å; F839-W880 HydrophobicContact CG-CZ3 4.41Å; F839-F901 HydrophobicContact CE1-CE1 4.4Å; F839-F901 HydrophobicContact CE1-CZ 4.42Å; F839-F901 HydrophobicContact CZ-CE1 4.18Å; F839-F901 AromaticContact CZ-CZ 3.79Å; F839-F901 HydrophobicContact CZ-CZ 3.79Å
840	G	90.9	Very high	88.1	Confident	36 Å²	36	41.6 Å²	41.6	37%	0.371	22%	0.223	S	C	.	.	H	α-helix	trans	-59.5	-37.8	177.1	0	0	0	0	0	112.8	F836 A837 P838 L843 F844	F836-G840 PolarHBondContact O-N 3.08Å; A837-G840 PolarHBondContact O-N 3.03Å; P838-G840 PolarHBondContact O-N 3.34Å; G840-L843 PolarHBondContact O-N 3.11Å; G840-F844 PolarHBondContact O-N 3.21Å; G840-F844 VanDerWaalsContact O-N 3.09Å
841	F	92.6	Very high	88.4	Confident	33 Å²	33	44.1 Å²	44.1	15%	0.145	24%	0.238	C	C	.	.	H	α-helix	trans	-74.5	-34.8	176.7	179.4	-103.9	0	0	0	112	L795 V798 E799 I802 P838 F839 L843 F844 L845	L795-F841 HydrophobicContact CD2-CZ 4.03Å; L795-F841 WeakPolarHBondContact O-CE1 3.24Å; V798-F841 HydrophobicContact CB-CE1 4.25Å; V798-F841 HydrophobicContact CB-CZ 4.02Å; V798-F841 HydrophobicContact CG1-CD1 4.48Å; V798-F841 HydrophobicContact CG1-CD2 4.13Å; V798-F841 HydrophobicContact CG1-CE1 4.16Å; V798-F841 HydrophobicContact CG1-CE2 3.8Å; V798-F841 HydrophobicContact CG1-CG 4.45Å; V798-F841 HydrophobicContact CG1-CZ 3.8Å; E799-F841 HydrophobicContact CB-CD1 4.22Å; E799-F841 VanDerWaalsContact OE2-CB 3.31Å; E799-F841 WeakPolarHBondContact OE2-CB 3.18Å; E799-F841 VanDerWaalsContact OE2-CD1 3.24Å; E799-F841 WeakPolarHBondContact OE2-CD1 3.36Å; I802-F841 HydrophobicContact CD1-CB 3.82Å; I802-F841 HydrophobicContact CD1-CG 4.19Å; P838-F841 PolarHBondContact O-N 3.44Å; F839-F841 VanDerWaalsContact C-N 3.28Å; F839-F841 PolarHBondContact O-N 3.47Å; F841-L843 PolarHBondContact O-N 3.01Å; F841-F844 HydrophobicContact CD2-CD1 4.22Å; F841-F844 HydrophobicContact CE2-CD1 4.17Å; F841-F844 WeakPolarHBondContact O-CB 3.36Å; F841-F844 PolarHBondContact O-N 3.24Å; F841-L845 HydrophobicContact CD1-CD1 4.01Å; F841-L845 HydrophobicContact CD1-CG 4.25Å; F841-L845 HydrophobicContact CE1-CD1 3.65Å; F841-L845 HydrophobicContact CE1-CD2 4.26Å; F841-L845 HydrophobicContact CE1-CG 3.95Å; F841-L845 HydrophobicContact CZ-CD1 4.31Å; F841-L845 HydrophobicContact CZ-CD2 4.09Å; F841-L845 HydrophobicContact CZ-CG 4.2Å; F841-L845 WeakPolarHBondContact O-CG 3.4Å; F841-L845 PolarHBondContact O-N 3.39Å
842	D	92.3	Very high	88.7	Confident	1 Å²	1	45.1 Å²	45.1	1%	0.005	23%	0.234	C	C	.	.	H	α-helix	trans	-59.8	-44.6	170	-74.4	-41	0	0	0	112.2	F751 A752 Y755 F839 F844 L845 V846	F751-D842 HydrophobicContact CB-CB 4.45Å; F751-D842 WeakPolarHBondContact CB-OD2 3.37Å; A752-D842 VanDerWaalsContact CA-OD1 3.28Å; A752-D842 WeakPolarHBondContact CA-OD1 3.29Å; A752-D842 PolarHBondContact N-OD1 3Å; Y755-D842 HydrophobicContact CD2-CB 4.33Å; F839-D842 WeakPolarHBondContact O-CB 3.42Å; F839-D842 PolarHBondContact O-N 2.84Å; D842-F844 VanDerWaalsContact C-N 3.27Å; D842-F844 PolarHBondContact O-N 2.98Å; D842-L845 WeakPolarHBondContact O-CB 3.36Å; D842-L845 PolarHBondContact O-N 3.06Å; D842-L845 VanDerWaalsContact O-N 3.13Å; D842-V846 WeakPolarHBondContact O-CG2 3.25Å; D842-V846 PolarHBondContact O-N 3.17Å
843	L	90.8	Very high	88.9	Confident	62 Å²	62	37.3 Å²	37.3	33%	0.325	20%	0.201	S	C	.	.	H	α-helix	trans	-62.1	-36.2	175.1	-72	175.2	0	0	0	112.1	F839 G840 F841 S847 W880	F839-L843 WeakPolarHBondContact O-CG 2.84Å; F839-L843 PolarHBondContact O-N 3.48Å; G840-L843 PolarHBondContact O-N 3.11Å; F841-L843 PolarHBondContact O-N 3.01Å; L843-S847 WeakPolarHBondContact O-CB 3.35Å; L843-S847 PolarHBondContact O-N 3.14Å; L843-S847 PolarHBondContact O-OG 3.42Å; L843-W880 HydrophobicContact CD2-CB 4.38Å; L843-W880 HydrophobicContact CD2-CD2 4.41Å; L843-W880 HydrophobicContact CD2-CE3 4.44Å; L843-W880 HydrophobicContact CD2-CG 4.39Å
844	F	92.8	Very high	89.2	Confident	107 Å²	107	34.3 Å²	34.3	47%	0.469	19%	0.187	S	C	.	.	H	α-helix	trans	-64	-45.4	171.8	172	-97.5	0	0	0	111.6	G840 F841 D842 V846 S847 M848	G840-F844 PolarHBondContact O-N 3.21Å; G840-F844 VanDerWaalsContact O-N 3.09Å; F841-F844 HydrophobicContact CD2-CD1 4.22Å; F841-F844 HydrophobicContact CE2-CD1 4.17Å; F841-F844 WeakPolarHBondContact O-CB 3.36Å; F841-F844 PolarHBondContact O-N 3.24Å; D842-F844 VanDerWaalsContact C-N 3.27Å; D842-F844 PolarHBondContact O-N 2.98Å; F844-V846 PolarHBondContact O-N 2.92Å; F844-S847 PolarHBondContact O-N 3.27Å; F844-M848 HydrophobicContact CD1-CG 4.43Å; F844-M848 HydrophobicContact CD2-CE 4.37Å; F844-M848 HydrophobicContact CD2-CG 4.37Å; F844-M848 HydrophobicContact CE1-CG 4Å; F844-M848 HydrophobicContact CE2-CE 3.78Å; F844-M848 HydrophobicContact CE2-CG 3.95Å; F844-M848 HydrophobicContact CE2-SD 4.4Å; F844-M848 HydrophobicContact CZ-CE 4.31Å; F844-M848 HydrophobicContact CZ-CG 3.75Å; F844-M848 HydrophobicContact CZ-SD 4.35Å; F844-M848 WeakPolarHBondContact O-CB 3.3Å; F844-M848 WeakPolarHBondContact O-CG 3.27Å; F844-M848 PolarHBondContact O-N 3.29Å
845	L	93.9	Very high	89.5	Confident	2 Å²	2	41.8 Å²	41.8	1%	0.01	22%	0.218	C	C	.	.	H	α-helix	trans	-61.1	-44	175.5	-70.4	179.1	0	0	0	111.7	L795 F841 D842 M848 C849	L795-L845 HydrophobicContact CD1-CD2 4.26Å; L795-L845 HydrophobicContact CD2-CD2 4.24Å; F841-L845 HydrophobicContact CD1-CD1 4.01Å; F841-L845 HydrophobicContact CD1-CG 4.25Å; F841-L845 HydrophobicContact CE1-CD1 3.65Å; F841-L845 HydrophobicContact CE1-CD2 4.26Å; F841-L845 HydrophobicContact CE1-CG 3.95Å; F841-L845 HydrophobicContact CZ-CD1 4.31Å; F841-L845 HydrophobicContact CZ-CD2 4.09Å; F841-L845 HydrophobicContact CZ-CG 4.2Å; F841-L845 WeakPolarHBondContact O-CG 3.4Å; F841-L845 PolarHBondContact O-N 3.39Å; D842-L845 WeakPolarHBondContact O-CB 3.36Å; D842-L845 PolarHBondContact O-N 3.06Å; D842-L845 VanDerWaalsContact O-N 3.13Å; L845-M848 PolarHBondContact O-N 2.79Å; L845-C849 WeakPolarHBondContact O-CB 3.32Å; L845-C849 PolarHBondContact O-N 3.37Å; L845-C849 PolarHBondContact O-SG 3.06Å
846	V	92.5	Very high	89.2	Confident	4 Å²	4	41.6 Å²	41.6	2%	0.024	22%	0.218	C	C	.	.	H	α-helix	trans	-60.6	-45.5	175.9	168.6	0	0	0	0	111	Y755 D842 F844 C849 T850 M873 T876	Y755-V846 HydrophobicContact CD1-CG2 3.69Å; Y755-V846 HydrophobicContact CD2-CG2 3.59Å; Y755-V846 HydrophobicContact CE1-CG2 3.69Å; Y755-V846 HydrophobicContact CE2-CG2 3.57Å; Y755-V846 HydrophobicContact CG-CG2 3.66Å; D842-V846 WeakPolarHBondContact O-CG2 3.25Å; D842-V846 PolarHBondContact O-N 3.17Å; F844-V846 PolarHBondContact O-N 2.92Å; V846-C849 PolarHBondContact O-N 3.06Å; V846-T850 WeakPolarHBondContact O-CB 3.41Å; V846-T850 PolarHBondContact O-N 3.4Å; V846-T850 PolarHBondContact O-OG1 2.98Å; V846-M873 HydrophobicContact CB-CE 4.12Å; V846-M873 HydrophobicContact CG1-CE 3.78Å; V846-M873 HydrophobicContact CG2-CE 4.24Å; V846-M873 WeakPolarHBondContact O-CE 3.46Å; V846-T876 HydrophobicContact CG1-CG2 4.37Å; V846-T876 HydrophobicContact CG2-CG2 4.34Å
847	S	90.7	Very high	88.9	Confident	62 Å²	62	48.2 Å²	48.2	43%	0.434	24%	0.242	S	C	.	.	H	α-helix	trans	-61.4	-47.5	177.8	-61.9	0	0	0	0	111.2	L843 F844 T850 L851	L843-S847 WeakPolarHBondContact O-CB 3.35Å; L843-S847 PolarHBondContact O-N 3.14Å; L843-S847 PolarHBondContact O-OG 3.42Å; F844-S847 PolarHBondContact O-N 3.27Å; S847-T850 PolarHBondContact O-N 3.17Å; S847-L851 WeakPolarHBondContact O-CG 3.49Å; S847-L851 PolarHBondContact O-N 3.12Å
848	M	91.5	Very high	88.5	Confident	55 Å²	55	53.6 Å²	53.6	27%	0.271	27%	0.267	S	S	.	.	H	α-helix	trans	-62.8	-45.6	177.1	-72.3	-62.4	129.7	0	0	112	F759 F844 L845 T850 L851 Y852	F759-M848 HydrophobicContact CD2-CB 3.98Å; F759-M848 HydrophobicContact CE2-CB 3.78Å; F844-M848 HydrophobicContact CD1-CG 4.43Å; F844-M848 HydrophobicContact CD2-CE 4.37Å; F844-M848 HydrophobicContact CD2-CG 4.37Å; F844-M848 HydrophobicContact CE1-CG 4Å; F844-M848 HydrophobicContact CE2-CE 3.78Å; F844-M848 HydrophobicContact CE2-CG 3.95Å; F844-M848 HydrophobicContact CE2-SD 4.4Å; F844-M848 HydrophobicContact CZ-CE 4.31Å; F844-M848 HydrophobicContact CZ-CG 3.75Å; F844-M848 HydrophobicContact CZ-SD 4.35Å; F844-M848 WeakPolarHBondContact O-CB 3.3Å; F844-M848 WeakPolarHBondContact O-CG 3.27Å; F844-M848 PolarHBondContact O-N 3.29Å; L845-M848 PolarHBondContact O-N 2.79Å; M848-T850 VanDerWaalsContact C-N 3.28Å; M848-T850 PolarHBondContact O-N 3.09Å; M848-L851 HydrophobicContact CE-CD1 3.86Å; M848-L851 PolarHBondContact O-N 3.08Å; M848-L851 HydrophobicContact SD-CD1 4.26Å; M848-Y852 VanDerWaalsContact O-CD2 3.22Å; M848-Y852 WeakPolarHBondContact O-CD2 3.34Å; M848-Y852 PolarHBondContact O-N 3.45Å
849	C	91.5	Very high	87.7	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-56.2	-43.2	174.2	-73.4	0	0	0	0	111.9	F759 L845 V846 Y852 A853 M873	F759-C849 WeakPolarHBondContact CA-SG 3.4Å; F759-C849 WeakPolarHBondContact CB-SG 3.46Å; F759-C849 PolarHBondContact N-SG 3.38Å; L845-C849 WeakPolarHBondContact O-CB 3.32Å; L845-C849 PolarHBondContact O-N 3.37Å; L845-C849 PolarHBondContact O-SG 3.06Å; V846-C849 PolarHBondContact O-N 3.06Å; C849-Y852 PolarHBondContact O-N 3.28Å; C849-A853 VanDerWaalsContact O-CB 3.3Å; C849-A853 WeakPolarHBondContact O-CB 3.47Å; C849-A853 PolarHBondContact O-N 3.45Å; C849-M873 HydrophobicContact CB-CE 3.4Å; C849-M873 HydrophobicContact CB-CG 4.07Å; C849-M873 HydrophobicContact CB-SD 3.64Å
850	T	90.7	Very high	86.6	Confident	19 Å²	19	57.8 Å²	57.8	12%	0.117	29%	0.293	C	S	.	.	H	α-helix	trans	-65.6	-44.6	179.3	-56.4	0	0	0	0	111.3	V846 S847 M848 Y852 A853 I854 Y874	V846-T850 WeakPolarHBondContact O-CB 3.41Å; V846-T850 PolarHBondContact O-N 3.4Å; V846-T850 PolarHBondContact O-OG1 2.98Å; S847-T850 PolarHBondContact O-N 3.17Å; M848-T850 VanDerWaalsContact C-N 3.28Å; M848-T850 PolarHBondContact O-N 3.09Å; T850-Y852 VanDerWaalsContact C-N 3.33Å; T850-Y852 PolarHBondContact O-N 2.86Å; T850-A853 WeakPolarHBondContact O-CB 3.44Å; T850-A853 PolarHBondContact O-N 3.33Å; T850-I854 HydrophobicContact CG2-CD1 4.2Å; T850-I854 VanDerWaalsContact O-CG1 3.3Å; T850-I854 WeakPolarHBondContact O-CG1 3.45Å; T850-I854 PolarHBondContact O-N 3.4Å; T850-Y874 HydrophobicContact CG2-CD1 4.08Å; T850-Y874 HydrophobicContact CG2-CE1 3.96Å
851	L	90.5	Very high	85.1	Confident	102 Å²	102	64.3 Å²	64.3	53%	0.534	31%	0.314	S	S	.	.	H	α-helix	trans	-59.8	-43.2	175.1	-69.9	174	0	0	0	111.9	S847 M848 K855	S847-L851 WeakPolarHBondContact O-CG 3.49Å; S847-L851 PolarHBondContact O-N 3.12Å; M848-L851 HydrophobicContact CE-CD1 3.86Å; M848-L851 PolarHBondContact O-N 3.08Å; M848-L851 HydrophobicContact SD-CD1 4.26Å; L851-K855 PolarHBondContact O-N 2.96Å
852	Y	87.5	Confident	83.5	Confident	71 Å²	71	66.9 Å²	66.9	28%	0.278	33%	0.329	S	S	.	.	H	α-helix	trans	-67.9	-38.6	175.1	-82.1	-71.6	0	0	0	112.2	F759 A766 M848 C849 T850 I854 K855 T856	F759-Y852 HydrophobicContact CD2-CD2 4.28Å; F759-Y852 AromaticContact CE2-CD2 3.67Å; F759-Y852 HydrophobicContact CE2-CD2 3.67Å; F759-Y852 AromaticContact CE2-CE2 3.57Å; F759-Y852 HydrophobicContact CE2-CE2 3.57Å; F759-Y852 HydrophobicContact CZ-CE2 4.13Å; A766-Y852 HydrophobicContact CB-CD1 3.62Å; A766-Y852 HydrophobicContact CB-CE1 3.97Å; M848-Y852 VanDerWaalsContact O-CD2 3.22Å; M848-Y852 WeakPolarHBondContact O-CD2 3.34Å; M848-Y852 PolarHBondContact O-N 3.45Å; C849-Y852 PolarHBondContact O-N 3.28Å; T850-Y852 VanDerWaalsContact C-N 3.33Å; T850-Y852 PolarHBondContact O-N 2.86Å; Y852-I854 PolarHBondContact O-N 2.96Å; Y852-K855 WeakPolarHBondContact O-CB 3.48Å; Y852-K855 PolarHBondContact O-N 3.32Å; Y852-T856 WeakPolarHBondContact O-CG2 3.4Å; Y852-T856 PolarHBondContact O-N 3.18Å; Y852-T856 PolarHBondContact O-OG1 2.97Å
853	A	85.8	Confident	82.2	Confident	3 Å²	3	71.6 Å²	71.6	3%	0.025	35%	0.35	C	S	.	.	H	α-helix	trans	-60.4	-44.2	175.7	0	0	0	0	0	111.7	C849 T850 K855 T856 R857	C849-A853 VanDerWaalsContact O-CB 3.3Å; C849-A853 WeakPolarHBondContact O-CB 3.47Å; C849-A853 PolarHBondContact O-N 3.45Å; T850-A853 WeakPolarHBondContact O-CB 3.44Å; T850-A853 PolarHBondContact O-N 3.33Å; A853-K855 VanDerWaalsContact C-N 3.34Å; A853-K855 PolarHBondContact O-N 3.43Å; A853-T856 VanDerWaalsContact CA-OG1 3.31Å; A853-T856 WeakPolarHBondContact CA-OG1 3.17Å; A853-T856 CarbonylContact O-C 3.5Å; A853-T856 PolarHBondContact O-N 3.03Å; A853-T856 VanDerWaalsContact O-N 3.12Å; A853-T856 PolarHBondContact O-OG1 3.31Å; A853-R857 PolarHBondContact O-N 3.44Å
854	I	86.9	Confident	81.3	Confident	71 Å²	71	72.6 Å²	72.6	36%	0.364	36%	0.355	S	S	.	.	H	α-helix	trans	-59.5	-45.6	173.7	-67.6	164.7	0	0	0	110.4	T850 Y852 T856 R857 Y874	T850-I854 HydrophobicContact CG2-CD1 4.2Å; T850-I854 VanDerWaalsContact O-CG1 3.3Å; T850-I854 WeakPolarHBondContact O-CG1 3.45Å; T850-I854 PolarHBondContact O-N 3.4Å; Y852-I854 PolarHBondContact O-N 2.96Å; I854-T856 PolarHBondContact O-N 3.22Å; I854-R857 WeakPolarHBondContact O-CB 3.41Å; I854-R857 WeakPolarHBondContact O-CD 3.29Å; I854-R857 WeakPolarHBondContact O-CG 3.41Å; I854-R857 PolarHBondContact O-N 3.28Å; I854-R857 VanDerWaalsContact O-N 3.08Å; I854-Y874 HydrophobicContact CG1-CE1 4.07Å; I854-Y874 WeakPolarHBondContact CG1-OH 3.47Å
855	K	85	Confident	80.6	Confident	161 Å²	161	70.1 Å²	70.1	70%	0.7	35%	0.345	S	S	*	.	H	α-helix	trans	-62.6	-27.6	178.2	-168.5	168.8	-175.4	166.3	0	112.8	L851 Y852 A853	L851-K855 PolarHBondContact O-N 2.96Å; Y852-K855 WeakPolarHBondContact O-CB 3.48Å; Y852-K855 PolarHBondContact O-N 3.32Å; A853-K855 VanDerWaalsContact C-N 3.34Å; A853-K855 PolarHBondContact O-N 3.43Å
856	T	78.9	Confident	80	Confident	6 Å²	6	70.5 Å²	70.5	4%	0.037	35%	0.348	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.9	2	176.9	57	0	0	0	0	113.9	I765 A766 L769 Y852 A853 I854 N858 L859	I765-T856 HydrophobicContact CB-CG2 4.44Å; I765-T856 HydrophobicContact CG2-CG2 3.79Å; A766-T856 HydrophobicContact CB-CG2 4.34Å; L769-T856 HydrophobicContact CD1-CG2 3.95Å; Y852-T856 WeakPolarHBondContact O-CG2 3.4Å; Y852-T856 PolarHBondContact O-N 3.18Å; Y852-T856 PolarHBondContact O-OG1 2.97Å; A853-T856 VanDerWaalsContact CA-OG1 3.31Å; A853-T856 WeakPolarHBondContact CA-OG1 3.17Å; A853-T856 CarbonylContact O-C 3.5Å; A853-T856 PolarHBondContact O-N 3.03Å; A853-T856 VanDerWaalsContact O-N 3.12Å; A853-T856 PolarHBondContact O-OG1 3.31Å; I854-T856 PolarHBondContact O-N 3.22Å; T856-N858 PolarHBondContact O-N 3.49Å; T856-L859 VanDerWaalsContact CB-CD1 3.43Å; T856-L859 HydrophobicContact CG2-CD1 4.09Å; T856-L859 WeakPolarHBondContact O-CD1 3.49Å; T856-L859 PolarHBondContact O-N 3.07Å
857	R	80.4	Confident	79.6	Confident	176 Å²	176	76.4 Å²	76.4	66%	0.664	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-26.3	-173.8	80.4	-170.4	-179	166.8	-2.2	114.4	A853 I854 L859	A853-R857 PolarHBondContact O-N 3.44Å; I854-R857 WeakPolarHBondContact O-CB 3.41Å; I854-R857 WeakPolarHBondContact O-CD 3.29Å; I854-R857 WeakPolarHBondContact O-CG 3.41Å; I854-R857 PolarHBondContact O-N 3.28Å; I854-R857 VanDerWaalsContact O-N 3.08Å; R857-L859 VanDerWaalsContact C-N 3.31Å; R857-L859 PolarHBondContact O-N 2.96Å
858	N	76.6	Confident	79.5	Confident	140 Å²	140	76.8 Å²	76.8	75%	0.749	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.7	25.7	-177.5	-63	-16.6	0	0	0	112.7	T856	T856-N858 PolarHBondContact O-N 3.49Å
859	L	70	Confident	79.4	Confident	27 Å²	27	74.3 Å²	74.3	14%	0.141	36%	0.356	C	S	.	.			trans	-67.1	145.9	171.7	-89.7	114.4	0	0	0	110.5	I765 L769 T856 R857 F863 A866	I765-L859 HydrophobicContact CG2-CD1 3.97Å; I765-L859 HydrophobicContact CG2-CD2 4.4Å; L769-L859 HydrophobicContact CD1-CD1 3.46Å; L769-L859 VanDerWaalsContact CD1-CD1 3.46Å; L769-L859 HydrophobicContact CD1-CD2 4.03Å; L769-L859 HydrophobicContact CD1-CG 3.71Å; L769-L859 HydrophobicContact CD2-CD2 3.82Å; L769-L859 HydrophobicContact CD2-CG 3.97Å; L769-L859 HydrophobicContact CG-CD2 4.27Å; L769-L859 HydrophobicContact CG-CG 4.38Å; T856-L859 VanDerWaalsContact CB-CD1 3.43Å; T856-L859 HydrophobicContact CG2-CD1 4.09Å; T856-L859 WeakPolarHBondContact O-CD1 3.49Å; T856-L859 PolarHBondContact O-N 3.07Å; R857-L859 VanDerWaalsContact C-N 3.31Å; R857-L859 PolarHBondContact O-N 2.96Å; L859-F863 HydrophobicContact CB-CB 4.09Å; L859-F863 HydrophobicContact CD2-CB 3.54Å; L859-F863 HydrophobicContact CD2-CD1 4Å; L859-F863 HydrophobicContact CD2-CD2 3.66Å; L859-F863 HydrophobicContact CD2-CE2 4.33Å; L859-F863 HydrophobicContact CD2-CG 3.46Å; L859-F863 VanDerWaalsContact CD2-CG 3.46Å; L859-F863 HydrophobicContact CG-CB 4.39Å; L859-A866 HydrophobicContact CD1-CB 3.77Å
860	P	66.4	Low	79.2	Confident	76 Å²	76	74.5 Å²	74.5	49%	0.494	36%	0.358	S	S	.	.			trans	-59	148.5	173.4	24.5	-32	0	0	0	110.8	N862 F863	P860-N862 PolarHBondContact O-N 2.99Å; P860-F863 HydrophobicContact CG-CD2 4.2Å; P860-F863 PolarHBondContact O-N 2.92Å
861	E	59.4	Low	79.2	Confident	172 Å²	172	78.2 Å²	78.2	80%	0.804	37%	0.373	S	S	*	.	G	3₁₀ helix	trans	-49.7	-23.3	-170.8	-72.6	-173.9	144.3	0	0	115.1	F863 N864	E861-F863 PolarHBondContact O-N 3.3Å; E861-F863 VanDerWaalsContact O-N 3.11Å; E861-N864 PolarHBondContact O-ND2 2.99Å; E861-N864 PolarHBondContact O-OD1 3.35Å
862	N	59.2	Low	79.3	Confident	87 Å²	87	73.4 Å²	73.4	47%	0.465	35%	0.348	S	S	.	.	G	3₁₀ helix	trans	-64.7	-11.5	176.8	-60.7	-25.3	0	0	0	114.2	P860	P860-N862 PolarHBondContact O-N 2.99Å
863	F	64.3	Low	79.4	Confident	101 Å²	101	70 Å²	70	44%	0.443	33%	0.334	S	S	.	.	G	3₁₀ helix	trans	-108.2	50.9	177.1	-72.3	-89	0	0	0	113.4	L859 P860 E861 E865 A866	L859-F863 HydrophobicContact CB-CB 4.09Å; L859-F863 HydrophobicContact CD2-CB 3.54Å; L859-F863 HydrophobicContact CD2-CD1 4Å; L859-F863 HydrophobicContact CD2-CD2 3.66Å; L859-F863 HydrophobicContact CD2-CE2 4.33Å; L859-F863 HydrophobicContact CD2-CG 3.46Å; L859-F863 VanDerWaalsContact CD2-CG 3.46Å; L859-F863 HydrophobicContact CG-CB 4.39Å; P860-F863 HydrophobicContact CG-CD2 4.2Å; P860-F863 PolarHBondContact O-N 2.92Å; E861-F863 PolarHBondContact O-N 3.3Å; E861-F863 VanDerWaalsContact O-N 3.11Å; F863-E865 PolarHBondContact O-N 3.25Å; F863-A866 PolarHBondContact O-N 3.5Å
864	N	71.8	Confident	79.7	Confident	82 Å²	82	73.9 Å²	73.9	44%	0.439	35%	0.349	S	S	.	.	H	α-helix	trans	-50.1	-25.9	177.4	-75.6	-42.2	0	0	0	114.5	E861 A866 K867 F868	E861-N864 PolarHBondContact O-ND2 2.99Å; E861-N864 PolarHBondContact O-OD1 3.35Å; N864-A866 VanDerWaalsContact C-N 3.32Å; N864-A866 PolarHBondContact O-N 3.4Å; N864-K867 WeakPolarHBondContact O-CB 3.41Å; N864-K867 PolarHBondContact O-N 3.01Å; N864-F868 HydrophobicContact CB-CE2 4.21Å; N864-F868 WeakPolarHBondContact O-CD2 3.5Å; N864-F868 PolarHBondContact O-N 2.88Å
865	E	78.9	Confident	80	Confident	56 Å²	56	73 Å²	73	26%	0.262	35%	0.347	S	S	.	.	H	α-helix	trans	-60.1	-36.7	176.1	-175.5	167.5	-150.1	0	0	113.4	T709 K761 F863 K867 F868 I869 K916	T709-E865 WeakPolarHBondContact CG2-OE1 3.47Å; K761-E865 WeakPolarHBondContact CE-OE1 3.28Å; K761-E865 IonicContact NZ-OE1 2.64Å; K761-E865 PolarHBondContact NZ-OE1 3.15Å; F863-E865 PolarHBondContact O-N 3.25Å; E865-K867 VanDerWaalsContact C-N 3.31Å; E865-K867 PolarHBondContact O-N 3.23Å; E865-F868 PolarHBondContact O-N 3.4Å; E865-I869 HydrophobicContact CG-CD1 4.08Å; E865-I869 WeakPolarHBondContact O-CG1 3.29Å; E865-I869 PolarHBondContact O-N 3.2Å; E865-I869 VanDerWaalsContact O-N 3.07Å; E865-K916 WeakPolarHBondContact OE1-CE 3.44Å; E865-K916 IonicContact OE1-NZ 2.76Å; E865-K916 PolarHBondContact OE1-NZ 2.97Å
866	A	81.3	Confident	80.3	Confident	9 Å²	9	65.3 Å²	65.3	7%	0.074	31%	0.314	C	S	.	.	H	α-helix	trans	-67	-34.8	178.8	0	0	0	0	0	111.9	L859 F863 N864 I869 G870	L859-A866 HydrophobicContact CD1-CB 3.77Å; F863-A866 PolarHBondContact O-N 3.5Å; N864-A866 VanDerWaalsContact C-N 3.32Å; N864-A866 PolarHBondContact O-N 3.4Å; A866-I869 PolarHBondContact O-N 3.41Å; A866-G870 PolarHBondContact O-N 3.34Å
867	K	84.4	Confident	80.9	Confident	128 Å²	128	66.8 Å²	66.8	56%	0.557	32%	0.324	S	S	*	.	H	α-helix	trans	-64.4	-46.4	175.9	-174.1	-177.9	-175.2	-178.2	0	111.2	N864 E865 G870 F871	N864-K867 WeakPolarHBondContact O-CB 3.41Å; N864-K867 PolarHBondContact O-N 3.01Å; E865-K867 VanDerWaalsContact C-N 3.31Å; E865-K867 PolarHBondContact O-N 3.23Å; K867-G870 PolarHBondContact O-N 3.48Å; K867-F871 HydrophobicContact CD-CE2 3.95Å; K867-F871 HydrophobicContact CD-CZ 4.44Å; K867-F871 VanDerWaalsContact CE-CE2 3.46Å; K867-F871 HydrophobicContact CG-CD2 4.02Å; K867-F871 HydrophobicContact CG-CE2 3.53Å; K867-F871 HydrophobicContact CG-CZ 4.09Å; K867-F871 WeakPolarHBondContact O-CD2 3.39Å; K867-F871 PolarHBondContact O-N 3.34Å
868	F	89	Confident	81.5	Confident	70 Å²	70	64 Å²	64	31%	0.307	32%	0.321	S	S	.	.	H	α-helix	trans	-63.2	-42.3	177.2	-70.4	-65.6	0	0	0	112.3	N864 E865 G870 F871 T872 P915	N864-F868 HydrophobicContact CB-CE2 4.21Å; N864-F868 WeakPolarHBondContact O-CD2 3.5Å; N864-F868 PolarHBondContact O-N 2.88Å; E865-F868 PolarHBondContact O-N 3.4Å; F868-G870 VanDerWaalsContact C-N 3.31Å; F868-G870 PolarHBondContact O-N 2.94Å; F868-F871 PolarHBondContact O-N 3.13Å; F868-T872 PolarHBondContact O-N 2.92Å; F868-T872 PolarHBondContact O-OG1 3.15Å; F868-P915 HydrophobicContact CD1-CG 3.84Å; F868-P915 HydrophobicContact CD2-CB 4.38Å; F868-P915 HydrophobicContact CD2-CG 4.28Å; F868-P915 HydrophobicContact CE1-CB 4.3Å; F868-P915 HydrophobicContact CE1-CG 3.62Å; F868-P915 HydrophobicContact CE2-CB 3.95Å; F868-P915 HydrophobicContact CE2-CG 4.09Å; F868-P915 HydrophobicContact CG-CG 4.18Å; F868-P915 HydrophobicContact CZ-CB 3.92Å; F868-P915 HydrophobicContact CZ-CG 3.76Å
869	I	88.2	Confident	82.2	Confident	3 Å²	3	58.1 Å²	58.1	2%	0.015	29%	0.29	C	S	.	.	H	α-helix	trans	-60.3	-43.7	174.1	-65.6	166.5	0	0	0	110.7	K761 T762 I765 E865 A866 T872 M873 L912	K761-I869 HydrophobicContact CD-CD1 4.18Å; K761-I869 HydrophobicContact CG-CD1 4.41Å; T762-I869 HydrophobicContact CG2-CG2 3.49Å; T762-I869 VanDerWaalsContact CG2-CG2 3.49Å; I765-I869 HydrophobicContact CD1-CD1 4.17Å; E865-I869 HydrophobicContact CG-CD1 4.08Å; E865-I869 WeakPolarHBondContact O-CG1 3.29Å; E865-I869 PolarHBondContact O-N 3.2Å; E865-I869 VanDerWaalsContact O-N 3.07Å; A866-I869 PolarHBondContact O-N 3.41Å; I869-T872 PolarHBondContact O-N 3.27Å; I869-M873 HydrophobicContact CG2-CG 4.36Å; I869-M873 WeakPolarHBondContact O-CG 3.33Å; I869-M873 PolarHBondContact O-N 3.43Å; I869-L912 HydrophobicContact CB-CD2 4.46Å; I869-L912 HydrophobicContact CG1-CD2 3.83Å
870	G	88.4	Confident	83.2	Confident	5 Å²	5	57.2 Å²	57.2	5%	0.052	28%	0.284	C	S	.	.	H	α-helix	trans	-57.8	-48.9	175.8	0	0	0	0	0	112.7	A866 K867 F868 T872 M873 Y874	A866-G870 PolarHBondContact O-N 3.34Å; K867-G870 PolarHBondContact O-N 3.48Å; F868-G870 VanDerWaalsContact C-N 3.31Å; F868-G870 PolarHBondContact O-N 2.94Å; G870-T872 VanDerWaalsContact C-N 3.34Å; G870-T872 PolarHBondContact O-N 3.17Å; G870-M873 PolarHBondContact O-N 2.77Å; G870-Y874 WeakPolarHBondContact O-CD2 3.07Å; G870-Y874 PolarHBondContact O-N 3.26Å
871	F	90.1	Very high	84.4	Confident	97 Å²	97	59.3 Å²	59.3	43%	0.425	29%	0.291	S	S	.	.	H	α-helix	trans	-60.7	-41.6	175.9	-69.8	-45.3	0	0	0	112.9	K867 F868 M873 Y874 T875 L911	K867-F871 HydrophobicContact CD-CE2 3.95Å; K867-F871 HydrophobicContact CD-CZ 4.44Å; K867-F871 VanDerWaalsContact CE-CE2 3.46Å; K867-F871 HydrophobicContact CG-CD2 4.02Å; K867-F871 HydrophobicContact CG-CE2 3.53Å; K867-F871 HydrophobicContact CG-CZ 4.09Å; K867-F871 WeakPolarHBondContact O-CD2 3.39Å; K867-F871 PolarHBondContact O-N 3.34Å; F868-F871 PolarHBondContact O-N 3.13Å; F871-M873 PolarHBondContact O-N 3.1Å; F871-Y874 HydrophobicContact CD1-CD2 4.43Å; F871-Y874 PolarHBondContact O-N 3.38Å; F871-T875 WeakPolarHBondContact O-CB 3.31Å; F871-T875 PolarHBondContact O-N 3.44Å; F871-T875 PolarHBondContact O-OG1 3.11Å; F871-L911 HydrophobicContact CB-CD1 4.34Å
872	T	92	Very high	85.9	Confident	1 Å²	1	53.2 Å²	53.2	1%	0.006	27%	0.27	C	S	.	.	H	α-helix	trans	-57.4	-50.1	174.3	-55.5	0	0	0	0	110.9	F868 I869 G870 Y874 T875 T876 A908 L911 L912	F868-T872 PolarHBondContact O-N 2.92Å; F868-T872 PolarHBondContact O-OG1 3.15Å; I869-T872 PolarHBondContact O-N 3.27Å; G870-T872 VanDerWaalsContact C-N 3.34Å; G870-T872 PolarHBondContact O-N 3.17Å; T872-Y874 PolarHBondContact O-N 3.33Å; T872-T875 PolarHBondContact O-N 3.22Å; T872-T876 WeakPolarHBondContact O-CB 3.49Å; T872-T876 PolarHBondContact O-N 2.91Å; T872-T876 PolarHBondContact O-OG1 3.42Å; T872-A908 HydrophobicContact CG2-CB 4.16Å; T872-L911 VanDerWaalsContact OG1-CB 3.25Å; T872-L911 WeakPolarHBondContact OG1-CB 3.35Å; T872-L912 HydrophobicContact CG2-CD1 4.11Å; T872-L912 HydrophobicContact CG2-CD2 4.39Å; T872-L912 HydrophobicContact CG2-CG 4.08Å; T872-L912 WeakPolarHBondContact OG1-CD2 3.3Å; T872-L912 WeakPolarHBondContact OG1-CG 3.36Å
873	M	91.3	Very high	87.4	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-62.8	-41.1	-179	-64.6	-47.3	-48.5	0	0	112.9	Y755 L758 V846 C849 I869 G870 F871 T876 C877	Y755-M873 HydrophobicContact CD1-CE 4.46Å; L758-M873 HydrophobicContact CD1-SD 4.12Å; V846-M873 HydrophobicContact CB-CE 4.12Å; V846-M873 HydrophobicContact CG1-CE 3.78Å; V846-M873 HydrophobicContact CG2-CE 4.24Å; V846-M873 WeakPolarHBondContact O-CE 3.46Å; C849-M873 HydrophobicContact CB-CE 3.4Å; C849-M873 HydrophobicContact CB-CG 4.07Å; C849-M873 HydrophobicContact CB-SD 3.64Å; I869-M873 HydrophobicContact CG2-CG 4.36Å; I869-M873 WeakPolarHBondContact O-CG 3.33Å; I869-M873 PolarHBondContact O-N 3.43Å; G870-M873 PolarHBondContact O-N 2.77Å; F871-M873 PolarHBondContact O-N 3.1Å; M873-T876 PolarHBondContact O-N 2.92Å; M873-C877 PolarHBondContact O-N 3.09Å; M873-C877 PolarHBondContact O-SG 3.48Å
874	Y	91.6	Very high	88.5	Confident	83 Å²	83	46.9 Å²	46.9	33%	0.325	24%	0.24	S	C	.	.	H	α-helix	trans	-64.9	-46.3	178.4	-58.8	-37.1	0	0	0	112.2	T850 I854 G870 F871 T872 T876 C877 I878	T850-Y874 HydrophobicContact CG2-CD1 4.08Å; T850-Y874 HydrophobicContact CG2-CE1 3.96Å; I854-Y874 HydrophobicContact CG1-CE1 4.07Å; I854-Y874 WeakPolarHBondContact CG1-OH 3.47Å; G870-Y874 WeakPolarHBondContact O-CD2 3.07Å; G870-Y874 PolarHBondContact O-N 3.26Å; F871-Y874 HydrophobicContact CD1-CD2 4.43Å; F871-Y874 PolarHBondContact O-N 3.38Å; T872-Y874 PolarHBondContact O-N 3.33Å; Y874-T876 VanDerWaalsContact C-N 3.33Å; Y874-T876 PolarHBondContact O-N 2.88Å; Y874-C877 PolarHBondContact O-N 2.92Å; Y874-I878 PolarHBondContact O-N 3.19Å
875	T	92.7	Very high	89.4	Confident	52 Å²	52	46.4 Å²	46.4	32%	0.319	25%	0.248	S	C	.	.	H	α-helix	trans	-64.7	-40.8	177.9	-54.5	0	0	0	0	111	F871 T872 C877 I878 V879 V907	F871-T875 WeakPolarHBondContact O-CB 3.31Å; F871-T875 PolarHBondContact O-N 3.44Å; F871-T875 PolarHBondContact O-OG1 3.11Å; T872-T875 PolarHBondContact O-N 3.22Å; T875-C877 VanDerWaalsContact C-N 3.34Å; T875-C877 PolarHBondContact O-N 3.47Å; T875-I878 PolarHBondContact O-N 2.98Å; T875-V879 WeakPolarHBondContact O-CG2 3.48Å; T875-V879 PolarHBondContact O-N 3.03Å; T875-V907 HydrophobicContact CG2-CB 4.37Å; T875-V907 HydrophobicContact CG2-CG1 3.54Å; T875-V907 HydrophobicContact CG2-CG2 3.82Å
876	T	91.2	Very high	90	Very high	1 Å²	1	48.1 Å²	48.1	1%	0.006	26%	0.258	C	S	.	.	H	α-helix	trans	-57.9	-44.8	174.2	-66.6	0	0	0	0	111.8	Y755 V846 T872 M873 Y874 I878 V879 W880	Y755-T876 HydrophobicContact CE1-CG2 3.79Å; Y755-T876 WeakPolarHBondContact OH-CG2 3.45Å; V846-T876 HydrophobicContact CG1-CG2 4.37Å; V846-T876 HydrophobicContact CG2-CG2 4.34Å; T872-T876 WeakPolarHBondContact O-CB 3.49Å; T872-T876 PolarHBondContact O-N 2.91Å; T872-T876 PolarHBondContact O-OG1 3.42Å; M873-T876 PolarHBondContact O-N 2.92Å; Y874-T876 VanDerWaalsContact C-N 3.33Å; Y874-T876 PolarHBondContact O-N 2.88Å; T876-I878 VanDerWaalsContact C-N 3.28Å; T876-I878 PolarHBondContact O-N 3.09Å; T876-V879 PolarHBondContact O-N 3.31Å; T876-W880 VanDerWaalsContact O-CD1 3.25Å; T876-W880 PolarHBondContact O-N 3.41Å
877	C	91.5	Very high	90.4	Very high	37 Å²	37	48.6 Å²	48.6	25%	0.25	26%	0.258	C	S	.	.	H	α-helix	trans	-57.8	-41.8	177	-68	0	0	0	0	112	M873 Y874 T875 L881	M873-C877 PolarHBondContact O-N 3.09Å; M873-C877 PolarHBondContact O-SG 3.48Å; Y874-C877 PolarHBondContact O-N 2.92Å; T875-C877 VanDerWaalsContact C-N 3.34Å; T875-C877 PolarHBondContact O-N 3.47Å; C877-L881 VanDerWaalsContact O-CG 3.28Å; C877-L881 WeakPolarHBondContact O-CG 3.27Å; C877-L881 PolarHBondContact O-N 3.46Å
878	I	93.1	Very high	90.5	Very high	117 Å²	117	48.4 Å²	48.4	60%	0.6	26%	0.257	S	S	*	.	H	α-helix	trans	-65.6	-44.1	177.8	-64.3	170.2	0	0	0	110.9	Y874 T875 T876 W880 L881 A882	Y874-I878 PolarHBondContact O-N 3.19Å; T875-I878 PolarHBondContact O-N 2.98Å; T876-I878 VanDerWaalsContact C-N 3.28Å; T876-I878 PolarHBondContact O-N 3.09Å; I878-W880 PolarHBondContact O-N 3.18Å; I878-L881 PolarHBondContact O-N 3.34Å; I878-A882 WeakPolarHBondContact O-CB 3.48Å; I878-A882 PolarHBondContact O-N 2.87Å
879	V	92.1	Very high	90.3	Very high	17 Å²	17	48.4 Å²	48.4	10%	0.103	28%	0.276	C	S	.	.	H	α-helix	trans	-60.2	-46.1	178.5	172.1	0	0	0	0	111.2	T875 T876 A882 F883 L903	T875-V879 WeakPolarHBondContact O-CG2 3.48Å; T875-V879 PolarHBondContact O-N 3.03Å; T876-V879 PolarHBondContact O-N 3.31Å; V879-A882 PolarHBondContact O-N 3.29Å; V879-F883 WeakPolarHBondContact O-CB 3.35Å; V879-F883 PolarHBondContact O-N 3Å; V879-L903 HydrophobicContact CG1-CD2 4.27Å; V879-L903 HydrophobicContact CG2-CD2 4.1Å; V879-L903 HydrophobicContact CG2-CG 4.35Å
880	W	90.1	Very high	90.1	Very high	7 Å²	7	49.9 Å²	49.9	3%	0.027	29%	0.287	C	S	.	.	H	α-helix	trans	-66.9	-37.5	178.7	-81	98	0	0	0	113.3	F751 Y755 F839 L843 T876 I878 F883 L884 F901	F751-W880 AromaticContact CD1-CZ2 3.97Å; F751-W880 HydrophobicContact CD1-CZ2 3.97Å; F751-W880 HydrophobicContact CD2-CH2 4.1Å; F751-W880 AromaticContact CD2-CZ2 3.91Å; F751-W880 HydrophobicContact CD2-CZ2 3.91Å; F751-W880 AromaticContact CE1-CZ2 3.8Å; F751-W880 HydrophobicContact CE1-CZ2 3.8Å; F751-W880 AromaticContact CE2-CH2 3.89Å; F751-W880 HydrophobicContact CE2-CH2 3.89Å; F751-W880 AromaticContact CE2-CZ2 3.73Å; F751-W880 HydrophobicContact CE2-CZ2 3.73Å; F751-W880 HydrophobicContact CG-CZ2 4.02Å; F751-W880 HydrophobicContact CZ-CH2 4.23Å; F751-W880 AromaticContact CZ-CZ2 3.67Å; F751-W880 HydrophobicContact CZ-CZ2 3.67Å; Y755-W880 AromaticContact CZ-NE1 4Å; Y755-W880 PolarHBondContact OH-NE1 3.14Å; Y755-W880 VanDerWaalsContact OH-NE1 3.14Å; F839-W880 AromaticContact CD1-CH2 3.63Å; F839-W880 HydrophobicContact CD1-CH2 3.63Å; F839-W880 HydrophobicContact CD1-CZ3 4.17Å; F839-W880 AromaticContact CE1-CH2 3.91Å; F839-W880 HydrophobicContact CE1-CH2 3.91Å; F839-W880 HydrophobicContact CG-CH2 4.32Å; F839-W880 HydrophobicContact CG-CZ3 4.41Å; L843-W880 HydrophobicContact CD2-CB 4.38Å; L843-W880 HydrophobicContact CD2-CD2 4.41Å; L843-W880 HydrophobicContact CD2-CE3 4.44Å; L843-W880 HydrophobicContact CD2-CG 4.39Å; T876-W880 VanDerWaalsContact O-CD1 3.25Å; T876-W880 PolarHBondContact O-N 3.41Å; I878-W880 PolarHBondContact O-N 3.18Å; W880-F883 HydrophobicContact CE3-CD1 4Å; W880-F883 HydrophobicContact CZ3-CD1 4.1Å; W880-F883 HydrophobicContact CZ3-CE1 4.2Å; W880-F883 PolarHBondContact O-N 3.44Å; W880-L884 WeakPolarHBondContact O-CG 3.46Å; W880-L884 PolarHBondContact O-N 3.38Å; W880-L884 VanDerWaalsContact O-N 3.11Å; W880-F901 HydrophobicContact CH2-CE1 4.35Å
881	L	90.8	Very high	89.8	Confident	121 Å²	121	56 Å²	56	63%	0.634	32%	0.319	S	S	*	.	H	α-helix	trans	-64.9	-42.5	174.1	-72.7	173	0	0	0	111.8	C877 I878 L884 A885	C877-L881 VanDerWaalsContact O-CG 3.28Å; C877-L881 WeakPolarHBondContact O-CG 3.27Å; C877-L881 PolarHBondContact O-N 3.46Å; I878-L881 PolarHBondContact O-N 3.34Å; L881-L884 PolarHBondContact O-N 2.97Å; L881-A885 PolarHBondContact O-N 3.08Å
882	A	91.5	Very high	89.5	Confident	44 Å²	44	56.7 Å²	56.7	36%	0.364	32%	0.321	S	S	.	.	H	α-helix	trans	-64.3	-41.7	176.2	0	0	0	0	0	111.7	I878 V879 L884 A885 I886	I878-A882 WeakPolarHBondContact O-CB 3.48Å; I878-A882 PolarHBondContact O-N 2.87Å; V879-A882 PolarHBondContact O-N 3.29Å; A882-L884 PolarHBondContact O-N 3.03Å; A882-A885 PolarHBondContact O-N 3.35Å; A882-I886 VanDerWaalsContact O-CG1 3.27Å; A882-I886 WeakPolarHBondContact O-CG1 3.38Å; A882-I886 PolarHBondContact O-N 3.45Å
883	F	90.7	Very high	89.3	Confident	4 Å²	4	61 Å²	61	2%	0.018	34%	0.34	C	S	.	.	H	α-helix	trans	-57.9	-49.4	176.3	169.8	-113.7	0	0	0	112.6	F835 F836 V879 W880 A885 I886 Y887 T896 M897 C900 F901	F835-F883 HydrophobicContact CE1-CE1 4.41Å; F835-F883 HydrophobicContact CE1-CZ 4.08Å; F835-F883 HydrophobicContact CZ-CZ 4.36Å; F836-F883 AromaticContact CE1-CE1 3.88Å; F836-F883 HydrophobicContact CE1-CE1 3.88Å; F836-F883 HydrophobicContact CZ-CE1 4.44Å; V879-F883 WeakPolarHBondContact O-CB 3.35Å; V879-F883 PolarHBondContact O-N 3Å; W880-F883 HydrophobicContact CE3-CD1 4Å; W880-F883 HydrophobicContact CZ3-CD1 4.1Å; W880-F883 HydrophobicContact CZ3-CE1 4.2Å; W880-F883 PolarHBondContact O-N 3.44Å; F883-A885 VanDerWaalsContact C-N 3.26Å; F883-A885 PolarHBondContact O-N 3.29Å; F883-I886 PolarHBondContact O-N 3.19Å; F883-Y887 HydrophobicContact CE2-CD2 4.06Å; F883-Y887 HydrophobicContact CE2-CG 4.41Å; F883-Y887 HydrophobicContact CZ-CD2 4.08Å; F883-Y887 HydrophobicContact CZ-CG 4.32Å; F883-Y887 WeakPolarHBondContact O-CB 3.47Å; F883-Y887 PolarHBondContact O-N 2.98Å; F883-T896 HydrophobicContact CD2-CG2 4.02Å; F883-T896 HydrophobicContact CE2-CG2 4.18Å; F883-M897 HydrophobicContact CE2-CG 4.23Å; F883-M897 HydrophobicContact CZ-CG 4.37Å; F883-C900 HydrophobicContact CB-CB 4.11Å; F883-C900 WeakPolarHBondContact CB-SG 3.43Å; F883-C900 HydrophobicContact CD2-CB 3.45Å; F883-C900 VanDerWaalsContact CD2-CB 3.45Å; F883-C900 HydrophobicContact CE2-CB 4.12Å; F883-C900 HydrophobicContact CG-CB 3.95Å; F883-C900 WeakPolarHBondContact CG-SG 3.43Å; F883-F901 HydrophobicContact CZ-CE1 4.49Å
884	L	88.2	Confident	89.1	Confident	50 Å²	50	63.4 Å²	63.4	26%	0.262	35%	0.353	S	S	.	.	H	α-helix	trans	-56.6	-43.3	178.2	-71.8	169.7	0	0	0	111.3	F836 W880 L881 A882 F888	F836-L884 HydrophobicContact CD1-CD2 3.77Å; F836-L884 HydrophobicContact CE1-CD2 3.25Å; F836-L884 HydrophobicContact CZ-CD2 3.8Å; W880-L884 WeakPolarHBondContact O-CG 3.46Å; W880-L884 PolarHBondContact O-N 3.38Å; W880-L884 VanDerWaalsContact O-N 3.11Å; L881-L884 PolarHBondContact O-N 2.97Å; A882-L884 PolarHBondContact O-N 3.03Å; L884-F888 HydrophobicContact CD2-CE2 4.42Å; L884-F888 WeakPolarHBondContact O-CD2 3.47Å; L884-F888 PolarHBondContact O-N 3.25Å
885	A	90.2	Very high	89.1	Confident	72 Å²	72	60.3 Å²	60.3	60%	0.595	34%	0.343	S	S	*	.	H	α-helix	trans	-65.9	-45.5	178.4	0	0	0	0	0	112.9	L881 A882 F883 G889	L881-A885 PolarHBondContact O-N 3.08Å; A882-A885 PolarHBondContact O-N 3.35Å; F883-A885 VanDerWaalsContact C-N 3.26Å; F883-A885 PolarHBondContact O-N 3.29Å; A885-G889 PolarHBondContact O-N 3.48Å
886	I	92	Very high	89	Confident	92 Å²	92	58.6 Å²	58.6	47%	0.472	33%	0.333	S	S	.	.	H	α-helix	trans	-70.7	-39.9	-178.2	-61.4	165.3	0	0	0	110.6	A882 F883 F888 G889 S890 T896	A882-I886 VanDerWaalsContact O-CG1 3.27Å; A882-I886 WeakPolarHBondContact O-CG1 3.38Å; A882-I886 PolarHBondContact O-N 3.45Å; F883-I886 PolarHBondContact O-N 3.19Å; I886-F888 PolarHBondContact O-N 3.46Å; I886-G889 PolarHBondContact O-N 2.8Å; I886-S890 WeakPolarHBondContact O-CB 3.38Å; I886-S890 PolarHBondContact O-N 3.09Å; I886-T896 HydrophobicContact CB-CG2 3.93Å; I886-T896 HydrophobicContact CG2-CG2 3.49Å; I886-T896 VanDerWaalsContact CG2-CG2 3.49Å
887	Y	88.8	Confident	89	Confident	20 Å²	20	58.7 Å²	58.7	8%	0.078	33%	0.333	C	S	.	.	H	α-helix	trans	-60.8	-44.9	-177.9	-178.5	-94.7	0	0	0	112.6	F835 F836 F883 G889 K893 M897	F835-Y887 HydrophobicContact CD1-CE1 4.49Å; F835-Y887 HydrophobicContact CE1-CE2 4.36Å; F836-Y887 AromaticContact CE2-CD1 3.72Å; F836-Y887 HydrophobicContact CE2-CD1 3.72Å; F836-Y887 AromaticContact CE2-CE1 3.65Å; F836-Y887 HydrophobicContact CE2-CE1 3.65Å; F836-Y887 AromaticContact CZ-CD1 3.46Å; F836-Y887 HydrophobicContact CZ-CD1 3.46Å; F836-Y887 VanDerWaalsContact CZ-CD1 3.46Å; F836-Y887 AromaticContact CZ-CE1 3.77Å; F836-Y887 HydrophobicContact CZ-CE1 3.77Å; F836-Y887 HydrophobicContact CZ-CG 4.08Å; F883-Y887 HydrophobicContact CE2-CD2 4.06Å; F883-Y887 HydrophobicContact CE2-CG 4.41Å; F883-Y887 HydrophobicContact CZ-CD2 4.08Å; F883-Y887 HydrophobicContact CZ-CG 4.32Å; F883-Y887 WeakPolarHBondContact O-CB 3.47Å; F883-Y887 PolarHBondContact O-N 2.98Å; Y887-G889 VanDerWaalsContact C-N 3.35Å; Y887-K893 HydrophobicContact CD2-CB 4.33Å; Y887-K893 HydrophobicContact CD2-CG 4.4Å; Y887-K893 HydrophobicContact CE2-CB 3.79Å; Y887-K893 HydrophobicContact CE2-CD 4.22Å; Y887-K893 HydrophobicContact CE2-CG 3.97Å; Y887-M897 HydrophobicContact CD2-CE 4.39Å; Y887-M897 HydrophobicContact CD2-CG 4.4Å; Y887-M897 HydrophobicContact CE2-CE 3.35Å; Y887-M897 HydrophobicContact CE2-CG 4.21Å
888	F	87.3	Confident	89.1	Confident	124 Å²	124	56.9 Å²	56.9	54%	0.544	32%	0.321	S	S	.	.	H	α-helix	trans	-77.9	-20	178.2	-70.5	-61.3	0	0	0	113.5	F836 L884 I886	F836-F888 HydrophobicContact CD2-CE1 4.48Å; F836-F888 HydrophobicContact CD2-CE2 4.48Å; F836-F888 AromaticContact CD2-CZ 3.74Å; F836-F888 HydrophobicContact CD2-CZ 3.74Å; F836-F888 AromaticContact CE2-CE1 3.75Å; F836-F888 HydrophobicContact CE2-CE1 3.75Å; F836-F888 AromaticContact CE2-CE2 3.76Å; F836-F888 HydrophobicContact CE2-CE2 3.76Å; F836-F888 AromaticContact CE2-CZ 3.15Å; F836-F888 HydrophobicContact CE2-CZ 3.15Å; F836-F888 AromaticContact CZ-CE2 3.98Å; F836-F888 HydrophobicContact CZ-CE2 3.98Å; F836-F888 AromaticContact CZ-CZ 3.84Å; F836-F888 HydrophobicContact CZ-CZ 3.84Å; L884-F888 HydrophobicContact CD2-CE2 4.42Å; L884-F888 WeakPolarHBondContact O-CD2 3.47Å; L884-F888 PolarHBondContact O-N 3.25Å; I886-F888 PolarHBondContact O-N 3.46Å
889	G	83.9	Confident	89.1	Confident	69 Å²	69	55.5 Å²	55.5	71%	0.711	31%	0.314	S	S	*	.	H	α-helix	trans	-92.9	-18.4	179.4	0	0	0	0	0	115	A885 I886 Y887	A885-G889 PolarHBondContact O-N 3.48Å; I886-G889 PolarHBondContact O-N 2.8Å; Y887-G889 VanDerWaalsContact C-N 3.35Å
890	S	85.2	Confident	89.1	Confident	34 Å²	34	55.1 Å²	55.1	24%	0.238	31%	0.312	C	S	.	.			trans	-102.9	139.3	-173.2	-175.4	0	0	0	0	112.5	I886 K892	I886-S890 WeakPolarHBondContact O-CB 3.38Å; I886-S890 PolarHBondContact O-N 3.09Å; S890-K892 PolarHBondContact OG-N 3.29Å
891	N	80.4	Confident	89.3	Confident	134 Å²	134	54.9 Å²	54.9	72%	0.717	31%	0.311	S	S	*	.	S	Bend	trans	-76.1	-15.7	168.1	-67.1	-23.2	0	0	0	112.2	I820 K893	I820-N891 HydrophobicContact CD1-CB 4.44Å; N891-K893 PolarHBondContact O-N 3.12Å
892	K	84.7	Confident	89.5	Confident	111 Å²	111	49.2 Å²	49.2	48%	0.483	28%	0.281	S	S	.	.			trans	-100.2	70.7	179.7	-61.6	-161.8	176.5	-166.1	0	110.5	E675 S890 T896	E675-K892 IonicContact OE1-NZ 2.77Å; E675-K892 PolarHBondContact OE1-NZ 2.88Å; E675-K892 WeakPolarHBondContact OE2-CD 3.36Å; E675-K892 IonicContact OE2-NZ 2.68Å; E675-K892 PolarHBondContact OE2-NZ 3Å; S890-K892 PolarHBondContact OG-N 3.29Å; K892-T896 PolarHBondContact O-N 3.41Å; K892-T896 PolarHBondContact O-OG1 3.07Å
893	K	87.3	Confident	89.6	Confident	91 Å²	91	50.5 Å²	50.5	40%	0.396	28%	0.282	S	S	.	.	H	α-helix	trans	-65.3	-42	-175.1	-68	174.9	-173	161.5	0	111.7	Y887 N891 T896 M897	Y887-K893 HydrophobicContact CD2-CB 4.33Å; Y887-K893 HydrophobicContact CD2-CG 4.4Å; Y887-K893 HydrophobicContact CE2-CB 3.79Å; Y887-K893 HydrophobicContact CE2-CD 4.22Å; Y887-K893 HydrophobicContact CE2-CG 3.97Å; N891-K893 PolarHBondContact O-N 3.12Å; K893-T896 WeakPolarHBondContact O-CB 3.44Å; K893-T896 PolarHBondContact O-N 3.45Å; K893-M897 WeakPolarHBondContact O-CG 3.06Å; K893-M897 PolarHBondContact O-N 2.98Å
894	D	88.1	Confident	89.7	Confident	51 Å²	51	50.5 Å²	50.5	27%	0.273	28%	0.282	S	S	.	.	H	α-helix	trans	-63.8	-48.2	-177.3	-54.1	-36.5	0	0	0	112.1	I731 T896 M897 C898	I731-D894 HydrophobicContact CG2-CB 3.77Å; D894-T896 VanDerWaalsContact C-N 3.26Å; D894-T896 PolarHBondContact O-N 3.44Å; D894-M897 PolarHBondContact O-N 3.34Å; D894-C898 PolarHBondContact O-N 3.01Å
895	T	90.4	Very high	90	Very high	19 Å²	19	48.1 Å²	48.1	12%	0.117	27%	0.27	C	S	.	.	H	α-helix	trans	-56.5	-42	174	-47	0	0	0	0	111.4	M669 E675 C898 I899	M669-T895 HydrophobicContact CE-CG2 4.35Å; M669-T895 WeakPolarHBondContact CE-OG1 3.04Å; E675-T895 HydrophobicContact CB-CG2 3.97Å; E675-T895 HydrophobicContact CG-CG2 4.33Å; E675-T895 PolarHBondContact OE2-OG1 3.11Å; T895-C898 PolarHBondContact O-N 3.44Å; T895-I899 HydrophobicContact CG2-CD1 3.99Å; T895-I899 WeakPolarHBondContact O-CG1 3.35Å; T895-I899 PolarHBondContact O-N 3.27Å; T895-I899 VanDerWaalsContact O-N 3.16Å
896	T	91.3	Very high	90.3	Very high	16 Å²	16	45.8 Å²	45.8	10%	0.098	25%	0.249	C	C	.	.	H	α-helix	trans	-64.3	-42.3	179.6	-55.7	0	0	0	0	111.7	F883 I886 K892 K893 D894 C900	F883-T896 HydrophobicContact CD2-CG2 4.02Å; F883-T896 HydrophobicContact CE2-CG2 4.18Å; I886-T896 HydrophobicContact CB-CG2 3.93Å; I886-T896 HydrophobicContact CG2-CG2 3.49Å; I886-T896 VanDerWaalsContact CG2-CG2 3.49Å; K892-T896 PolarHBondContact O-N 3.41Å; K892-T896 PolarHBondContact O-OG1 3.07Å; K893-T896 WeakPolarHBondContact O-CB 3.44Å; K893-T896 PolarHBondContact O-N 3.45Å; D894-T896 VanDerWaalsContact C-N 3.26Å; D894-T896 PolarHBondContact O-N 3.44Å; T896-C900 WeakPolarHBondContact O-CB 3.32Å; T896-C900 PolarHBondContact O-N 3.32Å; T896-C900 VanDerWaalsContact O-N 3.11Å
897	M	91.6	Very high	90.4	Very high	2 Å²	2	42.3 Å²	42.3	1%	0.01	23%	0.232	C	C	.	.	H	α-helix	trans	-63	-48.6	176.1	-66.8	-172.7	-163.8	0	0	111.7	I731 F835 F883 Y887 K893 D894 I899 C900 F901	I731-M897 HydrophobicContact CD1-CB 3.93Å; F835-M897 HydrophobicContact CD2-CE 4.1Å; F835-M897 HydrophobicContact CE1-CE 4.19Å; F835-M897 HydrophobicContact CE2-CE 3.38Å; F835-M897 HydrophobicContact CE2-SD 3.76Å; F835-M897 HydrophobicContact CZ-CE 3.43Å; F835-M897 VanDerWaalsContact CZ-CE 3.43Å; F835-M897 HydrophobicContact CZ-CG 4.27Å; F835-M897 HydrophobicContact CZ-SD 3.69Å; F883-M897 HydrophobicContact CE2-CG 4.23Å; F883-M897 HydrophobicContact CZ-CG 4.37Å; Y887-M897 HydrophobicContact CD2-CE 4.39Å; Y887-M897 HydrophobicContact CD2-CG 4.4Å; Y887-M897 HydrophobicContact CE2-CE 3.35Å; Y887-M897 HydrophobicContact CE2-CG 4.21Å; K893-M897 WeakPolarHBondContact O-CG 3.06Å; K893-M897 PolarHBondContact O-N 2.98Å; D894-M897 PolarHBondContact O-N 3.34Å; M897-I899 PolarHBondContact O-N 3.17Å; M897-C900 PolarHBondContact O-N 3.29Å; M897-F901 HydrophobicContact CB-CD2 4.47Å; M897-F901 HydrophobicContact CB-CE2 4.09Å; M897-F901 HydrophobicContact CB-CZ 4.44Å; M897-F901 WeakPolarHBondContact O-CD2 3.04Å; M897-F901 VanDerWaalsContact O-CG 3.31Å; M897-F901 WeakPolarHBondContact O-CG 3.49Å; M897-F901 PolarHBondContact O-N 3.2Å
898	C	93.2	Very high	90.6	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-53.7	-50.2	179	-77.6	0	0	0	0	112.6	C679 T728 I731 D894 T895 S902	C679-C898 HydrophobicContact CB-CB 3.89Å; T728-C898 HydrophobicContact CG2-CB 4.37Å; I731-C898 VanDerWaalsContact CB-SG 3.55Å; I731-C898 VanDerWaalsContact CD1-SG 3.58Å; I731-C898 WeakPolarHBondContact CG2-SG 3.49Å; D894-C898 PolarHBondContact O-N 3.01Å; T895-C898 PolarHBondContact O-N 3.44Å; C898-S902 WeakPolarHBondContact O-CB 3.45Å; C898-S902 PolarHBondContact O-N 3.39Å; C898-S902 PolarHBondContact O-OG 3.03Å; C898-S902 VanDerWaalsContact O-OG 3.05Å
899	I	92.3	Very high	91	Very high	88 Å²	88	36.4 Å²	36.4	45%	0.451	21%	0.208	S	C	.	.	H	α-helix	trans	-65.3	-46.8	-178.3	-66.6	171.1	0	0	0	110.2	T895 M897 L903	T895-I899 HydrophobicContact CG2-CD1 3.99Å; T895-I899 WeakPolarHBondContact O-CG1 3.35Å; T895-I899 PolarHBondContact O-N 3.27Å; T895-I899 VanDerWaalsContact O-N 3.16Å; M897-I899 PolarHBondContact O-N 3.17Å; I899-L903 WeakPolarHBondContact O-CB 3.17Å; I899-L903 PolarHBondContact O-N 3.02Å
900	C	92.8	Very high	91.5	Very high	9 Å²	9	37.2 Å²	37.2	6%	0.061	20%	0.199	C	C	.	.	H	α-helix	trans	-62.6	-49.5	-177.8	176.4	0	0	0	0	112.5	F883 T896 M897 S902 L903 S904	F883-C900 HydrophobicContact CB-CB 4.11Å; F883-C900 WeakPolarHBondContact CB-SG 3.43Å; F883-C900 HydrophobicContact CD2-CB 3.45Å; F883-C900 VanDerWaalsContact CD2-CB 3.45Å; F883-C900 HydrophobicContact CE2-CB 4.12Å; F883-C900 HydrophobicContact CG-CB 3.95Å; F883-C900 WeakPolarHBondContact CG-SG 3.43Å; T896-C900 WeakPolarHBondContact O-CB 3.32Å; T896-C900 PolarHBondContact O-N 3.32Å; T896-C900 VanDerWaalsContact O-N 3.11Å; M897-C900 PolarHBondContact O-N 3.29Å; C900-S902 PolarHBondContact O-N 3.08Å; C900-L903 PolarHBondContact O-N 3.35Å; C900-S904 WeakPolarHBondContact O-CB 3.4Å; C900-S904 PolarHBondContact O-N 3.3Å
901	F	94	Very high	91.9	Very high	2 Å²	2	37.8 Å²	37.8	1%	0.009	20%	0.199	C	C	.	.	H	α-helix	trans	-63.9	-43.5	-176.8	-63	-20	0	0	0	111.7	T727 I731 P747 F751 F835 F839 W880 F883 M897 S904 A905	T727-F901 HydrophobicContact CG2-CD2 3.74Å; T727-F901 HydrophobicContact CG2-CE2 4.18Å; I731-F901 HydrophobicContact CD1-CD2 4.26Å; I731-F901 HydrophobicContact CD1-CE2 4.42Å; P747-F901 HydrophobicContact CB-CD2 4.48Å; P747-F901 HydrophobicContact CB-CE2 4.03Å; P747-F901 HydrophobicContact CB-CZ 4.31Å; P747-F901 HydrophobicContact CG-CE2 4.16Å; F751-F901 AromaticContact CE2-CD1 3.6Å; F751-F901 HydrophobicContact CE2-CD1 3.6Å; F751-F901 AromaticContact CE2-CE1 3.93Å; F751-F901 HydrophobicContact CE2-CE1 3.93Å; F751-F901 HydrophobicContact CE2-CG 4.17Å; F751-F901 HydrophobicContact CZ-CB 4.33Å; F751-F901 AromaticContact CZ-CD1 3.75Å; F751-F901 HydrophobicContact CZ-CD1 3.75Å; F751-F901 HydrophobicContact CZ-CE1 4.46Å; F751-F901 HydrophobicContact CZ-CG 4.29Å; F835-F901 HydrophobicContact CZ-CZ 4.46Å; F839-F901 HydrophobicContact CE1-CE1 4.4Å; F839-F901 HydrophobicContact CE1-CZ 4.42Å; F839-F901 HydrophobicContact CZ-CE1 4.18Å; F839-F901 AromaticContact CZ-CZ 3.79Å; F839-F901 HydrophobicContact CZ-CZ 3.79Å; W880-F901 HydrophobicContact CH2-CE1 4.35Å; F883-F901 HydrophobicContact CZ-CE1 4.49Å; M897-F901 HydrophobicContact CB-CD2 4.47Å; M897-F901 HydrophobicContact CB-CE2 4.09Å; M897-F901 HydrophobicContact CB-CZ 4.44Å; M897-F901 WeakPolarHBondContact O-CD2 3.04Å; M897-F901 VanDerWaalsContact O-CG 3.31Å; M897-F901 WeakPolarHBondContact O-CG 3.49Å; M897-F901 PolarHBondContact O-N 3.2Å; F901-S904 PolarHBondContact O-N 3.37Å; F901-A905 PolarHBondContact O-N 2.97Å; F901-A905 VanDerWaalsContact O-N 3.15Å
902	S	94.8	Very high	92.4	Very high	1 Å²	1	31.9 Å²	31.9	1%	0.007	17%	0.167	C	C	.	.	H	α-helix	trans	-67	-38.5	176.5	-60	0	0	0	0	112.2	F682 Y725 T728 C898 C900 A905 S906	F682-S902 VanDerWaalsContact CD1-CB 3.44Å; F682-S902 VanDerWaalsContact CE1-CB 3.46Å; Y725-S902 WeakPolarHBondContact CE1-O 3.35Å; T728-S902 PolarHBondContact OG1-OG 3.2Å; T728-S902 VanDerWaalsContact OG1-OG 3.08Å; C898-S902 WeakPolarHBondContact O-CB 3.45Å; C898-S902 PolarHBondContact O-N 3.39Å; C898-S902 PolarHBondContact O-OG 3.03Å; C898-S902 VanDerWaalsContact O-OG 3.05Å; C900-S902 PolarHBondContact O-N 3.08Å; S902-A905 PolarHBondContact O-N 2.99Å; S902-S906 WeakPolarHBondContact O-CB 3.35Å; S902-S906 PolarHBondContact O-N 3.25Å; S902-S906 PolarHBondContact O-OG 3.34Å
903	L	93.5	Very high	92.8	Very high	72 Å²	72	26.7 Å²	26.7	38%	0.377	15%	0.145	S	C	.	.	H	α-helix	trans	-66	-43.4	177.8	-177.9	64.1	0	0	0	111.4	V879 I899 C900 A905 S906 V907	V879-L903 HydrophobicContact CG1-CD2 4.27Å; V879-L903 HydrophobicContact CG2-CD2 4.1Å; V879-L903 HydrophobicContact CG2-CG 4.35Å; I899-L903 WeakPolarHBondContact O-CB 3.17Å; I899-L903 PolarHBondContact O-N 3.02Å; C900-L903 PolarHBondContact O-N 3.35Å; L903-A905 VanDerWaalsContact C-N 3.31Å; L903-A905 PolarHBondContact O-N 3.37Å; L903-S906 WeakPolarHBondContact O-CB 3.33Å; L903-S906 PolarHBondContact O-N 3.45Å; L903-V907 WeakPolarHBondContact O-CG2 3.49Å; L903-V907 PolarHBondContact O-N 2.76Å
904	S	93.6	Very high	93	Very high	3 Å²	3	27.4 Å²	27.4	2%	0.021	15%	0.148	C	C	.	.	H	α-helix	trans	-61.1	-40.6	176.9	-170.2	0	0	0	0	111.7	Y755 C900 F901 A908	Y755-S904 PolarHBondContact OH-OG 2.83Å; C900-S904 WeakPolarHBondContact O-CB 3.4Å; C900-S904 PolarHBondContact O-N 3.3Å; F901-S904 PolarHBondContact O-N 3.37Å; S904-A908 PolarHBondContact O-N 3.01Å
905	A	95.2	Very high	93	Very high	1 Å²	1	26.4 Å²	26.4	1%	0.008	15%	0.145	C	C	.	.	H	α-helix	trans	-66.1	-41.3	173.8	0	0	0	0	0	112.1	L721 C724 Y725 F901 S902 L903 V907 A908 L909	L721-A905 HydrophobicContact CD2-CB 3.9Å; L721-A905 WeakPolarHBondContact CD2-O 3.42Å; C724-A905 HydrophobicContact CB-CB 3.75Å; Y725-A905 HydrophobicContact CD1-CB 4.44Å; Y725-A905 HydrophobicContact CD2-CB 4.48Å; Y725-A905 HydrophobicContact CE1-CB 3.92Å; Y725-A905 HydrophobicContact CE2-CB 3.93Å; F901-A905 PolarHBondContact O-N 2.97Å; F901-A905 VanDerWaalsContact O-N 3.15Å; S902-A905 PolarHBondContact O-N 2.99Å; L903-A905 VanDerWaalsContact C-N 3.31Å; L903-A905 PolarHBondContact O-N 3.37Å; A905-V907 PolarHBondContact O-N 2.64Å; A905-A908 PolarHBondContact O-N 2.91Å; A905-L909 WeakPolarHBondContact O-CB 3.36Å; A905-L909 PolarHBondContact O-N 2.94Å
906	S	95.1	Very high	93	Very high	22 Å²	22	26.7 Å²	26.7	15%	0.154	14%	0.144	C	C	.	.	H	α-helix	trans	-62.2	-44.4	179.3	-60.5	0	0	0	0	112.1	F682 Y725 S902 L903 A908 L909 V910	F682-S906 VanDerWaalsContact CZ-OG 3.27Å; F682-S906 WeakPolarHBondContact CZ-OG 3.38Å; Y725-S906 WeakPolarHBondContact OH-CA 3.43Å; Y725-S906 PolarHBondContact OH-N 3.4Å; Y725-S906 VanDerWaalsContact OH-N 3.13Å; Y725-S906 PolarHBondContact OH-OG 3.23Å; Y725-S906 VanDerWaalsContact OH-OG 3.1Å; S902-S906 WeakPolarHBondContact O-CB 3.35Å; S902-S906 PolarHBondContact O-N 3.25Å; S902-S906 PolarHBondContact O-OG 3.34Å; L903-S906 WeakPolarHBondContact O-CB 3.33Å; L903-S906 PolarHBondContact O-N 3.45Å; S906-A908 VanDerWaalsContact C-N 3.32Å; S906-A908 PolarHBondContact O-N 3.41Å; S906-L909 PolarHBondContact O-N 3.28Å; S906-V910 WeakPolarHBondContact O-CB 3.46Å; S906-V910 WeakPolarHBondContact O-CG2 3.43Å; S906-V910 PolarHBondContact O-N 3.44Å
907	V	94.3	Very high	93	Very high	20 Å²	20	26.6 Å²	26.6	12%	0.121	14%	0.143	C	C	.	.	H	α-helix	trans	-58.1	-45.3	176.6	168.2	0	0	0	0	110.9	T875 L903 A905 L911	T875-V907 HydrophobicContact CG2-CB 4.37Å; T875-V907 HydrophobicContact CG2-CG1 3.54Å; T875-V907 HydrophobicContact CG2-CG2 3.82Å; L903-V907 WeakPolarHBondContact O-CG2 3.49Å; L903-V907 PolarHBondContact O-N 2.76Å; A905-V907 PolarHBondContact O-N 2.64Å; V907-L911 HydrophobicContact CG1-CD1 3.84Å; V907-L911 VanDerWaalsContact O-CB 3.3Å; V907-L911 WeakPolarHBondContact O-CB 3.43Å; V907-L911 WeakPolarHBondContact O-CG 3.4Å; V907-L911 PolarHBondContact O-N 3.11Å
908	A	93.7	Very high	92.9	Very high	4 Å²	4	30.7 Å²	30.7	3%	0.033	16%	0.159	C	C	.	.	H	α-helix	trans	-67.2	-42.4	178.1	0	0	0	0	0	112.3	L721 T872 S904 A905 S906 L912	L721-A908 HydrophobicContact CD2-CB 3.77Å; T872-A908 HydrophobicContact CG2-CB 4.16Å; S904-A908 PolarHBondContact O-N 3.01Å; A905-A908 PolarHBondContact O-N 2.91Å; S906-A908 VanDerWaalsContact C-N 3.32Å; S906-A908 PolarHBondContact O-N 3.41Å; A908-L912 HydrophobicContact CB-CD1 4.23Å; A908-L912 WeakPolarHBondContact O-CB 3.39Å; A908-L912 WeakPolarHBondContact O-CG 3.31Å; A908-L912 PolarHBondContact O-N 3.41Å
909	L	95.4	Very high	92.6	Very high	15 Å²	15	32.1 Å²	32.1	8%	0.079	17%	0.168	C	C	.	.	H	α-helix	trans	-60.9	-51.8	177.7	-175.2	64.8	0	0	0	111.4	A689 T693 L718 L721 A905 S906 F913 F914	A689-L909 HydrophobicContact CB-CD2 3.69Å; T693-L909 HydrophobicContact CG2-CD1 4.37Å; L718-L909 HydrophobicContact CD2-CD1 4.41Å; L721-L909 HydrophobicContact CD1-CB 4.16Å; L721-L909 HydrophobicContact CD1-CD1 4.1Å; A905-L909 WeakPolarHBondContact O-CB 3.36Å; A905-L909 PolarHBondContact O-N 2.94Å; S906-L909 PolarHBondContact O-N 3.28Å; L909-F913 HydrophobicContact CD1-CB 4.42Å; L909-F913 HydrophobicContact CD1-CD2 4.37Å; L909-F913 WeakPolarHBondContact O-CB 3.3Å; L909-F913 PolarHBondContact O-N 3.01Å; L909-F913 VanDerWaalsContact O-N 3.11Å; L909-F914 PolarHBondContact O-N 3.16Å
910	V	94.4	Very high	92.4	Very high	87 Å²	87	28.7 Å²	28.7	53%	0.527	15%	0.15	S	C	.	.	H	α-helix	trans	-64.2	-51.8	-178.5	174.3	0	0	0	0	110.5	S906 F914 P915	S906-V910 WeakPolarHBondContact O-CB 3.46Å; S906-V910 WeakPolarHBondContact O-CG2 3.43Å; S906-V910 PolarHBondContact O-N 3.44Å; V910-F914 WeakPolarHBondContact O-CB 3.36Å; V910-F914 PolarHBondContact O-N 3.03Å; V910-P915 WeakPolarHBondContact O-CD 3.48Å
911	L	93.2	Very high	92.3	Very high	45 Å²	45	31.8 Å²	31.8	24%	0.236	17%	0.166	C	C	.	.	H	α-helix	trans	-76.4	-32.2	-171.7	-64.1	178.8	0	0	0	113.8	F871 T872 V907	F871-L911 HydrophobicContact CB-CD1 4.34Å; T872-L911 VanDerWaalsContact OG1-CB 3.25Å; T872-L911 WeakPolarHBondContact OG1-CB 3.35Å; V907-L911 HydrophobicContact CG1-CD1 3.84Å; V907-L911 VanDerWaalsContact O-CB 3.3Å; V907-L911 WeakPolarHBondContact O-CB 3.43Å; V907-L911 WeakPolarHBondContact O-CG 3.4Å; V907-L911 PolarHBondContact O-N 3.11Å
912	L	91.8	Very high	92.2	Very high	10 Å²	10	39.4 Å²	39.4	5%	0.052	19%	0.194	C	C	.	.	H	α-helix	trans	-91.4	-34.9	-176.2	-61.3	171.8	0	0	0	113.9	L758 I869 T872 A908	L758-L912 HydrophobicContact CD1-CD1 4.24Å; L758-L912 HydrophobicContact CD2-CD1 3.79Å; L758-L912 HydrophobicContact CD2-CD2 4.28Å; L758-L912 HydrophobicContact CG-CD1 4.5Å; I869-L912 HydrophobicContact CB-CD2 4.46Å; I869-L912 HydrophobicContact CG1-CD2 3.83Å; T872-L912 HydrophobicContact CG2-CD1 4.11Å; T872-L912 HydrophobicContact CG2-CD2 4.39Å; T872-L912 HydrophobicContact CG2-CG 4.08Å; T872-L912 WeakPolarHBondContact OG1-CD2 3.3Å; T872-L912 WeakPolarHBondContact OG1-CG 3.36Å; A908-L912 HydrophobicContact CB-CD1 4.23Å; A908-L912 WeakPolarHBondContact O-CB 3.39Å; A908-L912 WeakPolarHBondContact O-CG 3.31Å; A908-L912 PolarHBondContact O-N 3.41Å
913	F	93.3	Very high	91.8	Very high	3 Å²	3	44.9 Å²	44.9	1%	0.013	22%	0.215	C	C	.	.	H	α-helix	trans	-108.9	-33.7	-170.3	-66.9	-88.4	0	0	0	113.6	T693 F697 I717 L718 L721 L909 K916 L917	T693-F913 HydrophobicContact CG2-CB 3.81Å; T693-F913 HydrophobicContact CG2-CD1 3.82Å; T693-F913 HydrophobicContact CG2-CG 3.96Å; F697-F913 AromaticContact CE1-CD1 3.99Å; F697-F913 HydrophobicContact CE1-CD1 3.99Å; F697-F913 AromaticContact CE1-CE1 3.99Å; F697-F913 HydrophobicContact CE1-CE1 3.99Å; F697-F913 AromaticContact CE2-CD1 3.96Å; F697-F913 HydrophobicContact CE2-CD1 3.96Å; F697-F913 AromaticContact CZ-CD1 3.57Å; F697-F913 HydrophobicContact CZ-CD1 3.57Å; F697-F913 HydrophobicContact CZ-CE1 4.06Å; I717-F913 HydrophobicContact CB-CE2 4.43Å; I717-F913 HydrophobicContact CB-CZ 4.19Å; I717-F913 HydrophobicContact CG2-CE2 3.69Å; I717-F913 HydrophobicContact CG2-CZ 3.96Å; L718-F913 HydrophobicContact CD1-CE1 3.95Å; L718-F913 HydrophobicContact CD1-CZ 4.32Å; L718-F913 HydrophobicContact CD2-CD1 4.26Å; L718-F913 HydrophobicContact CD2-CD2 4.4Å; L718-F913 HydrophobicContact CD2-CE1 4.01Å; L718-F913 HydrophobicContact CD2-CE2 4.15Å; L718-F913 HydrophobicContact CD2-CG 4.46Å; L718-F913 HydrophobicContact CD2-CZ 3.94Å; L718-F913 HydrophobicContact CG-CE1 3.84Å; L718-F913 HydrophobicContact CG-CE2 4.36Å; L718-F913 HydrophobicContact CG-CZ 3.73Å; L721-F913 HydrophobicContact CD1-CD2 4.41Å; L721-F913 HydrophobicContact CD1-CE2 4.08Å; L909-F913 HydrophobicContact CD1-CB 4.42Å; L909-F913 HydrophobicContact CD1-CD2 4.37Å; L909-F913 WeakPolarHBondContact O-CB 3.3Å; L909-F913 PolarHBondContact O-N 3.01Å; L909-F913 VanDerWaalsContact O-N 3.11Å; F913-K916 WeakPolarHBondContact O-CB 3.49Å; F913-K916 PolarHBondContact O-N 2.72Å; F913-L917 PolarHBondContact O-N 3.45Å
914	F	91	Very high	91.3	Very high	105 Å²	105	45.2 Å²	45.2	46%	0.461	22%	0.221	S	C	.	.	H	α-helix	trans	-56.2	-45	178.3	-177	-97.3	0	0	0	113.1	L909 V910 K916 L917 Y918 W922	L909-F914 PolarHBondContact O-N 3.16Å; V910-F914 WeakPolarHBondContact O-CB 3.36Å; V910-F914 PolarHBondContact O-N 3.03Å; F914-K916 PolarHBondContact O-N 3.42Å; F914-L917 PolarHBondContact O-N 3.39Å; F914-Y918 VanDerWaalsContact O-CB 3.3Å; F914-Y918 WeakPolarHBondContact O-CB 3.34Å; F914-Y918 PolarHBondContact O-N 2.93Å; F914-W922 HydrophobicContact CE2-CZ3 4.21Å; F914-W922 HydrophobicContact CZ-CZ3 4.15Å
915	P	88.9	Confident	90.6	Very high	31 Å²	31	49.8 Å²	49.8	20%	0.201	24%	0.242	C	C	.	.	H	α-helix	trans	-60	-31.1	177	-23.9	34.5	0	0	0	113.2	F868 V910 V919	F868-P915 HydrophobicContact CD1-CG 3.84Å; F868-P915 HydrophobicContact CD2-CB 4.38Å; F868-P915 HydrophobicContact CD2-CG 4.28Å; F868-P915 HydrophobicContact CE1-CB 4.3Å; F868-P915 HydrophobicContact CE1-CG 3.62Å; F868-P915 HydrophobicContact CE2-CB 3.95Å; F868-P915 HydrophobicContact CE2-CG 4.09Å; F868-P915 HydrophobicContact CG-CG 4.18Å; F868-P915 HydrophobicContact CZ-CB 3.92Å; F868-P915 HydrophobicContact CZ-CG 3.76Å; V910-P915 WeakPolarHBondContact O-CD 3.48Å; P915-V919 WeakPolarHBondContact O-CG2 3.23Å; P915-V919 PolarHBondContact O-N 2.83Å
916	K	89.6	Confident	89.8	Confident	24 Å²	24	53.5 Å²	53.5	10%	0.104	26%	0.258	C	S	.	.	H	α-helix	trans	-78.6	-44.3	179.3	-65.6	174	-178.5	167.6	0	111.4	F697 V705 T709 E865 F913 F914 Y918 V919 I920	F697-K916 HydrophobicContact CE2-CB 4.46Å; F697-K916 HydrophobicContact CZ-CB 4Å; F697-K916 HydrophobicContact CZ-CD 4.02Å; V705-K916 HydrophobicContact CG1-CB 4.18Å; V705-K916 HydrophobicContact CG1-CG 4.24Å; T709-K916 HydrophobicContact CG2-CD 4.25Å; E865-K916 WeakPolarHBondContact OE1-CE 3.44Å; E865-K916 IonicContact OE1-NZ 2.76Å; E865-K916 PolarHBondContact OE1-NZ 2.97Å; F913-K916 WeakPolarHBondContact O-CB 3.49Å; F913-K916 PolarHBondContact O-N 2.72Å; F914-K916 PolarHBondContact O-N 3.42Å; K916-Y918 VanDerWaalsContact C-N 3.3Å; K916-Y918 PolarHBondContact O-N 2.92Å; K916-V919 PolarHBondContact O-N 3.28Å; K916-I920 WeakPolarHBondContact O-CD1 3.33Å; K916-I920 VanDerWaalsContact O-CG1 3.23Å; K916-I920 WeakPolarHBondContact O-CG1 3.45Å; K916-I920 PolarHBondContact O-N 2.84Å
917	L	91.2	Very high	89.1	Confident	15 Å²	15	53.8 Å²	53.8	8%	0.079	26%	0.258	C	S	.	.	H	α-helix	trans	-59.8	-42.3	173.6	-71.8	174.5	0	0	0	111.2	T693 I696 F697 F913 F914 V919 I920 L921	T693-L917 HydrophobicContact CG2-CD1 3.92Å; T693-L917 HydrophobicContact CG2-CD2 4.37Å; T693-L917 HydrophobicContact CG2-CG 4.33Å; T693-L917 WeakPolarHBondContact OG1-CD1 3.36Å; I696-L917 HydrophobicContact CB-CD2 3.85Å; I696-L917 HydrophobicContact CG1-CD2 4.37Å; I696-L917 HydrophobicContact CG2-CD2 3.63Å; F697-L917 HydrophobicContact CD2-CD2 4.12Å; F697-L917 HydrophobicContact CE2-CD2 3.94Å; F697-L917 HydrophobicContact CE2-CG 4.28Å; F913-L917 PolarHBondContact O-N 3.45Å; F914-L917 PolarHBondContact O-N 3.39Å; L917-V919 VanDerWaalsContact C-N 3.32Å; L917-V919 PolarHBondContact O-N 2.83Å; L917-I920 PolarHBondContact O-N 3.33Å; L917-I920 VanDerWaalsContact O-N 3.14Å; L917-L921 WeakPolarHBondContact O-CB 3.37Å; L917-L921 WeakPolarHBondContact O-CG 3.33Å; L917-L921 PolarHBondContact O-N 3.45Å
918	Y	90.3	Very high	88.2	Confident	88 Å²	88	55.8 Å²	55.8	35%	0.345	27%	0.27	S	S	.	.	H	α-helix	trans	-57	-44.6	176.4	-179	-87.3	0	0	0	111.7	F914 K916 W922 R923	F914-Y918 VanDerWaalsContact O-CB 3.3Å; F914-Y918 WeakPolarHBondContact O-CB 3.34Å; F914-Y918 PolarHBondContact O-N 2.93Å; K916-Y918 VanDerWaalsContact C-N 3.3Å; K916-Y918 PolarHBondContact O-N 2.92Å; Y918-W922 HydrophobicContact CD2-CD2 4.26Å; Y918-W922 AromaticContact CD2-CE3 3.19Å; Y918-W922 HydrophobicContact CD2-CE3 3.19Å; Y918-W922 AromaticContact CD2-CZ3 3.66Å; Y918-W922 HydrophobicContact CD2-CZ3 3.66Å; Y918-W922 HydrophobicContact CE2-CB 4.36Å; Y918-W922 HydrophobicContact CE2-CD2 4.41Å; Y918-W922 AromaticContact CE2-CE3 3.67Å; Y918-W922 HydrophobicContact CE2-CE3 3.67Å; Y918-W922 HydrophobicContact CE2-CZ3 4.28Å; Y918-W922 AromaticContact CG-CE3 3.96Å; Y918-W922 HydrophobicContact CG-CE3 3.96Å; Y918-W922 WeakPolarHBondContact O-CA 3.26Å; Y918-W922 PolarHBondContact O-N 3.29Å; Y918-R923 HydrophobicContact CD1-CG 4.08Å; Y918-R923 HydrophobicContact CE1-CB 4.39Å; Y918-R923 HydrophobicContact CE1-CG 3.37Å; Y918-R923 PolarHBondContact O-N 3.16Å; Y918-R923 VanDerWaalsContact O-N 3.16Å; Y918-R923 PolarHBondContact OH-NE 3.33Å
919	V	86.9	Confident	86.9	Confident	30 Å²	30	64.8 Å²	64.8	18%	0.182	30%	0.303	C	S	.	.	H	α-helix	trans	-68.8	-38.1	176.3	175.2	0	0	0	0	112.1	V705 P915 K916 L917 R923 K926 N927	V705-V919 HydrophobicContact CG2-CG1 3.72Å; P915-V919 WeakPolarHBondContact O-CG2 3.23Å; P915-V919 PolarHBondContact O-N 2.83Å; K916-V919 PolarHBondContact O-N 3.28Å; L917-V919 VanDerWaalsContact C-N 3.32Å; L917-V919 PolarHBondContact O-N 2.83Å; V919-R923 CarbonylContact O-C 3.13Å; V919-K926 HydrophobicContact CG1-CB 3.97Å; V919-N927 HydrophobicContact CG1-CB 4.49Å
920	I	88.3	Confident	85.3	Confident	16 Å²	16	68.3 Å²	68.3	8%	0.082	33%	0.329	C	S	.	.	H	α-helix	trans	-70.2	-38.7	-179.3	-67.7	163.5	0	0	0	111.9	I696 F697 K700 V705 V706 K916 L917	I696-I920 HydrophobicContact CG2-CG2 4Å; F697-I920 HydrophobicContact CE2-CD1 4.35Å; K700-I920 HydrophobicContact CB-CG2 4.21Å; K700-I920 HydrophobicContact CG-CG2 4.11Å; V705-I920 HydrophobicContact CB-CG1 4.37Å; V705-I920 HydrophobicContact CG1-CD1 4.35Å; V705-I920 HydrophobicContact CG1-CG1 4.35Å; V706-I920 HydrophobicContact CG2-CD1 3.67Å; K916-I920 WeakPolarHBondContact O-CD1 3.33Å; K916-I920 VanDerWaalsContact O-CG1 3.23Å; K916-I920 WeakPolarHBondContact O-CG1 3.45Å; K916-I920 PolarHBondContact O-N 2.84Å; L917-I920 PolarHBondContact O-N 3.33Å; L917-I920 VanDerWaalsContact O-N 3.14Å
921	L	90.5	Very high	83.6	Confident	74 Å²	74	70.1 Å²	70.1	39%	0.387	33%	0.328	S	S	.	.	H	α-helix	trans	-96.4	-43.8	-172.1	-64.6	175	0	0	0	113.6	F692 I696 L917	F692-L921 HydrophobicContact CE1-CD1 4.22Å; F692-L921 HydrophobicContact CZ-CD1 4.01Å; I696-L921 HydrophobicContact CD1-CD2 4.24Å; I696-L921 HydrophobicContact CG2-CD2 4.48Å; L917-L921 WeakPolarHBondContact O-CB 3.37Å; L917-L921 WeakPolarHBondContact O-CG 3.33Å; L917-L921 PolarHBondContact O-N 3.45Å
922	W	90.7	Very high	82	Confident	162 Å²	162	72.6 Å²	72.6	61%	0.614	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.4	-22.1	-170.1	-68.4	-48.8	0	0	0	114.8	F914 Y918	F914-W922 HydrophobicContact CE2-CZ3 4.21Å; F914-W922 HydrophobicContact CZ-CZ3 4.15Å; Y918-W922 HydrophobicContact CD2-CD2 4.26Å; Y918-W922 AromaticContact CD2-CE3 3.19Å; Y918-W922 HydrophobicContact CD2-CE3 3.19Å; Y918-W922 AromaticContact CD2-CZ3 3.66Å; Y918-W922 HydrophobicContact CD2-CZ3 3.66Å; Y918-W922 HydrophobicContact CE2-CB 4.36Å; Y918-W922 HydrophobicContact CE2-CD2 4.41Å; Y918-W922 AromaticContact CE2-CE3 3.67Å; Y918-W922 HydrophobicContact CE2-CE3 3.67Å; Y918-W922 HydrophobicContact CE2-CZ3 4.28Å; Y918-W922 AromaticContact CG-CE3 3.96Å; Y918-W922 HydrophobicContact CG-CE3 3.96Å; Y918-W922 WeakPolarHBondContact O-CA 3.26Å; Y918-W922 PolarHBondContact O-N 3.29Å
923	R	86.3	Confident	80.1	Confident	115 Å²	115	79.2 Å²	79.2	43%	0.434	37%	0.365	S	S	.	.			trans	-125.4	57.4	177.8	-60.8	-58.3	-151.5	161.7	-0.5	112.8	Y918 V919 E925 K926	Y918-R923 HydrophobicContact CD1-CG 4.08Å; Y918-R923 HydrophobicContact CE1-CB 4.39Å; Y918-R923 HydrophobicContact CE1-CG 3.37Å; Y918-R923 PolarHBondContact O-N 3.16Å; Y918-R923 VanDerWaalsContact O-N 3.16Å; Y918-R923 PolarHBondContact OH-NE 3.33Å; V919-R923 CarbonylContact O-C 3.13Å; R923-E925 WeakPolarHBondContact CA-OE2 3.44Å; R923-E925 WeakPolarHBondContact CB-OE1 3.47Å; R923-E925 VanDerWaalsContact CD-OE1 3.27Å; R923-E925 WeakPolarHBondContact CD-OE1 3.39Å; R923-E925 IonicContact NH1-OE1 3.93Å; R923-E925 PolarHBondContact O-N 3.36Å; R923-E925 VanDerWaalsContact O-N 3.1Å; R923-K926 HydrophobicContact CB-CD 4.45Å; R923-K926 HydrophobicContact CB-CG 4.48Å; R923-K926 PolarHBondContact O-N 3.09Å
924	P	82.7	Confident	78	Confident	79 Å²	79	83.7 Å²	83.7	51%	0.513	39%	0.392	S	S	.	.	G	3₁₀ helix	trans	-60.9	-21.2	-176.4	27.9	-35.8	0	0	0	113	K926 N927	P924-K926 PolarHBondContact O-N 3.38Å; P924-N927 WeakPolarHBondContact O-CB 3.17Å; P924-N927 PolarHBondContact O-N 3.47Å
925	E	80.2	Confident	75.7	Confident	100 Å²	100	83.2 Å²	83.2	47%	0.467	40%	0.399	S	S	.	.	G	3₁₀ helix	trans	-62.9	-26	174.5	76.7	-69.9	168.5	0	0	113	R923 N927	R923-E925 WeakPolarHBondContact CA-OE2 3.44Å; R923-E925 WeakPolarHBondContact CB-OE1 3.47Å; R923-E925 VanDerWaalsContact CD-OE1 3.27Å; R923-E925 WeakPolarHBondContact CD-OE1 3.39Å; R923-E925 IonicContact NH1-OE1 3.93Å; R923-E925 PolarHBondContact O-N 3.36Å; R923-E925 VanDerWaalsContact O-N 3.1Å; E925-N927 VanDerWaalsContact C-N 3.32Å
926	K	78.5	Confident	73.6	Confident	79 Å²	79	88.6 Å²	88.6	34%	0.343	43%	0.431	S	S	.	.	G	3₁₀ helix	trans	-85.3	-5.6	174	-63.6	-172.7	-179.1	-173.1	0	112.9	V919 R923 P924 V928 Y931	V919-K926 HydrophobicContact CG1-CB 3.97Å; R923-K926 HydrophobicContact CB-CD 4.45Å; R923-K926 HydrophobicContact CB-CG 4.48Å; R923-K926 PolarHBondContact O-N 3.09Å; P924-K926 PolarHBondContact O-N 3.38Å; K926-V928 PolarHBondContact O-N 3.02Å; K926-V928 VanDerWaalsContact O-N 3.09Å; K926-Y931 HydrophobicContact CG-CE2 4.38Å
927	N	79.4	Confident	71.1	Confident	27 Å²	27	92.8 Å²	92.8	14%	0.144	46%	0.459	C	S	.	.			trans	-85.2	40.5	179.5	-166.8	17.4	0	0	0	112.5	T703 P704 V705 V919 P924 E925	T703-N927 WeakPolarHBondContact CB-ND2 3.31Å; T703-N927 VanDerWaalsContact CG2-ND2 3.33Å; T703-N927 WeakPolarHBondContact CG2-ND2 3.28Å; P704-N927 WeakPolarHBondContact CD-OD1 3.39Å; P704-N927 WeakPolarHBondContact CG-O 3.44Å; V705-N927 HydrophobicContact CG2-CB 4.37Å; V705-N927 VanDerWaalsContact CG2-OD1 3.26Å; V705-N927 WeakPolarHBondContact CG2-OD1 3.35Å; V705-N927 PolarHBondContact N-OD1 3.35Å; V919-N927 HydrophobicContact CG1-CB 4.49Å; P924-N927 WeakPolarHBondContact O-CB 3.17Å; P924-N927 PolarHBondContact O-N 3.47Å; E925-N927 VanDerWaalsContact C-N 3.32Å
928	V	76.6	Confident	68.7	Low	62 Å²	62	99.5 Å²	99.5	38%	0.376	49%	0.493	S	S	.	.	S	Bend	trans	-115.4	146.7	-178.3	-68.3	0	0	0	0	111.2	K926 S930 Y931	K926-V928 PolarHBondContact O-N 3.02Å; K926-V928 VanDerWaalsContact O-N 3.09Å; V928-S930 VanDerWaalsContact CG2-OG 3.3Å; V928-S930 WeakPolarHBondContact CG2-OG 3.32Å; V928-S930 PolarHBondContact O-N 3.07Å; V928-Y931 PolarHBondContact O-N 3Å
929	R	66.7	Low	66	Low	193 Å²	193	105.8 Å²	105.8	73%	0.728	52%	0.516	S	S	*	.	G	3₁₀ helix	trans	-64.4	-24.4	-176.6	-164.1	175.8	-174.3	-175.8	2.3	113.2	Y931 F932	R929-Y931 VanDerWaalsContact C-N 3.3Å; R929-Y931 PolarHBondContact O-N 3.05Å; R929-F932 PolarHBondContact O-N 3.49Å
930	S	60.1	Low	63.7	Low	89 Å²	89	109.4 Å²	109.4	62%	0.622	54%	0.542	S	S	*	.	G	3₁₀ helix	trans	-65.6	-30.1	178.1	47.5	0	0	0	0	112.8	V928 F932 K933	V928-S930 VanDerWaalsContact CG2-OG 3.3Å; V928-S930 WeakPolarHBondContact CG2-OG 3.32Å; V928-S930 PolarHBondContact O-N 3.07Å; S930-F932 PolarHBondContact O-N 2.97Å; S930-K933 PolarHBondContact O-N 3.37Å
931	Y	59.8	Low	61.3	Low	126 Å²	126	116.1 Å²	116.1	49%	0.494	57%	0.572	S	S	.	*	G	3₁₀ helix	trans	-69	-13.9	179.3	-152.3	-90.4	0	0	0	113.2	K926 V928 R929	K926-Y931 HydrophobicContact CG-CE2 4.38Å; V928-Y931 PolarHBondContact O-N 3Å; R929-Y931 VanDerWaalsContact C-N 3.3Å; R929-Y931 PolarHBondContact O-N 3.05Å
932	F	58.8	Low	59	Low	97 Å²	97	122.3 Å²	122.3	43%	0.425	60%	0.597	S	S	.	*	G	3₁₀ helix	trans	-107.3	2.3	-178.5	-64	-80.5	0	0	0	114.3	V705 A708 R929 S930	V705-F932 HydrophobicContact CG2-CE2 4.27Å; V705-F932 HydrophobicContact CG2-CZ 4.06Å; A708-F932 HydrophobicContact CB-CD1 4.43Å; A708-F932 HydrophobicContact CB-CE1 4.36Å; R929-F932 PolarHBondContact O-N 3.49Å; S930-F932 PolarHBondContact O-N 2.97Å
933	K	52.8	Low	56.4	Low	148 Å²	148	118.2 Å²	118.2	64%	0.643	61%	0.605	S	S	*	*	S	Bend	trans	-99.2	123.3	177.9	-72.9	-173.6	176.2	-176.9	0	110.4	S930 T935	S930-K933 PolarHBondContact O-N 3.37Å; K933-T935 PolarHBondContact O-N 3.36Å
934	T	49.1	Very low	54	Low	97 Å²	97	116.9 Å²	116.9	60%	0.595	62%	0.618	S	S	*	*	P	Polyproline II helix	trans	-58.8	127.2	172.1	-44.7	0	0	0	0	110.2
935	T	42.8	Very low	51.8	Low	96 Å²	96	119.7 Å²	119.7	59%	0.589	63%	0.629	S	S	*	*	P	Polyproline II helix	trans	-52.6	132.5	-174.9	-24.2	0	0	0	0	112.7	K933 T937	K933-T935 PolarHBondContact O-N 3.36Å; T935-T937 HydrophobicContact CG2-CG2 4.4Å; T935-T937 PolarHBondContact O-N 2.88Å
936	T	44.3	Very low	49.8	Very low	143 Å²	143	122.9 Å²	122.9	88%	0.877	64%	0.644	S	S	*	*			trans	-75.3	32	177.6	43.2	0	0	0	0	113.6	I938	T936-I938 PolarHBondContact O-N 3.04Å
937	T	38	Very low	48.1	Very low	113 Å²	113	125.7 Å²	125.7	69%	0.693	67%	0.667	S	S	*	*			trans	-103.3	65	-179.6	41.5	0	0	0	0	111.5	T935	T935-T937 HydrophobicContact CG2-CG2 4.4Å; T935-T937 PolarHBondContact O-N 2.88Å
938	I	39.2	Very low	46.4	Very low	156 Å²	156	129.9 Å²	129.9	80%	0.8	70%	0.696	S	S	*	*			trans	-125.3	93.4	148.4	-61.5	177.9	0	0	0	105.6	T936	T936-I938 PolarHBondContact O-N 3.04Å
939	R	34.3	Very low	44.5	Very low	220 Å²	220	130.5 Å²	130.5	83%	0.83	71%	0.714	S	S	*	*			trans	-91.3	107	169.6	-170.6	-173.3	-143.4	110.3	1.3	106.7
940	C	38.9	Very low	43.2	Very low	106 Å²	106	127.2 Å²	127.2	72%	0.716	72%	0.721	S	S	*	*			trans	-85.6	111.2	165.4	-72.2	0	0	0	0	108.4
941	H	38.2	Very low	42.1	Very low	156 Å²	156	126 Å²	126	72%	0.722	72%	0.723	S	S	*	*			trans	-87.1	119.9	153.1	-98	-98.6	0	0	0	107.3
942	F	41.2	Very low	41	Very low	205 Å²	205	125.5 Å²	125.5	90%	0.899	73%	0.733	S	S	*	*			trans	-120.2	133.5	148.5	-91.9	-81.2	0	0	0	106.9
943	G	37.3	Very low	39.9	Very low	76 Å²	76	129.1 Å²	129.1	78%	0.784	75%	0.751	S	S	*	*			trans	-80.1	-179	-156.8	0	0	0	0	0	117.7
944	A	34.9	Very low	39.2	Very low	87 Å²	87	127.7 Å²	127.7	72%	0.719	76%	0.76	S	S	*	*			trans	-66.6	144.8	-172.9	0	0	0	0	0	115.3
945	N	36.8	Very low	38.6	Very low	137 Å²	137	134.6 Å²	134.6	73%	0.733	78%	0.775	S	S	*	*				170.5	129.8	110.1	-93.4	-17.6	0	0	0	112.2
946	Q	38.5	Very low	38.4	Very low	167 Å²	167	135.9 Å²	135.9	78%	0.78	78%	0.782	S	S	*	*			trans	54.6	116.5	142.2	-57.1	-176.9	18.2	0	0	120.5
947	V	43.5	Very low	38	Very low	139 Å²	139	133.8 Å²	133.8	84%	0.842	77%	0.774	S	S	*	*			trans	-120.3	118.8	144.1	176.6	0	0	0	0	106.7
948	P	42.6	Very low	38	Very low	115 Å²	115	132.9 Å²	132.9	75%	0.747	77%	0.772	S	S	*	*			trans	-83.9	136.1	156.6	23.5	-10.9	0	0	0	109
949	G	37.3	Very low	38	Very low	74 Å²	74	132.8 Å²	132.8	76%	0.763	77%	0.771	S	S	*	*			trans	-73.5	155	-178.8	0	0	0	0	0	113.6
950	S	38	Very low	38.1	Very low	125 Å²	125	128 Å²	128	87%	0.874	77%	0.771	S	S	*	*				-178.8	136.7	124.5	67.5	0	0	0	0	110.1
951	G	37.7	Very low	37.9	Very low	63 Å²	63	126.6 Å²	126.6	65%	0.649	78%	0.775	S	S	*	*				102.2	89.6	128.5	0	0	0	0	0	119.6
952	T	36.8	Very low	37.7	Very low	116 Å²	116	125 Å²	125	71%	0.712	78%	0.782	S	S	*	*				69.8	115.9	116.1	-38.7	0	0	0	0	121.4
953	Q	36.4	Very low	37.4	Very low	173 Å²	173	122.7 Å²	122.7	81%	0.808	77%	0.774	S	S	*	*			trans	60.1	128.9	142.9	-62.3	168.6	9.1	0	0	118.4
954	S	38.5	Very low	37.3	Very low	118 Å²	118	126 Å²	126	83%	0.825	77%	0.766	S	S	*	*				-176.8	156.4	77	-62.3	0	0	0	0	112.2
955	R	34.8	Very low	37.2	Very low	241 Å²	241	130.4 Å²	130.4	91%	0.909	77%	0.77	S	S	*	*			trans	-64.9	177.2	-175.2	-73.8	174.3	176.7	171.3	-0.9	116.6
956	V	38.6	Very low	37.2	Very low	123 Å²	123	133.8 Å²	133.8	75%	0.745	77%	0.772	S	S	*	*			trans	123.3	92.7	140.6	177.5	0	0	0	0	110.3
957	S	37.2	Very low	37.1	Very low	99 Å²	99	133.3 Å²	133.3	69%	0.692	78%	0.775	S	S	*	*				59.6	139.8	97.3	62.4	0	0	0	0	113.3
958	S	38	Very low	36.8	Very low	94 Å²	94	136.9 Å²	136.9	66%	0.657	77%	0.773	S	S	*	*			cis	179.6	154.6	26.7	18.4	0	0	0	0	109.3
959	I	39.6	Very low	36.3	Very low	154 Å²	154	138.1 Å²	138.1	79%	0.79	78%	0.779	S	S	*	*			trans	75.7	102.7	137.6	-65.4	166.9	0	0	0	119.5
960	S	35.6	Very low	36.2	Very low	119 Å²	119	138 Å²	138	83%	0.832	78%	0.778	S	S	*	*				30.2	147.3	122	84.4	0	0	0	0	122.2
961	G	34.7	Very low	36	Very low	77 Å²	77	136.5 Å²	136.5	79%	0.794	77%	0.773	S	S	*	*			trans	152	91	155.6	0	0	0	0	0	114.9
962	S	34.4	Very low	35.8	Very low	124 Å²	124	141 Å²	141	87%	0.867	78%	0.782	S	S	*	*			trans	-69.1	133.1	175.9	-174.1	0	0	0	0	112.8
963	Q	34.9	Very low	35.5	Very low	156 Å²	156	146.9 Å²	146.9	73%	0.729	79%	0.791	S	S	*	*			trans	-150.8	127.2	157.6	-98.4	-159.3	2.5	0	0	113.3
964	K	34.6	Very low	35.6	Very low	144 Å²	144	146.2 Å²	146.2	63%	0.626	79%	0.791	S	S	*	*				67.5	126.1	129.9	-80.4	176.2	179.1	157.2	0	122.2
965	K	32.9	Very low	35.4	Very low	181 Å²	181	151.7 Å²	151.7	79%	0.787	79%	0.794	S	S	*	*				58.6	130.8	123.9	-71.1	-179.7	170.8	-178.4	0	118.8
966	R	37.6	Very low	35.4	Very low	207 Å²	207	144.8 Å²	144.8	78%	0.781	78%	0.783	S	S	*	*				-176.8	129.9	96.7	-114.4	171.5	156.4	158.5	-6.2	113.8
967	N	34.7	Very low	35.2	Very low	157 Å²	157	148.7 Å²	148.7	84%	0.84	79%	0.789	S	S	*	*			trans	-65.9	152.9	149.2	-84	-16.1	0	0	0	110.3
968	R	37.9	Very low	35.3	Very low	214 Å²	214	149.8 Å²	149.8	81%	0.808	79%	0.794	S	S	*	*			trans	-169.8	127.9	137.3	-111.9	174.2	-179.1	-174.4	-2.9	113.6
969	T	32	Very low	35	Very low	141 Å²	141	148.5 Å²	148.5	87%	0.865	80%	0.796	S	S	*	*			trans	-72.6	156.3	150.9	37.7	0	0	0	0	110.5
970	G	35.7	Very low	34.7	Very low	73 Å²	73	150.2 Å²	150.2	75%	0.753	80%	0.8	S	S	*	*			trans	135.7	103.5	157	0	0	0	0	0	117.8
971	A	33.8	Very low	34.7	Very low	93 Å²	93	151 Å²	151	77%	0.769	80%	0.795	S	S	*	*				65.6	157.4	121.3	0	0	0	0	0	123.8
972	L	33.9	Very low	34.6	Very low	158 Å²	158	154.6 Å²	154.6	83%	0.827	80%	0.795	S	S	*	*			trans	83.9	115.2	171.7	-77.7	85.5	0	0	0	116.4
973	R	29.7	Very low	34.4	Very low	238 Å²	238	151.4 Å²	151.4	90%	0.898	78%	0.782	S	S	*	*			cis	73.1	110	45.6	-154.3	-170.8	-145.8	-169.5	8.7	113.1
974	I	39.1	Very low	34.2	Very low	160 Å²	160	150.2 Å²	150.2	82%	0.821	79%	0.791	S	S	*	*			trans	174.6	116.4	150.9	-82.8	143	0	0	0	104.5
975	R	33.6	Very low	34	Very low	232 Å²	232	146.3 Å²	146.3	88%	0.875	79%	0.791	S	S	*	*			cis	95.2	132.9	48.4	-161.5	179	-168.3	-172.9	3.1	113
976	S	36.1	Very low	33.9	Very low	97 Å²	97	145 Å²	145	68%	0.678	79%	0.793	S	S	*	*			trans	76.3	112	162.7	37.9	0	0	0	0	118.4
977	K	34.3	Very low	33.5	Very low	204 Å²	204	140 Å²	140	89%	0.887	79%	0.79	S	S	*	*				75	153	74.6	-81.9	-167.7	178.9	-173.4	0	112.5
978	P	38.2	Very low	33.3	Very low	123 Å²	123	143.3 Å²	143.3	80%	0.799	79%	0.792	S	S	*	*			cis	-119.4	163.6	-1.6	30.2	-8.5	0	0	0	112.1
979	G	31	Very low	32.9	Very low	67 Å²	67	137.2 Å²	137.2	69%	0.691	78%	0.782	S	S	*	*				90	138.3	85.9	0	0	0	0	0	111.1
980	Q	34.9	Very low	32.7	Very low	189 Å²	189	134.7 Å²	134.7	88%	0.883	77%	0.77	S	S	*	*			trans	89.5	125.1	-175.4	-64.9	179.4	-2	0	0	113.8
981	L	35.5	Very low	32.4	Very low	136 Å²	136	141.9 Å²	141.9	71%	0.712	78%	0.776	S	S	*	*			cis	-152.4	137.7	20.2	-123.6	97.1	0	0	0	107.8
982	L	31.9	Very low	32.2	Very low	153 Å²	153	141.2 Å²	141.2	80%	0.801	77%	0.766	S	S	*	*			trans	48.1	121.8	151.2	-74.8	93.4	0	0	0	120
983	G	29.6	Very low	32	Very low	57 Å²	57	139.1 Å²	139.1	59%	0.588	76%	0.76	S	S	*	*			cis	80.9	123	17.2	0	0	0	0	0	111.6
984	S	32.5	Very low	32.2	Very low	131 Å²	131	136.1 Å²	136.1	92%	0.916	76%	0.756	S	S	*	*			trans	78	134.7	-175.3	-50.9	0	0	0	0	112.6
985	G	28.5	Very low	31.9	Very low	61 Å²	61	133.6 Å²	133.6	63%	0.629	75%	0.752	S	S	*	*				116.3	156.2	51.2	0	0	0	0	0	106.4
986	D	31.9	Very low	31.9	Very low	154 Å²	154	128 Å²	128	82%	0.824	75%	0.749	S	S	*	*			trans	89.4	93.9	176.3	-46.9	-21.2	0	0	0	113.8
987	S	28.4	Very low	31.9	Very low	103 Å²	103	128 Å²	128	72%	0.72	75%	0.746	S	S	*	*				59.8	102.1	58.3	-46.3	0	0	0	0	112.4
988	Y	31.3	Very low	32	Very low	225 Å²	225	125 Å²	125	88%	0.882	74%	0.74	S	S	*	*				-152.8	99.5	128.8	-111.4	-85.8	0	0	0	105.6
989	S	28.5	Very low	31.7	Very low	87 Å²	87	126.4 Å²	126.4	61%	0.608	74%	0.74	S	S	*	*				63.9	99.1	69	-153.2	0	0	0	0	109.3
990	S	27.7	Very low	31.6	Very low	87 Å²	87	127.7 Å²	127.7	61%	0.608	74%	0.739	S	S	*	*				84.9	115.5	95.7	71.8	0	0	0	0	112.9
991	Y	29.6	Very low	31.3	Very low	224 Å²	224	129.8 Å²	129.8	88%	0.878	74%	0.738	S	S	*	*				-158.9	134	119.6	-91.7	-82.7	0	0	0	105.3
992	S	30.7	Very low	30.9	Very low	79 Å²	79	129.4 Å²	129.4	55%	0.552	75%	0.746	S	S	*	*			cis	172.9	136.7	-9.9	44.6	0	0	0	0	103.8
993	T	29.1	Very low	31	Very low	115 Å²	115	125.2 Å²	125.2	71%	0.706	74%	0.74	S	S	*	*			trans	46.6	126.4	134.9	60.7	0	0	0	0	118.3
994	Q	33.3	Very low	30.9	Very low	175 Å²	175	128.1 Å²	128.1	82%	0.818	75%	0.751	S	S	*	*				-179.9	150.6	66.1	-127.7	153.9	17.1	0	0	110.8
995	S	34	Very low	30.8	Very low	106 Å²	106	130.7 Å²	130.7	74%	0.741	75%	0.746	S	S	*	*			trans	65.3	107.5	158.3	55.4	0	0	0	0	118.4
996	S	32.7	Very low	30.8	Very low	116 Å²	116	133.7 Å²	133.7	81%	0.811	75%	0.752	S	S	*	*				52.5	147.6	60.3	-87.6	0	0	0	0	114.5
997	P	37.5	Very low	30.7	Very low	95 Å²	95	130.6 Å²	130.6	62%	0.617	74%	0.743	S	S	*	*			cis	-141.8	172.6	6.7	45.1	-28.2	0	0	0	115.9
998	N	35.3	Very low	30.9	Very low	143 Å²	143	133.9 Å²	133.9	77%	0.765	75%	0.746	S	S	*	*			trans	67.9	147.8	140.2	-62.5	-16.8	0	0	0	119.1
999	L	31.8	Very low	30.9	Very low	152 Å²	152	129 Å²	129	80%	0.796	74%	0.739	S	S	*	*			cis	-157.1	133	18.9	-158.5	68.4	0	0	0	109.5
1000	S	29.5	Very low	31	Very low	94 Å²	94	131.2 Å²	131.2	66%	0.657	75%	0.75	S	S	*	*			trans	-72.9	161.5	159.1	51.1	0	0	0	0	112.4
1001	R	27.2	Very low	31.4	Very low	232 Å²	232	131.6 Å²	131.6	88%	0.875	76%	0.758	S	S	*	*			trans	99.3	145.4	135.3	-145.6	174	-157.1	-168.3	3.7	119.3
1002	C	28.6	Very low	31.6	Very low	128 Å²	128	124.6 Å²	124.6	87%	0.865	75%	0.746	S	S	*	*			trans	82	129.5	168.4	-81.8	0	0	0	0	116
1003	G	32.4	Very low	31.6	Very low	66 Å²	66	129.4 Å²	129.4	68%	0.68	77%	0.765	S	S	*	*			cis	174.8	126.7	5	0	0	0	0	0	105.2
1004	S	28.3	Very low	31.9	Very low	118 Å²	118	126.9 Å²	126.9	83%	0.825	76%	0.761	S	S	*	*				65.2	134.6	96.8	-153.3	0	0	0	0	115.8
1005	K	31.2	Very low	31.8	Very low	185 Å²	185	125.9 Å²	125.9	80%	0.804	76%	0.762	S	S	*	*			trans	102.7	95	164.3	-60.4	-178.1	178.2	-177.5	0	115.7
1006	T	27.8	Very low	31.7	Very low	124 Å²	124	128.6 Å²	128.6	76%	0.761	77%	0.767	S	S	*	*				60.6	119	83.2	58	0	0	0	0	113.8
1007	S	29.7	Very low	31.7	Very low	89 Å²	89	128 Å²	128	62%	0.622	76%	0.763	S	S	*	*				145.8	135.9	109.9	-91.8	0	0	0	0	114.9
1008	H	32.9	Very low	31.3	Very low	172 Å²	172	133.9 Å²	133.9	80%	0.796	77%	0.773	S	S	*	*			trans	70	143.9	145.6	-64.4	-50.9	0	0	0	116.9
1009	V	32	Very low	31	Very low	122 Å²	122	135 Å²	135	74%	0.739	77%	0.771	S	S	*	*			cis	-166.7	152.6	11.1	126.3	0	0	0	0	109.4
1010	T	30	Very low	30.9	Very low	134 Å²	134	134.7 Å²	134.7	82%	0.822	77%	0.765	S	S	*	*			trans	-60.4	144.7	170.7	-9	0	0	0	0	114.7
1011	A	34.8	Very low	30.9	Very low	95 Å²	95	135.1 Å²	135.1	79%	0.785	77%	0.768	S	S	*	*			trans	170.7	144.8	142.4	0	0	0	0	0	107.6
1012	A	34.6	Very low	31.2	Very low	77 Å²	77	129.4 Å²	129.4	64%	0.636	76%	0.764	S	S	*	*			cis	171.4	140.6	-7.7	0	0	0	0	0	106.1
1013	L	31.8	Very low	31.3	Very low	180 Å²	180	127.8 Å²	127.8	94%	0.942	76%	0.76	S	S	*	*			trans	68.7	139	149.5	-59.1	155.1	0	0	0	118.1
1014	G	33.9	Very low	31.5	Very low	61 Å²	61	130.6 Å²	130.6	63%	0.629	77%	0.766	S	S	*	*			cis	177.3	128.3	1.6	0	0	0	0	0	104.9
1015	D	32.8	Very low	31.6	Very low	154 Å²	154	132.4 Å²	132.4	82%	0.824	77%	0.766	S	S	*	*				96.2	140.7	91.7	-113.8	-21.8	0	0	0	113.7
1016	L	31.7	Very low	31.7	Very low	163 Å²	163	131.6 Å²	131.6	85%	0.853	77%	0.766	S	S	*	*			trans	80.7	127.1	166.7	-59	152.6	0	0	0	117.3
1017	S	31.9	Very low	31.9	Very low	103 Å²	103	134.3 Å²	134.3	72%	0.72	77%	0.77	S	S	*	*			cis	141.7	142.2	-7.4	177.9	0	0	0	0	107.3
1018	R	29.5	Very low	32	Very low	219 Å²	219	133.3 Å²	133.3	83%	0.826	77%	0.773	S	S	*	*			trans	87.4	110.6	159.6	-128.4	164.9	-170.9	163.3	2.7	117.3
1019	K	28.6	Very low	31.8	Very low	167 Å²	167	136.2 Å²	136.2	73%	0.726	78%	0.777	S	S	*	*				55.2	135.6	76	-82.4	-176.7	160.4	-140.5	0	111.8
1020	E	30.3	Very low	31.8	Very low	145 Å²	145	135.8 Å²	135.8	68%	0.678	78%	0.775	S	S	*	*			cis	-169.8	147.8	26.2	-122.1	150.6	-178	0	0	109.3
1021	S	28.5	Very low	31.9	Very low	104 Å²	104	135.1 Å²	135.1	73%	0.727	77%	0.771	S	S	*	*			trans	36.6	145.4	135.5	-167.7	0	0	0	0	124.2
1022	S	33.1	Very low	31.9	Very low	111 Å²	111	138.5 Å²	138.5	78%	0.776	78%	0.776	S	S	*	*			trans	97.1	128.3	142.3	18.1	0	0	0	0	121.5
1023	A	31.4	Very low	31.7	Very low	95 Å²	95	141.3 Å²	141.3	79%	0.785	79%	0.785	S	S	*	*			trans	-60.4	175.5	174.1	0	0	0	0	0	113.5
1024	P	36.8	Very low	32	Very low	125 Å²	125	140 Å²	140	81%	0.812	78%	0.779	S	S	*	*			cis	-147.8	-172.7	46.4	38.4	-13.9	0	0	0	117.3
1025	D	30.6	Very low	32.5	Very low	155 Å²	155	143.1 Å²	143.1	83%	0.829	79%	0.786	S	S	*	*			trans	-54.9	168.1	-175.2	-71.3	-56.9	0	0	0	119.5
1026	Q	33.5	Very low	32.9	Very low	169 Å²	169	142.3 Å²	142.3	79%	0.79	78%	0.781	S	S	*	*			trans	107.4	108.5	146.8	-90.2	-178.1	-16.6	0	0	120
1027	E	31.9	Very low	33.1	Very low	180 Å²	180	144.6 Å²	144.6	84%	0.841	78%	0.779	S	S	*	*				88.4	128.7	122.4	-148	158.2	-146.4	0	0	119.1
1028	G	31.4	Very low	33.5	Very low	68 Å²	68	148.3 Å²	148.3	70%	0.701	78%	0.782	S	S	*	*			trans	130.3	70.2	158.7	0	0	0	0	0	118.7
1029	R	28.9	Very low	34.2	Very low	233 Å²	233	141.2 Å²	141.2	88%	0.879	77%	0.766	S	S	*	*			trans	21.1	116.9	130.8	-163.6	-168.2	-82.8	162.8	-4.1	118.3
1030	T	32.1	Very low	34.8	Very low	113 Å²	113	136.6 Å²	136.6	69%	0.693	76%	0.755	S	S	*	*				163.3	127.4	111.2	40.5	0	0	0	0	112.7
1031	T	32.2	Very low	35.5	Very low	120 Å²	120	134.7 Å²	134.7	74%	0.736	75%	0.748	S	S	*	*			trans	55.1	103.6	141.7	61.9	0	0	0	0	120.1
1032	D	34.2	Very low	36.4	Very low	166 Å²	166	132.7 Å²	132.7	89%	0.888	74%	0.738	S	S	*	*				-171.9	111.9	110.7	-111.8	-25.1	0	0	0	111.3
1033	T	31.4	Very low	37	Very low	136 Å²	136	131.9 Å²	131.9	83%	0.834	73%	0.728	S	S	*	*			trans	-102.4	91.2	179.5	48.3	0	0	0	0	109.4
1034	D	37.2	Very low	37.6	Very low	153 Å²	153	133.3 Å²	133.3	82%	0.818	72%	0.719	S	S	*	*	S	Bend	trans	-163.7	4.3	157	-120.6	-18.5	0	0	0	117
1035	V	44.5	Very low	37.9	Very low	126 Å²	126	133.2 Å²	133.2	76%	0.764	71%	0.711	S	S	*	*	S	Bend	trans	-112.4	-23.5	-174	-174.1	0	0	0	0	114.1	R1037	V1035-R1037 PolarHBondContact O-N 3.29Å
1036	D	40.9	Very low	38.6	Very low	137 Å²	137	128.8 Å²	128.8	73%	0.733	70%	0.695	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.1	-7.6	-176.4	-75.2	-38	0	0	0	115.7
1037	R	36.9	Very low	39.2	Very low	211 Å²	211	124.8 Å²	124.8	80%	0.796	68%	0.683	S	S	*	*	H	α-helix	trans	-81.8	-17.3	179.2	-148.7	173.2	-168.5	171.4	4.1	113.5	V1035 I1041	V1035-R1037 PolarHBondContact O-N 3.29Å; R1037-I1041 WeakPolarHBondContact O-CD1 3.34Å; R1037-I1041 WeakPolarHBondContact O-CG1 3.49Å
1038	K	39.5	Very low	39.6	Very low	182 Å²	182	121.5 Å²	121.5	79%	0.791	67%	0.669	S	S	*	*	H	α-helix	trans	-89.1	-23.5	180	-79.9	-177.5	176.7	175.6	0	114.1
1039	S	43.5	Very low	39.9	Very low	69 Å²	69	125.9 Å²	125.9	48%	0.483	67%	0.668	S	S	.	*	H	α-helix	trans	-84.5	-30.1	177.8	69.2	0	0	0	0	113.2	T1043	S1039-T1043 PolarHBondContact O-N 3.43Å; S1039-T1043 PolarHBondContact O-OG1 2.84Å
1040	S	41.8	Very low	40.5	Very low	71 Å²	71	121.2 Å²	121.2	50%	0.497	66%	0.661	S	S	.	*	H	α-helix	trans	-71.2	-37.8	176.9	-166.1	0	0	0	0	112.6	T1043 E1044	S1040-T1043 PolarHBondContact O-N 3.3Å; S1040-E1044 PolarHBondContact O-N 3.28Å; S1040-E1044 VanDerWaalsContact O-N 3.08Å
1041	I	46.2	Very low	40.9	Very low	105 Å²	105	124 Å²	124	54%	0.538	66%	0.663	S	S	.	*	H	α-helix	trans	-71.7	-32.9	177.2	-62.3	173.8	0	0	0	111.8	R1037 T1043 L1045	R1037-I1041 WeakPolarHBondContact O-CD1 3.34Å; R1037-I1041 WeakPolarHBondContact O-CG1 3.49Å; I1041-T1043 VanDerWaalsContact C-N 3.32Å; I1041-T1043 PolarHBondContact O-N 3.49Å; I1041-L1045 VanDerWaalsContact O-CB 3.3Å; I1041-L1045 WeakPolarHBondContact O-CB 3.33Å; I1041-L1045 PolarHBondContact O-N 3.01Å
1042	A	45.6	Very low	41.1	Very low	61 Å²	61	124.9 Å²	124.9	50%	0.504	66%	0.661	S	S	.	*	H	α-helix	trans	-69.6	-30.5	175.5	0	0	0	0	0	112.7	A1046	A1042-A1046 WeakPolarHBondContact O-CB 3.3Å; A1042-A1046 PolarHBondContact O-N 2.88Å
1043	T	46.4	Very low	41.3	Very low	95 Å²	95	121.7 Å²	121.7	58%	0.583	65%	0.647	S	S	*	*	H	α-helix	trans	-81.9	-32.6	179.8	-46.5	0	0	0	0	111.8	S1039 S1040 I1041 T1047	S1039-T1043 PolarHBondContact O-N 3.43Å; S1039-T1043 PolarHBondContact O-OG1 2.84Å; S1040-T1043 PolarHBondContact O-N 3.3Å; I1041-T1043 VanDerWaalsContact C-N 3.32Å; I1041-T1043 PolarHBondContact O-N 3.49Å; T1043-T1047 PolarHBondContact O-N 2.98Å; T1043-T1047 PolarHBondContact O-OG1 3.11Å
1044	E	44.2	Very low	41.4	Very low	125 Å²	125	118.2 Å²	118.2	58%	0.584	64%	0.639	S	S	*	*	H	α-helix	trans	-72.7	-33.6	169.9	-74.6	-164.3	150.9	0	0	113.1	S1040 T1047 M1048	S1040-E1044 PolarHBondContact O-N 3.28Å; S1040-E1044 VanDerWaalsContact O-N 3.08Å; E1044-T1047 WeakPolarHBondContact CA-OG1 3.38Å; E1044-T1047 PolarHBondContact O-N 3.49Å; E1044-T1047 PolarHBondContact O-OG1 3.18Å; E1044-T1047 VanDerWaalsContact O-OG1 3.13Å; E1044-M1048 PolarHBondContact O-N 3.48Å; E1044-M1048 VanDerWaalsContact O-N 3.1Å
1045	L	43.5	Very low	41.2	Very low	123 Å²	123	118.2 Å²	118.2	64%	0.644	64%	0.638	S	S	*	*	H	α-helix	trans	-72.7	-29.4	176.3	-150.4	75.7	0	0	0	112.6	I1041 K1049	I1041-L1045 VanDerWaalsContact O-CB 3.3Å; I1041-L1045 WeakPolarHBondContact O-CB 3.33Å; I1041-L1045 PolarHBondContact O-N 3.01Å; L1045-K1049 PolarHBondContact O-N 3.43Å
1046	A	44.7	Very low	40.6	Very low	61 Å²	61	118.1 Å²	118.1	50%	0.504	64%	0.638	S	S	.	*	H	α-helix	trans	-72.5	-34.7	173.8	0	0	0	0	0	112.7	A1042 K1049	A1042-A1046 WeakPolarHBondContact O-CB 3.3Å; A1042-A1046 PolarHBondContact O-N 2.88Å; A1046-K1049 PolarHBondContact O-N 3.31Å
1047	T	46.8	Very low	40.1	Very low	86 Å²	86	120.3 Å²	120.3	53%	0.528	64%	0.641	S	S	.	*	H	α-helix	trans	-79.3	-24	176.9	40.3	0	0	0	0	113.4	T1043 E1044 K1051	T1043-T1047 PolarHBondContact O-N 2.98Å; T1043-T1047 PolarHBondContact O-OG1 3.11Å; E1044-T1047 WeakPolarHBondContact CA-OG1 3.38Å; E1044-T1047 PolarHBondContact O-N 3.49Å; E1044-T1047 PolarHBondContact O-OG1 3.18Å; E1044-T1047 VanDerWaalsContact O-OG1 3.13Å; T1047-K1051 PolarHBondContact O-N 2.72Å
1048	M	40.4	Very low	39.8	Very low	111 Å²	111	118.5 Å²	118.5	55%	0.547	65%	0.645	S	S	.	*	H	α-helix	trans	-72.4	-31.2	168.4	-77.3	-165.6	-169	0	0	113	E1044 K1051 M1052	E1044-M1048 PolarHBondContact O-N 3.48Å; E1044-M1048 VanDerWaalsContact O-N 3.1Å; M1048-K1051 PolarHBondContact O-N 3.34Å; M1048-M1052 PolarHBondContact O-N 3.41Å
1049	K	37.9	Very low	39.3	Very low	159 Å²	159	117.2 Å²	117.2	69%	0.691	64%	0.642	S	S	*	*	H	α-helix	trans	-70.1	-31.1	178.6	-161.3	172.9	-177.9	177.4	0	113.1	L1045 A1046 T1053	L1045-K1049 PolarHBondContact O-N 3.43Å; A1046-K1049 PolarHBondContact O-N 3.31Å; K1049-T1053 PolarHBondContact O-N 3.21Å; K1049-T1053 PolarHBondContact O-OG1 2.89Å
1050	D	41.1	Very low	38.6	Very low	135 Å²	135	122.3 Å²	122.3	72%	0.722	66%	0.658	S	S	*	*	H	α-helix	trans	-78.3	-22.9	173.8	-102.9	11.2	0	0	0	113.4	T1053	D1050-T1053 PolarHBondContact O-OG1 2.74Å
1051	K	39.5	Very low	38.1	Very low	171 Å²	171	126.8 Å²	126.8	74%	0.743	68%	0.675	S	S	*	*	H	α-helix	trans	-85.9	-25.8	173.5	-78.6	-179	177.4	175.7	0	113.7	T1047 M1048	T1047-K1051 PolarHBondContact O-N 2.72Å; M1048-K1051 PolarHBondContact O-N 3.34Å
1052	M	37.1	Very low	37.4	Very low	140 Å²	140	127 Å²	127	69%	0.69	68%	0.683	S	S	*	*	H	α-helix	trans	-82	-18.3	176	-75.7	-174.9	-158.5	0	0	114.4	M1048 G1054	M1048-M1052 PolarHBondContact O-N 3.41Å; M1052-G1054 VanDerWaalsContact C-N 3.35Å
1053	T	37.9	Very low	36.4	Very low	98 Å²	98	129.6 Å²	129.6	60%	0.601	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.8	-6	177.3	38.6	0	0	0	0	113.8	K1049 D1050	K1049-T1053 PolarHBondContact O-N 3.21Å; K1049-T1053 PolarHBondContact O-OG1 2.89Å; D1050-T1053 PolarHBondContact O-OG1 2.74Å
1054	G	34.9	Very low	35.8	Very low	63 Å²	63	131.3 Å²	131.3	65%	0.649	71%	0.71	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.5	-6.9	176.7	0	0	0	0	0	116.3	M1052	M1052-G1054 VanDerWaalsContact C-N 3.35Å
1055	L	32.5	Very low	35.1	Very low	153 Å²	153	130.2 Å²	130.2	80%	0.801	72%	0.716	S	S	*	*	S	Bend	trans	-110.5	13.3	-171.8	-77.6	166.6	0	0	0	115
1056	T	32	Very low	34.6	Very low	125 Å²	125	130.2 Å²	130.2	77%	0.767	72%	0.721	S	S	*	*			trans	-111.2	64.4	170.2	37.8	0	0	0	0	111.1
1057	K	29.6	Very low	33.9	Very low	183 Å²	183	132.8 Å²	132.8	80%	0.796	74%	0.736	S	S	*	*			trans	-142.4	75.4	162	-132.7	177.1	-172.4	178.3	0	110	Q1059	K1057-Q1059 PolarHBondContact O-N 3.36Å
1058	I	30.2	Very low	33.2	Very low	172 Å²	172	134.4 Å²	134.4	88%	0.882	75%	0.748	S	S	*	*			trans	-70.3	109.7	160.9	-63.6	171.7	0	0	0	106
1059	Q	30.3	Very low	32.8	Very low	155 Å²	155	135.8 Å²	135.8	72%	0.724	76%	0.762	S	S	*	*			trans	-139.1	120.7	162.3	-151.9	167.4	-3.4	0	0	109.4	K1057	K1057-Q1059 PolarHBondContact O-N 3.36Å
1060	E	28.5	Very low	32.6	Very low	177 Å²	177	132.6 Å²	132.6	83%	0.827	76%	0.76	S	S	*	*			trans	-34.6	131.8	176	-61.6	162.7	150.1	0	0	114.2
1061	I	30.3	Very low	31.9	Very low	165 Å²	165	133.2 Å²	133.2	85%	0.846	76%	0.76	S	S	*	*			trans	-113.7	107.4	161.8	-58.6	177.3	0	0	0	107.6
1062	P	31.8	Very low	31.5	Very low	109 Å²	109	135.1 Å²	135.1	71%	0.708	76%	0.763	S	S	*	*			trans	-82.5	147.7	169.3	30.2	-26.2	0	0	0	111.2
1063	S	24.8	Very low	31.3	Very low	115 Å²	115	140.4 Å²	140.4	80%	0.804	78%	0.775	S	S	*	*			trans	-62.5	144.8	174.8	35.3	0	0	0	0	113.3
1064	P	33.3	Very low	31	Very low	132 Å²	132	141.2 Å²	141.2	86%	0.857	79%	0.785	S	S	*	*			trans	-105.9	119.8	170.3	33.5	-24.4	0	0	0	112.5
1065	S	30.9	Very low	30.7	Very low	102 Å²	102	149.9 Å²	149.9	71%	0.713	80%	0.798	S	S	*	*			trans	-95.2	144.2	158.9	50.3	0	0	0	0	110.7
1066	T	32.8	Very low	30.8	Very low	122 Å²	122	148 Å²	148	75%	0.748	80%	0.797	S	S	*	*			trans	65.3	106.1	149.4	51.6	0	0	0	0	121.6
1067	S	29.7	Very low	31	Very low	115 Å²	115	149.2 Å²	149.2	80%	0.804	80%	0.799	S	S	*	*				82.4	148	120.1	75.3	0	0	0	0	121.7
1068	P	31.1	Very low	31.1	Very low	121 Å²	121	152.3 Å²	152.3	79%	0.786	81%	0.805	S	S	*	*			trans	-115.9	151.6	-144.5	38.6	-25.6	0	0	0	115.2
1069	V	33.7	Very low	31.1	Very low	139 Å²	139	155.5 Å²	155.5	84%	0.842	81%	0.807	S	S	*	*			trans	-130.5	106.6	171.1	177.6	0	0	0	0	111.7
1070	S	31.8	Very low	31.6	Very low	93 Å²	93	157.4 Å²	157.4	65%	0.65	81%	0.812	S	S	*	*			trans	44.8	132.2	139.3	88.4	0	0	0	0	124.3
1071	M	28.4	Very low	31.9	Very low	147 Å²	147	158.6 Å²	158.6	72%	0.724	82%	0.815	S	S	*	*			trans	69.6	138.9	132.7	-78.9	-171.2	169	0	0	117.8
1072	R	31	Very low	32.3	Very low	212 Å²	212	157.4 Å²	157.4	80%	0.8	81%	0.81	S	S	*	*			cis	-174.8	159	23.8	-123.5	169	-161.2	-174.1	6.9	107.5
1073	R	31.9	Very low	32.5	Very low	250 Å²	250	158 Å²	158	94%	0.943	81%	0.814	S	S	*	*			trans	98.6	87	166.6	-70.2	-178.2	163.2	174.6	-4.2	117.4
1074	S	30.9	Very low	33.1	Very low	116 Å²	116	159.8 Å²	159.8	81%	0.811	81%	0.814	S	S	*	*				174.2	82.3	121.4	-175.3	0	0	0	0	108.2
1075	R	29.8	Very low	33.5	Very low	244 Å²	244	162 Å²	162	92%	0.921	82%	0.818	S	S	*	*			trans	-144.3	89.7	169.1	-85	-169.6	176.9	-170.8	-1	107.2
1076	S	34.6	Very low	33.8	Very low	113 Å²	113	168.9 Å²	168.9	79%	0.79	83%	0.828	S	S	*	*			trans	-142.4	14.6	176	66.9	0	0	0	0	116.2
1077	L	36.1	Very low	34.4	Very low	152 Å²	152	168.2 Å²	168.2	80%	0.796	82%	0.82	S	S	*	*	S	Bend	trans	-124.6	1.4	-176.1	-100.6	150.9	0	0	0	117.9
1078	W	30.4	Very low	35.2	Very low	247 Å²	247	168 Å²	168	94%	0.936	82%	0.816	S	S	*	*			trans	-130.4	33.5	-175	-76.4	104.5	0	0	0	116.5
1079	R	31.9	Very low	36	Very low	240 Å²	240	170 Å²	170	91%	0.906	82%	0.815	S	S	*	*			trans	-104	31.8	-176.3	-129.3	-166.3	-73.2	-174.6	0	116.2
1080	K	39.3	Very low	36.8	Very low	194 Å²	194	169.5 Å²	169.5	84%	0.843	81%	0.807	S	S	*	*	S	Bend	trans	-124.3	7.7	-174.6	-117.1	-178.8	-176.7	-177.8	0	118.5
1081	F	36.2	Very low	37.3	Very low	202 Å²	202	168.8 Å²	168.8	89%	0.886	80%	0.801	S	S	*	*	S	Bend	trans	-139.2	105	171.4	-80.5	-88.1	0	0	0	109.4
1082	D	37.5	Very low	38	Very low	140 Å²	140	170 Å²	170	75%	0.749	81%	0.805	S	S	*	*			trans	161.5	101	131.2	-158.3	-1	0	0	0	111
1083	P	35.8	Very low	38.5	Very low	122 Å²	122	170.3 Å²	170.3	79%	0.792	81%	0.806	S	S	*	*			trans	-106.8	78.1	177.6	36.3	-25.2	0	0	0	112
1084	L	38.7	Very low	38.8	Very low	153 Å²	153	169.3 Å²	169.3	80%	0.801	80%	0.803	S	S	*	*			trans	-142.2	8.1	172.1	-91	177.8	0	0	0	117.4
1085	L	40.5	Very low	39.4	Very low	177 Å²	177	172.3 Å²	172.3	93%	0.927	80%	0.801	S	S	*	*			trans	-130.5	78.6	-179	-75.9	162.5	0	0	0	112.4
1086	R	38.6	Very low	40	Very low	248 Å²	248	165.1 Å²	165.1	94%	0.936	79%	0.789	S	S	*	*			trans	-141.8	52.6	171.2	-151.4	-173.5	-74.1	-140.3	4	111.6
1087	N	44.2	Very low	40.1	Very low	107 Å²	107	169 Å²	169	57%	0.572	79%	0.792	S	S	*	*			trans	-119.2	110.5	169.2	-160.8	-16.9	0	0	0	111	E1089	N1087-E1089 VanDerWaalsContact C-N 3.3Å; N1087-E1089 PolarHBondContact O-N 3.42Å
1088	P	47.2	Very low	40	Very low	110 Å²	110	173.4 Å²	173.4	71%	0.714	80%	0.797	S	S	*	*	G	3₁₀ helix	trans	-67.6	-17	-175.8	-19.4	31.9	0	0	0	115.9	L1090 S1091	P1088-L1090 PolarHBondContact O-N 3.48Å; P1088-S1091 PolarHBondContact O-N 2.97Å
1089	E	47.5	Very low	40.4	Very low	165 Å²	165	166.7 Å²	166.7	77%	0.771	79%	0.788	S	S	*	*	G	3₁₀ helix	trans	-70.5	-26.7	-176.6	-77	-95.8	133.5	0	0	113.7	N1087 S1091	N1087-E1089 VanDerWaalsContact C-N 3.3Å; N1087-E1089 PolarHBondContact O-N 3.42Å; E1089-S1091 VanDerWaalsContact C-N 3.3Å; E1089-S1091 PolarHBondContact O-N 2.86Å
1090	L	49.4	Very low	40.5	Very low	128 Å²	128	166.9 Å²	166.9	67%	0.67	79%	0.789	S	S	*	*	G	3₁₀ helix	trans	-80.1	-10.2	-178.7	-82.7	154.4	0	0	0	113.7	P1088	P1088-L1090 PolarHBondContact O-N 3.48Å
1091	S	43.4	Very low	40.3	Very low	77 Å²	77	163.7 Å²	163.7	54%	0.538	79%	0.788	S	S	.	*	G	3₁₀ helix	trans	-83.1	-20.7	-176.5	-179.8	0	0	0	0	114.6	P1088 E1089	P1088-S1091 PolarHBondContact O-N 2.97Å; E1089-S1091 VanDerWaalsContact C-N 3.3Å; E1089-S1091 PolarHBondContact O-N 2.86Å
1092	Q	43	Very low	40.3	Very low	172 Å²	172	162.9 Å²	162.9	80%	0.804	79%	0.787	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.7	-29.4	-179.5	-88.5	-159.6	-25	0	0	113.3	W1094	Q1092-W1094 VanDerWaalsContact C-N 3.27Å; Q1092-W1094 PolarHBondContact O-N 2.76Å
1093	R	40.6	Very low	40.1	Very low	219 Å²	219	162.3 Å²	162.3	83%	0.826	79%	0.789	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.7	-14.1	-178.6	-130.2	172.9	179.2	179.4	-1	114.3
1094	W	39.2	Very low	40.1	Very low	229 Å²	229	163 Å²	163	87%	0.867	79%	0.791	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.3	-7.9	180	-104.7	74.1	0	0	0	114.7	Q1092	Q1092-W1094 VanDerWaalsContact C-N 3.27Å; Q1092-W1094 PolarHBondContact O-N 2.76Å
1095	K	43	Very low	39.9	Very low	179 Å²	179	167.4 Å²	167.4	78%	0.778	80%	0.797	S	S	*	*	S	Bend	trans	-89.5	-8.7	-177.8	-77.7	-177.7	176.5	178.4	0	114.9
1096	S	42.7	Very low	39.6	Very low	94 Å²	94	162.5 Å²	162.5	66%	0.657	79%	0.788	S	S	*	*	S	Bend	trans	-94.8	2.5	-176.9	66.3	0	0	0	0	115.6
1097	F	37.2	Very low	39.5	Very low	195 Å²	195	161.1 Å²	161.1	86%	0.855	79%	0.789	S	S	*	*			trans	-107.6	20.2	-169	-123.2	-88.2	0	0	0	115.6
1098	R	33.9	Very low	39.1	Very low	243 Å²	243	159.9 Å²	159.9	92%	0.917	79%	0.794	S	S	*	*			trans	-121.9	76.1	-175.1	-153.6	-175.1	-83.9	-162.7	-3.3	112
1099	S	38.8	Very low	38.9	Very low	106 Å²	106	159.6 Å²	159.6	74%	0.741	79%	0.79	S	S	*	*			trans	-153.4	119.8	162.9	60.2	0	0	0	0	112.8
1100	R	33.9	Very low	38.7	Very low	245 Å²	245	156.6 Å²	156.6	93%	0.925	79%	0.785	S	S	*	*			trans	77.7	122.9	163.9	-63.4	-172.4	179.6	-171.1	0.4	119.4
1101	P	35	Very low	38.7	Very low	126 Å²	126	156 Å²	156	82%	0.818	79%	0.787	S	S	*	*			trans	-99.7	136.8	177.7	36.7	-27.2	0	0	0	112
1102	E	35.9	Very low	38.7	Very low	186 Å²	186	157.8 Å²	157.8	87%	0.869	79%	0.79	S	S	*	*			trans	-155.7	129.5	154.6	-113.9	168.3	-158.7	0	0	109.8
1103	T	33.4	Very low	38.8	Very low	127 Å²	127	155.9 Å²	155.9	78%	0.779	78%	0.784	S	S	*	*			trans	8.1	122	161.9	49.6	0	0	0	0	119.4
1104	V	36.7	Very low	39.1	Very low	138 Å²	138	151.6 Å²	151.6	84%	0.836	78%	0.777	S	S	*	*				165.4	117.7	125.9	161.7	0	0	0	0	110.8
1105	R	34.4	Very low	39.4	Very low	245 Å²	245	150 Å²	150	93%	0.925	77%	0.771	S	S	*	*			trans	18.7	113.1	141.6	-140.4	176.9	-70.4	-173.8	-1	118.3
1106	G	34.6	Very low	39.8	Very low	73 Å²	73	144.7 Å²	144.7	75%	0.753	75%	0.754	S	S	*	*			trans	112.4	125.4	144.9	0	0	0	0	0	118.1
1107	K	35.9	Very low	40	Very low	219 Å²	219	142.7 Å²	142.7	95%	0.952	74%	0.743	S	S	*	*			trans	80.8	94	163.9	-57.2	-177.6	179.9	179.8	0	117
1108	A	34.5	Very low	40.9	Very low	81 Å²	81	136 Å²	136	67%	0.669	72%	0.723	S	S	*	*			trans	-103.3	135.5	159.9	0	0	0	0	0	110.6
1109	T	44.5	Very low	41.5	Very low	105 Å²	105	131.2 Å²	131.2	64%	0.644	71%	0.711	S	S	*	*			trans	-65.7	156	-169.1	0.7	0	0	0	0	114.5	T1111 L1112	T1109-T1111 PolarHBondContact O-N 3.47Å; T1109-L1112 PolarHBondContact O-N 3.15Å
1110	P	43.3	Very low	41.8	Very low	102 Å²	102	134.9 Å²	134.9	66%	0.662	71%	0.709	S	S	*	*	H	α-helix	trans	-64	-12.4	-167.6	-20	31.6	0	0	0	116.5
1111	T	49	Very low	42.8	Very low	114 Å²	114	129.4 Å²	129.4	70%	0.699	70%	0.697	S	S	*	*	H	α-helix	trans	-87.8	-16.9	-175.4	0.2	0	0	0	0	113.5	T1109	T1109-T1111 PolarHBondContact O-N 3.47Å
1112	L	43.7	Very low	43.6	Very low	116 Å²	116	128.5 Å²	128.5	61%	0.607	69%	0.685	S	S	*	*	H	α-helix	trans	-82.6	-32.4	176.9	-144.3	88.4	0	0	0	112	T1109 L1114 R1115 V1116	T1109-L1112 PolarHBondContact O-N 3.15Å; L1112-L1114 PolarHBondContact O-N 3.39Å; L1112-R1115 PolarHBondContact O-N 2.91Å; L1112-V1116 WeakPolarHBondContact O-CG2 3.32Å; L1112-V1116 PolarHBondContact O-N 2.98Å; L1112-V1116 VanDerWaalsContact O-N 3.08Å
1113	L	44	Very low	44.2	Very low	131 Å²	131	122.3 Å²	122.3	69%	0.686	67%	0.667	S	S	*	*	H	α-helix	trans	-65.4	-36.2	177.7	-88.6	159.6	0	0	0	112.7	A1117	L1113-A1117 VanDerWaalsContact O-CB 3.23Å; L1113-A1117 WeakPolarHBondContact O-CB 3.23Å; L1113-A1117 PolarHBondContact O-N 3.02Å
1114	L	47.5	Very low	45.2	Very low	130 Å²	130	120.2 Å²	120.2	68%	0.681	65%	0.653	S	S	*	*	H	α-helix	trans	-71.6	-32.6	176.9	-85.3	159	0	0	0	113.2	L1112 A1118	L1112-L1114 PolarHBondContact O-N 3.39Å; L1114-A1118 WeakPolarHBondContact O-CB 3.33Å; L1114-A1118 PolarHBondContact O-N 2.99Å
1115	R	45.7	Very low	45.9	Very low	194 Å²	194	122.5 Å²	122.5	73%	0.732	65%	0.647	S	S	*	*	H	α-helix	trans	-73.8	-40.2	175	-110.9	-177.7	-174.8	171.2	2.5	112.4	L1112 A1117 A1118 E1119	L1112-R1115 PolarHBondContact O-N 2.91Å; R1115-A1117 VanDerWaalsContact C-N 3.34Å; R1115-A1118 PolarHBondContact O-N 3.48Å; R1115-E1119 PolarHBondContact O-N 3.36Å
1116	V	51.2	Low	47.1	Very low	69 Å²	69	117.9 Å²	117.9	42%	0.418	64%	0.636	S	S	.	*	H	α-helix	trans	-68.5	-34.5	174.6	176.1	0	0	0	0	111	L1112 R1120	L1112-V1116 WeakPolarHBondContact O-CG2 3.32Å; L1112-V1116 PolarHBondContact O-N 2.98Å; L1112-V1116 VanDerWaalsContact O-N 3.08Å; V1116-R1120 HydrophobicContact CG1-CG 4.47Å; V1116-R1120 VanDerWaalsContact O-CB 3.31Å; V1116-R1120 WeakPolarHBondContact O-CB 3.45Å; V1116-R1120 VanDerWaalsContact O-CG 3.31Å; V1116-R1120 WeakPolarHBondContact O-CG 3.27Å; V1116-R1120 PolarHBondContact O-N 3.28Å
1117	A	47.2	Very low	48.1	Very low	52 Å²	52	119.6 Å²	119.6	43%	0.43	62%	0.623	S	S	.	*	H	α-helix	trans	-66	-38.9	172.4	0	0	0	0	0	112.5	L1113 R1115 L1121	L1113-A1117 VanDerWaalsContact O-CB 3.23Å; L1113-A1117 WeakPolarHBondContact O-CB 3.23Å; L1113-A1117 PolarHBondContact O-N 3.02Å; R1115-A1117 VanDerWaalsContact C-N 3.34Å; A1117-L1121 WeakPolarHBondContact O-CB 3.3Å; A1117-L1121 PolarHBondContact O-N 3.47Å
1118	A	55.8	Low	49.1	Very low	54 Å²	54	114.2 Å²	114.2	45%	0.446	60%	0.604	S	S	.	*	H	α-helix	trans	-70.3	-44.3	177.1	0	0	0	0	0	112.8	L1114 R1115 R1120 L1121 D1122	L1114-A1118 WeakPolarHBondContact O-CB 3.33Å; L1114-A1118 PolarHBondContact O-N 2.99Å; R1115-A1118 PolarHBondContact O-N 3.48Å; A1118-R1120 VanDerWaalsContact C-N 3.32Å; A1118-R1120 PolarHBondContact O-N 3.38Å; A1118-L1121 PolarHBondContact O-N 3.36Å; A1118-D1122 PolarHBondContact O-N 2.96Å
1119	E	47.1	Very low	50.1	Low	142 Å²	142	115.3 Å²	115.3	66%	0.664	60%	0.598	S	S	*	*	H	α-helix	trans	-66.9	-32.9	176.3	-76.8	-179.7	168.4	0	0	112.2	R1115 A1123	R1115-E1119 PolarHBondContact O-N 3.36Å; E1119-A1123 PolarHBondContact O-N 3.33Å
1120	R	43.9	Very low	50.6	Low	184 Å²	184	117.3 Å²	117.3	69%	0.694	60%	0.6	S	S	*	*	H	α-helix	trans	-74	-26.7	172.2	-71.6	-155.8	177.3	-149.9	-0.5	113.2	V1116 A1118 V1124	V1116-R1120 HydrophobicContact CG1-CG 4.47Å; V1116-R1120 VanDerWaalsContact O-CB 3.31Å; V1116-R1120 WeakPolarHBondContact O-CB 3.45Å; V1116-R1120 VanDerWaalsContact O-CG 3.31Å; V1116-R1120 WeakPolarHBondContact O-CG 3.27Å; V1116-R1120 PolarHBondContact O-N 3.28Å; A1118-R1120 VanDerWaalsContact C-N 3.32Å; A1118-R1120 PolarHBondContact O-N 3.38Å; R1120-V1124 WeakPolarHBondContact O-CB 3.49Å; R1120-V1124 WeakPolarHBondContact O-CG2 3.36Å; R1120-V1124 PolarHBondContact O-N 3.14Å
1121	L	55.2	Low	50.6	Low	130 Å²	130	119.6 Å²	119.6	68%	0.681	60%	0.596	S	S	*	*	H	α-helix	trans	-69.1	-38.3	173.7	-127.2	88.4	0	0	0	112.2	A1117 A1118 V1124 R1125	A1117-L1121 WeakPolarHBondContact O-CB 3.3Å; A1117-L1121 PolarHBondContact O-N 3.47Å; A1118-L1121 PolarHBondContact O-N 3.36Å; L1121-V1124 PolarHBondContact O-N 2.81Å; L1121-R1125 WeakPolarHBondContact O-CB 3.32Å; L1121-R1125 PolarHBondContact O-N 3.48Å
1122	D	52.5	Low	50.5	Low	106 Å²	106	117.4 Å²	117.4	57%	0.567	59%	0.585	S	S	*	*	H	α-helix	trans	-69.7	-37.4	176.7	-82.3	-22.2	0	0	0	112.1	A1118 R1125 Q1126	A1118-D1122 PolarHBondContact O-N 2.96Å; D1122-R1125 PolarHBondContact O-N 3.48Å; D1122-Q1126 PolarHBondContact O-N 3.2Å
1123	A	48.2	Very low	50.7	Low	57 Å²	57	118.4 Å²	118.4	47%	0.471	59%	0.585	S	S	.	*	H	α-helix	trans	-65.1	-40.3	173	0	0	0	0	0	112.1	E1119 R1125 Q1126 F1127	E1119-A1123 PolarHBondContact O-N 3.33Å; A1123-R1125 VanDerWaalsContact C-N 3.31Å; A1123-R1125 PolarHBondContact O-N 2.91Å; A1123-Q1126 PolarHBondContact O-N 3.26Å; A1123-F1127 WeakPolarHBondContact O-CB 3.13Å; A1123-F1127 PolarHBondContact O-N 2.85Å
1124	V	54.5	Low	50.6	Low	82 Å²	82	117.5 Å²	117.5	50%	0.497	58%	0.577	S	S	.	*	H	α-helix	trans	-65.4	-35.8	173.5	170.8	0	0	0	0	110.9	R1120 L1121 F1127 L1128	R1120-V1124 WeakPolarHBondContact O-CB 3.49Å; R1120-V1124 WeakPolarHBondContact O-CG2 3.36Å; R1120-V1124 PolarHBondContact O-N 3.14Å; L1121-V1124 PolarHBondContact O-N 2.81Å; V1124-F1127 PolarHBondContact O-N 3.17Å; V1124-L1128 HydrophobicContact CG1-CD1 3.92Å; V1124-L1128 HydrophobicContact CG1-CG 4.35Å; V1124-L1128 WeakPolarHBondContact O-CB 3.46Å; V1124-L1128 VanDerWaalsContact O-CG 3.23Å; V1124-L1128 WeakPolarHBondContact O-CG 3.36Å; V1124-L1128 PolarHBondContact O-N 2.87Å
1125	R	51.1	Low	50.1	Low	186 Å²	186	115 Å²	115	70%	0.702	57%	0.569	S	S	*	*	H	α-helix	trans	-69.5	-41	178.1	-156.6	175	-169.4	164.7	3.8	112.6	L1121 D1122 A1123 L1128 D1129	L1121-R1125 WeakPolarHBondContact O-CB 3.32Å; L1121-R1125 PolarHBondContact O-N 3.48Å; D1122-R1125 PolarHBondContact O-N 3.48Å; A1123-R1125 VanDerWaalsContact C-N 3.31Å; A1123-R1125 PolarHBondContact O-N 2.91Å; R1125-L1128 PolarHBondContact O-N 3.44Å; R1125-D1129 PolarHBondContact O-N 3.41Å; R1125-D1129 VanDerWaalsContact O-N 3.08Å
1126	Q	60	Low	50	Low	148 Å²	148	109 Å²	109	69%	0.692	56%	0.561	S	S	*	*	H	α-helix	trans	-63.8	-42.6	172.5	-83.7	-174.8	-31.5	0	0	111.9	D1122 A1123 L1128 D1129 E1130	D1122-Q1126 PolarHBondContact O-N 3.2Å; A1123-Q1126 PolarHBondContact O-N 3.26Å; Q1126-L1128 PolarHBondContact O-N 3Å; Q1126-D1129 PolarHBondContact O-N 3.45Å; Q1126-E1130 PolarHBondContact O-N 3.36Å
1127	F	55.2	Low	49.6	Very low	110 Å²	110	112.7 Å²	112.7	48%	0.482	57%	0.574	S	S	.	*	H	α-helix	trans	-62.8	-39.6	176.6	-175.2	-100.3	0	0	0	112.5	A1123 V1124 R1131	A1123-F1127 WeakPolarHBondContact O-CB 3.13Å; A1123-F1127 PolarHBondContact O-N 2.85Å; V1124-F1127 PolarHBondContact O-N 3.17Å; F1127-R1131 WeakPolarHBondContact O-CB 3.33Å; F1127-R1131 PolarHBondContact O-N 3.5Å
1128	L	56.1	Low	49.2	Very low	106 Å²	106	115.2 Å²	115.2	56%	0.555	58%	0.58	S	S	*	*	H	α-helix	trans	-68.4	-34.7	175.9	-72.4	170.8	0	0	0	112.8	V1124 R1125 Q1126 S1132	V1124-L1128 HydrophobicContact CG1-CD1 3.92Å; V1124-L1128 HydrophobicContact CG1-CG 4.35Å; V1124-L1128 WeakPolarHBondContact O-CB 3.46Å; V1124-L1128 VanDerWaalsContact O-CG 3.23Å; V1124-L1128 WeakPolarHBondContact O-CG 3.36Å; V1124-L1128 PolarHBondContact O-N 2.87Å; R1125-L1128 PolarHBondContact O-N 3.44Å; Q1126-L1128 PolarHBondContact O-N 3Å; L1128-S1132 WeakPolarHBondContact O-CB 3.18Å; L1128-S1132 PolarHBondContact O-N 2.89Å
1129	D	55.9	Low	48.4	Very low	104 Å²	104	117 Å²	117	56%	0.556	59%	0.59	S	S	*	*	H	α-helix	trans	-71.3	-40.4	178.7	-131.5	36.9	0	0	0	111.6	R1125 Q1126 S1132 K1133	R1125-D1129 PolarHBondContact O-N 3.41Å; R1125-D1129 VanDerWaalsContact O-N 3.08Å; Q1126-D1129 PolarHBondContact O-N 3.45Å; D1129-S1132 PolarHBondContact O-N 3.04Å; D1129-S1132 PolarHBondContact O-OG 2.87Å; D1129-K1133 PolarHBondContact O-N 2.87Å
1130	E	54.7	Low	48.1	Very low	147 Å²	147	113.7 Å²	113.7	69%	0.687	59%	0.587	S	S	*	*	H	α-helix	trans	-65.4	-41.3	173.1	-107.9	167.5	178.2	0	0	112	Q1126 S1132 K1133 Q1134	Q1126-E1130 PolarHBondContact O-N 3.36Å; E1130-S1132 VanDerWaalsContact C-N 3.33Å; E1130-S1132 PolarHBondContact O-N 3.07Å; E1130-K1133 PolarHBondContact O-N 3.01Å; E1130-Q1134 PolarHBondContact O-N 3.16Å; E1130-Q1134 VanDerWaalsContact O-N 3.09Å
1131	R	44.1	Very low	47.7	Very low	150 Å²	150	113.4 Å²	113.4	57%	0.566	59%	0.593	S	S	*	*	H	α-helix	trans	-69	-30.5	177	-145.7	175	-169.4	174	4.1	112.5	F1127 K1133 Q1134 C1135	F1127-R1131 WeakPolarHBondContact O-CB 3.33Å; F1127-R1131 PolarHBondContact O-N 3.5Å; R1131-K1133 VanDerWaalsContact C-N 3.32Å; R1131-K1133 PolarHBondContact O-N 3.44Å; R1131-Q1134 PolarHBondContact O-N 3.23Å; R1131-C1135 WeakPolarHBondContact O-CB 3.41Å; R1131-C1135 PolarHBondContact O-N 3.09Å; R1131-C1135 PolarHBondContact O-SG 3.36Å
1132	S	47.9	Very low	46.6	Very low	68 Å²	68	113 Å²	113	48%	0.476	60%	0.596	S	S	.	*	H	α-helix	trans	-66.3	-32.9	173.8	82.5	0	0	0	0	112.9	L1128 D1129 E1130 A1136	L1128-S1132 WeakPolarHBondContact O-CB 3.18Å; L1128-S1132 PolarHBondContact O-N 2.89Å; D1129-S1132 PolarHBondContact O-N 3.04Å; D1129-S1132 PolarHBondContact O-OG 2.87Å; E1130-S1132 VanDerWaalsContact C-N 3.33Å; E1130-S1132 PolarHBondContact O-N 3.07Å; S1132-A1136 WeakPolarHBondContact O-CB 3.42Å; S1132-A1136 PolarHBondContact O-N 2.99Å
1133	K	46.5	Very low	45.5	Very low	137 Å²	137	113.8 Å²	113.8	60%	0.596	61%	0.607	S	S	*	*	H	α-helix	trans	-75.1	-41.2	175.7	-71	178	-178.4	174.1	0	111.6	D1129 E1130 R1131 A1136 E1137	D1129-K1133 PolarHBondContact O-N 2.87Å; E1130-K1133 PolarHBondContact O-N 3.01Å; R1131-K1133 VanDerWaalsContact C-N 3.32Å; R1131-K1133 PolarHBondContact O-N 3.44Å; K1133-A1136 PolarHBondContact O-N 3.28Å; K1133-E1137 PolarHBondContact O-N 3.48Å
1134	Q	41.9	Very low	44.6	Very low	111 Å²	111	116.4 Å²	116.4	52%	0.519	62%	0.621	S	S	.	*	H	α-helix	trans	-63.5	-42.6	175.8	-153.4	75.5	33.8	0	0	111.6	E1130 R1131 A1136 E1137 D1138	E1130-Q1134 PolarHBondContact O-N 3.16Å; E1130-Q1134 VanDerWaalsContact O-N 3.09Å; R1131-Q1134 PolarHBondContact O-N 3.23Å; Q1134-A1136 VanDerWaalsContact C-N 3.28Å; Q1134-A1136 PolarHBondContact O-N 3.1Å; Q1134-E1137 PolarHBondContact O-N 3.37Å; Q1134-D1138 PolarHBondContact O-N 3.19Å; Q1134-D1138 VanDerWaalsContact O-N 3.11Å
1135	C	37.1	Very low	43.7	Very low	77 Å²	77	118.3 Å²	118.3	52%	0.52	64%	0.635	S	S	.	*	H	α-helix	trans	-69.3	-21	176.3	-69.3	0	0	0	0	114	R1131 S1139	R1131-C1135 WeakPolarHBondContact O-CB 3.41Å; R1131-C1135 PolarHBondContact O-N 3.09Å; R1131-C1135 PolarHBondContact O-SG 3.36Å; C1135-S1139 WeakPolarHBondContact O-CB 3.29Å; C1135-S1139 PolarHBondContact O-OG 2.91Å
1136	A	43.6	Very low	42.6	Very low	69 Å²	69	115 Å²	115	57%	0.57	64%	0.638	S	S	*	*	H	α-helix	trans	-80	-21.2	174.6	0	0	0	0	0	113	S1132 K1133 Q1134	S1132-A1136 WeakPolarHBondContact O-CB 3.42Å; S1132-A1136 PolarHBondContact O-N 2.99Å; K1133-A1136 PolarHBondContact O-N 3.28Å; Q1134-A1136 VanDerWaalsContact C-N 3.28Å; Q1134-A1136 PolarHBondContact O-N 3.1Å
1137	E	43	Very low	41.3	Very low	146 Å²	146	114 Å²	114	68%	0.682	65%	0.645	S	S	*	*	H	α-helix	trans	-91.6	-32.7	175.9	-73.3	178.2	165	0	0	112.2	K1133 Q1134	K1133-E1137 PolarHBondContact O-N 3.48Å; Q1134-E1137 PolarHBondContact O-N 3.37Å
1138	D	39.5	Very low	40.4	Very low	105 Å²	105	113.4 Å²	113.4	56%	0.561	66%	0.66	S	S	*	*	H	α-helix	trans	-79.7	-14.5	178.7	-71.7	-29.5	0	0	0	114.1	Q1134 A1140	Q1134-D1138 PolarHBondContact O-N 3.19Å; Q1134-D1138 VanDerWaalsContact O-N 3.11Å; D1138-A1140 VanDerWaalsContact C-N 3.27Å; D1138-A1140 PolarHBondContact O-N 3.16Å
1139	S	39.1	Very low	39.7	Very low	92 Å²	92	115.7 Å²	115.7	64%	0.643	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.9	4.3	178.1	42.3	0	0	0	0	114.5	C1135	C1135-S1139 WeakPolarHBondContact O-CB 3.29Å; C1135-S1139 PolarHBondContact O-OG 2.91Å
1140	A	39.9	Very low	39.1	Very low	73 Å²	73	118.9 Å²	118.9	60%	0.603	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.2	-11.9	173.9	0	0	0	0	0	114.1	D1138	D1138-A1140 VanDerWaalsContact C-N 3.27Å; D1138-A1140 PolarHBondContact O-N 3.16Å
1141	H	35.3	Very low	38.7	Very low	177 Å²	177	115 Å²	115	82%	0.819	67%	0.672	S	S	*	*	S	Bend	trans	-150	89.7	-180	-74.6	-49.3	0	0	0	112.3
1142	T	31.9	Very low	38.5	Very low	123 Å²	123	113.9 Å²	113.9	76%	0.755	68%	0.682	S	S	*	*			trans	-157	134	160	2.4	0	0	0	0	112.2
1143	P	31	Very low	38.2	Very low	122 Å²	122	114.7 Å²	114.7	79%	0.792	69%	0.687	S	S	*	*	P	Polyproline II helix	trans	-81.3	161.6	176.2	19.2	-5.3	0	0	0	112.5
1144	S	28.8	Very low	37.7	Very low	111 Å²	111	112.1 Å²	112.1	78%	0.776	69%	0.686	S	S	*	*	P	Polyproline II helix	trans	-47.7	144.8	-175.2	48.5	0	0	0	0	116.9
1145	P	34.2	Very low	37.5	Very low	122 Å²	122	114.7 Å²	114.7	79%	0.792	70%	0.698	S	S	*	*	P	Polyproline II helix	trans	-78.4	154.6	174.8	33	-33.1	0	0	0	112.9
1146	P	29.2	Very low	37.1	Very low	117 Å²	117	116.2 Å²	116.2	76%	0.76	72%	0.716	S	S	*	*	P	Polyproline II helix	trans	-76.9	163.8	176.2	33.8	-33.4	0	0	0	111.9
1147	P	31.8	Very low	36.4	Very low	128 Å²	128	117.3 Å²	117.3	83%	0.831	73%	0.725	S	S	*	*	P	Polyproline II helix	trans	-72.1	132.7	-172.4	30.1	-33.3	0	0	0	111.4
1148	A	37.1	Very low	35.5	Very low	97 Å²	97	114.7 Å²	114.7	80%	0.802	73%	0.729	S	S	*	*	P	Polyproline II helix	trans	-82.6	131.8	172.8	0	0	0	0	0	110.2	E1150	A1148-E1150 PolarHBondContact O-N 3.21Å
1149	D	41.5	Very low	35.1	Very low	153 Å²	153	116.5 Å²	116.5	82%	0.818	74%	0.738	S	S	*	*	P	Polyproline II helix	trans	-58.1	119.5	176.3	-65.7	-45.7	0	0	0	110.9
1150	E	42.1	Very low	34.4	Very low	171 Å²	171	118.6 Å²	118.6	80%	0.799	75%	0.747	S	S	*	*	P	Polyproline II helix	trans	-63.6	139	173.5	-90.2	-176.8	145	0	0	110.9	A1148 T1152	A1148-E1150 PolarHBondContact O-N 3.21Å; E1150-T1152 PolarHBondContact O-N 3.25Å
1151	P	47.1	Very low	33.9	Very low	67 Å²	67	121.6 Å²	121.6	44%	0.435	76%	0.758	S	S	.	*			trans	-68.2	101.7	170.9	26.5	-30.2	0	0	0	109.6	A814 F816	A814-P1151 HydrophobicContact CB-CG 4.48Å; F816-P1151 HydrophobicContact CZ-CB 4.46Å
1152	T	40.8	Very low	33.4	Very low	125 Å²	125	119.1 Å²	119.1	77%	0.767	76%	0.761	S	S	*	*			trans	-64.5	131.4	178.5	43.8	0	0	0	0	112.1	E1150	E1150-T1152 PolarHBondContact O-N 3.25Å
1153	S	40.5	Very low	33.3	Very low	85 Å²	85	116.2 Å²	116.2	59%	0.594	76%	0.755	S	S	*	*			trans	28.6	132.3	162.3	51	0	0	0	0	120.2	E1155	S1153-E1155 PolarHBondContact O-N 2.97Å
1154	C	36.9	Very low	33	Very low	84 Å²	84	122.4 Å²	122.4	57%	0.568	76%	0.762	S	S	*	*			trans	-59.1	69.5	164.7	-94.4	0	0	0	0	111.3	C736	C736-C1154 HydrophobicContact CB-CB 4.3Å; C736-C1154 WeakPolarHBondContact CB-SG 3.39Å; C736-C1154 WeakPolarHBondContact SG-CB 3.29Å; C736-C1154 CovalentContact SG-SG 2.09Å; C736-C1154 PolarHBondContact SG-SG 3.38Å
1155	E	37.4	Very low	33.1	Very low	165 Å²	165	123.5 Å²	123.5	77%	0.771	76%	0.764	S	S	*	*			trans	-98.8	125.5	170	-87.3	-174.6	148.6	0	0	110.2	S1153 A1157	S1153-E1155 PolarHBondContact O-N 2.97Å; E1155-A1157 PolarHBondContact O-N 2.72Å
1156	A	29.4	Very low	32.8	Very low	109 Å²	109	129.3 Å²	129.3	90%	0.901	77%	0.771	S	S	*	*			trans	-69.4	89.7	-180	0	0	0	0	0	110.6	A1158	A1156-A1158 PolarHBondContact O-N 3.08Å
1157	A	27.4	Very low	32.7	Very low	92 Å²	92	133.8 Å²	133.8	76%	0.76	78%	0.778	S	S	*	*			trans	-89.7	89.4	167.8	0	0	0	0	0	109.7	E1155 D1159	E1155-A1157 PolarHBondContact O-N 2.72Å; A1157-D1159 PolarHBondContact O-N 3.03Å
1158	A	25.3	Very low	32.7	Very low	91 Å²	91	131 Å²	131	75%	0.752	77%	0.772	S	S	*	*			trans	-76.2	94.9	159.2	0	0	0	0	0	107.9	A1156	A1156-A1158 PolarHBondContact O-N 3.08Å
1159	D	30.2	Very low	32.4	Very low	143 Å²	143	131.4 Å²	131.4	77%	0.765	77%	0.767	S	S	*	*			trans	-138.6	96.5	169.4	-89.8	-39	0	0	0	113.2	A1157 V1161	A1157-D1159 PolarHBondContact O-N 3.03Å; D1159-V1161 PolarHBondContact O-N 2.96Å
1160	T	24.9	Very low	31.8	Very low	135 Å²	135	134.3 Å²	134.3	83%	0.828	77%	0.768	S	S	*	*			trans	-4.5	101	138.1	-20.1	0	0	0	0	116.5
1161	V	29.4	Very low	31.2	Very low	137 Å²	137	136 Å²	136	83%	0.83	77%	0.773	S	S	*	*			trans	-133.4	107.9	151.1	-178.1	0	0	0	0	110.1	D1159 G1163	D1159-V1161 PolarHBondContact O-N 2.96Å; V1161-G1163 PolarHBondContact O-N 3.43Å
1162	S	25.4	Very low	30.5	Very low	125 Å²	125	138.9 Å²	138.9	87%	0.874	79%	0.789	S	S	*	*			trans	-57.9	107.6	167	179.2	0	0	0	0	110.1
1163	G	28.7	Very low	29.9	Very low	62 Å²	62	139.9 Å²	139.9	64%	0.639	79%	0.789	S	S	*	*			trans	-141	91.1	179.2	0	0	0	0	0	110.8	V1161 V1165	V1161-G1163 PolarHBondContact O-N 3.43Å; G1163-V1165 PolarHBondContact O-N 3.46Å; G1163-V1165 VanDerWaalsContact O-N 3.08Å
1164	R	25.5	Very low	29.2	Very low	251 Å²	251	146.4 Å²	146.4	95%	0.947	80%	0.802	S	S	*	*			trans	-59.6	98.5	-175.9	-171.7	-174.3	-82.6	173.5	-7.8	111.8
1165	V	29.4	Very low	28.9	Very low	135 Å²	135	149.5 Å²	149.5	82%	0.818	81%	0.812	S	S	*	*			trans	-110.2	122.2	168.3	-178.1	0	0	0	0	110.8	G1163 K1167	G1163-V1165 PolarHBondContact O-N 3.46Å; G1163-V1165 VanDerWaalsContact O-N 3.08Å; V1165-K1167 PolarHBondContact O-N 3.22Å
1166	R	29.3	Very low	28.4	Very low	244 Å²	244	154.7 Å²	154.7	92%	0.921	83%	0.832	S	S	*	*			trans	-59.9	123.2	180	-77.9	177.6	177.9	173.9	-0.4	111.2
1167	K	27.3	Very low	28.4	Very low	210 Å²	210	157 Å²	157	91%	0.913	83%	0.829	S	S	*	*			trans	-68.2	123.6	163.1	-71.7	-179.9	175.1	178.4	0	109.8	V1165	V1165-K1167 PolarHBondContact O-N 3.22Å
1168	G	30.4	Very low	28.5	Very low	69 Å²	69	160.4 Å²	160.4	71%	0.711	83%	0.832	S	S	*	*			trans	-115.1	123.8	159.6	0	0	0	0	0	108.7
1169	P	31.1	Very low	28.6	Very low	106 Å²	106	164.2 Å²	164.2	69%	0.688	84%	0.837	S	S	*	*			trans	-102.1	104	-169.2	34.8	-25.7	0	0	0	111.2
1170	Y	29.9	Very low	28.5	Very low	215 Å²	215	165.5 Å²	165.5	84%	0.843	84%	0.841	S	S	*	*			trans	-153.1	105.1	162	-67.7	-74.7	0	0	0	109.7
1171	F	29.5	Very low	28.8	Very low	207 Å²	207	167.4 Å²	167.4	91%	0.908	84%	0.842	S	S	*	*				-175.5	103.8	122.3	-113.1	-86.5	0	0	0	109.4
1172	T	31.8	Very low	28.7	Very low	127 Å²	127	169.4 Å²	169.4	78%	0.779	84%	0.843	S	S	*	*			trans	-65.6	134.8	171.5	-51	0	0	0	0	110
1173	L	27.9	Very low	29	Very low	145 Å²	145	172.6 Å²	172.6	76%	0.759	84%	0.84	S	S	*	*			trans	-38.2	129.4	167.5	-106.5	74.8	0	0	0	113.2
1174	Y	27.2	Very low	29	Very low	222 Å²	222	181.1 Å²	181.1	87%	0.871	86%	0.856	S	S	*	*			trans	-125.7	103.3	145.1	-98.3	-90.1	0	0	0	107.7
1175	I	30	Very low	29.3	Very low	150 Å²	150	175.3 Å²	175.3	77%	0.769	85%	0.848	S	S	*	*			trans	-114.9	98.8	154.8	-66.1	178.7	0	0	0	105.3
1176	F	27.5	Very low	29.3	Very low	273 Å²	273	178.9 Å²	178.9	100%	1.197	85%	0.851	S	S	*	*			trans	-159.2	0	142.1	-108.4	-72	0	0	0	107.8

Retrieved 1,176 of 1,176 residues in 1412.6 ms (Link to these results)

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