A0A077YYA2_TRITR Loading...

Exocyst complex component 5

AlphaFold DB , UniProt , Accession A0A077YYA2, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 1,194 aa.

						>A0A077YYA2_TRITR|A0A077YYA2
MLRTYAEDLQSDAFNPEEYVERLAWRLTGSTSSCSLDASYLASAMEEEVSNLQILFDQCTTKVEGLENQRREEEESYYASLEKLLAANEISRRLLPRTPLAASAKVAELSEKVSSVSARIVHLGDQLQSVTGPRARAYEAFKLMTHFNEFLSDQPLESDTFTDPDKLVEAGDVVQKLQMIAAELPKEKYEAVQSRIAYKYDEVEKMLIEEFVRYHHANAKNKMKQVAHVLSQFKGYGQCIDAFIDQCQWQTYRSDDMFNEIWLLLKKNDAIISEVFPNPQQVMSKLILSIFGGKLRDEVDKKLSATADMETYLTSLCDLYQKTKKLVDQLFTLNNCPDKDFRTVLVDTVFSKYLADYIKKETVYLREQCKFALQKFYDSKGHTKKTGFSGIQARLSLESRCNESLLSEEVAINILQETKQAFYRCSLLSSMVSMVENVRQILSILTQYLCHEHVEYAIDVALSAVPTQEGHGSTDFAFLNLLRQAAAISHLFERQIDDSVVPLLQSCPEGENCLKDARRLMTAVETKLDKGLDKVLTAIVNHVRFILSSEQKRQDFKPEDNDQYGAIPSCSNACTLVCKYLTQQINSLSDCLDGCNLMNTLSELVVRFHRVIVDHIYQFQYNSQGAVHLLCDVSEYRKIVSGIGVPLAKRLFDTLHALSNLLIVAPDHLLSACTSNVLVRRLTIVAPLKGAFVVLQENFDRSVVVAFVQLRFGELERMGTMSMSNDGCRERSPVCTYFRRSHIASVNRAPRANRIFDATCASLSTMSKYLFSLLDRWRLLPLICLVFYSLCGGLIFDIAEGNAALARRCNPEAVAFQPNSSFYKRHLTMRLAEILTEPVNSSKKMLLARDAWQWFTERMHVGWDACCSSTQEVVIGHRRNLTLFASLYYAVQVCTTIGKNFTFRCLLAAASGYGDVVPSTALGKLFTMAYSLLGIPLLLYILDEWGTLLMKLMFRVKYIWNAKTMGASTHHRVHTVDDVPLSLALLLQFLWLCLSAALFQSWEKDVDYFSSFYFFFISFTTIGFGKGSKFMRACYAVAAAMTPLVAGDVVPKHPLYMPLCSILVLFGLAQLSMCINLLQHKIDVTFQMLLHSVDRMYKERQSVAMDNEQRLMEKVEDVNALLKVLSEGDGIQNRFFLQALGKSRRDLVVESWERRTICRNVAVQATVELGSSSCQTVNLHRPDFKVNYLYNIDN
					

Structure Viewer

Loading PAE data...

(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	43	Very low	56	Low	142 Å²	142	94.5 Å²	94.5	70%	0.7	47%	0.473	S	S	*	.				0	-69	0	-121.5	-150.4	-106.3	0	0	111.8	R3 T4 Y5	M1-R3 VanDerWaalsContact C-N 3.34Å; M1-R3 PolarHBondContact O-N 3.3Å; M1-T4 WeakPolarHBondContact CA-OG1 3.37Å; M1-T4 PolarHBondContact O-N 3.04Å; M1-T4 VanDerWaalsContact O-N 3.07Å; M1-T4 PolarHBondContact O-OG1 2.91Å; M1-Y5 HydrophobicContact CB-CE2 4.42Å; M1-Y5 HydrophobicContact CG-CE2 3.79Å; M1-Y5 WeakPolarHBondContact O-CD2 3.36Å; M1-Y5 PolarHBondContact O-N 3.03Å; M1-Y5 VanDerWaalsContact O-N 3.14Å; M1-Y5 HydrophobicContact SD-CE2 3.82Å
2	L	47.3	Very low	55.7	Low	107 Å²	107	97.1 Å²	97.1	56%	0.56	49%	0.49	S	S	*	.	H	α-helix	trans	-56	-37.8	179.8	-93.5	148.3	0	0	0	115.4	A6 L55	L2-A6 VanDerWaalsContact O-CB 3.27Å; L2-A6 WeakPolarHBondContact O-CB 3.48Å; L2-A6 PolarHBondContact O-N 3.2Å; L2-L55 HydrophobicContact CD2-CD1 3.53Å; L2-L55 HydrophobicContact CD2-CG 4.11Å; L2-L55 HydrophobicContact CG-CD1 4.02Å
3	R	52.4	Low	55.5	Low	212 Å²	212	95.2 Å²	95.2	80%	0.8	50%	0.498	S	S	*	.	H	α-helix	trans	-65.3	-41.2	174.8	-85.5	-176.6	177.3	157.5	-1.1	112.7	M1 A6 E7	M1-R3 VanDerWaalsContact C-N 3.34Å; M1-R3 PolarHBondContact O-N 3.3Å; R3-A6 PolarHBondContact O-N 2.92Å; R3-E7 WeakPolarHBondContact O-CG 3.44Å; R3-E7 PolarHBondContact O-N 3.28Å
4	T	60.1	Low	56.1	Low	67 Å²	67	96.1 Å²	96.1	41%	0.411	50%	0.496	S	S	.	.	H	α-helix	trans	-67.2	-42.1	-179.4	8.2	0	0	0	0	111.8	M1 D8	M1-T4 WeakPolarHBondContact CA-OG1 3.37Å; M1-T4 PolarHBondContact O-N 3.04Å; M1-T4 VanDerWaalsContact O-N 3.07Å; M1-T4 PolarHBondContact O-OG1 2.91Å; T4-D8 PolarHBondContact O-N 2.84Å
5	Y	62.4	Low	57	Low	11 Å²	11	94.2 Å²	94.2	4%	0.043	49%	0.487	C	S	.	.	H	α-helix	trans	-66.9	-37.9	172.8	-66.3	-73	0	0	0	112.4	M1 E7 D8 L9 Y19 E48 L55	M1-Y5 HydrophobicContact CB-CE2 4.42Å; M1-Y5 HydrophobicContact CG-CE2 3.79Å; M1-Y5 WeakPolarHBondContact O-CD2 3.36Å; M1-Y5 PolarHBondContact O-N 3.03Å; M1-Y5 VanDerWaalsContact O-N 3.14Å; M1-Y5 HydrophobicContact SD-CE2 3.82Å; Y5-E7 VanDerWaalsContact C-N 3.32Å; Y5-E7 PolarHBondContact O-N 2.75Å; Y5-D8 PolarHBondContact O-N 3.26Å; Y5-L9 WeakPolarHBondContact O-CB 3.5Å; Y5-L9 WeakPolarHBondContact O-CD1 3.39Å; Y5-L9 WeakPolarHBondContact O-CG 3.37Å; Y5-L9 PolarHBondContact O-N 3.06Å; Y5-Y19 WeakPolarHBondContact CD1-OH 3.5Å; Y5-Y19 WeakPolarHBondContact CE1-OH 3.29Å; Y5-E48 PolarHBondContact OH-OE1 3.46Å; Y5-E48 PolarHBondContact OH-OE2 3.29Å; Y5-L55 HydrophobicContact CD2-CD1 3.93Å; Y5-L55 HydrophobicContact CG-CD1 4.26Å
6	A	59.6	Low	57.7	Low	40 Å²	40	93.2 Å²	93.2	33%	0.331	49%	0.488	S	S	.	.	H	α-helix	trans	-64.9	-35.5	179.8	0	0	0	0	0	112.8	L2 R3 Q10	L2-A6 VanDerWaalsContact O-CB 3.27Å; L2-A6 WeakPolarHBondContact O-CB 3.48Å; L2-A6 PolarHBondContact O-N 3.2Å; R3-A6 PolarHBondContact O-N 2.92Å; A6-Q10 WeakPolarHBondContact O-CB 3.35Å; A6-Q10 WeakPolarHBondContact O-CG 3.47Å; A6-Q10 PolarHBondContact O-N 3.23Å; A6-Q10 VanDerWaalsContact O-N 3.16Å
7	E	63	Low	58.5	Low	136 Å²	136	96.7 Å²	96.7	64%	0.636	50%	0.502	S	S	*	.	H	α-helix	trans	-68.9	-39.3	175.1	-74.3	167.6	-173.2	0	0	112	R3 Y5	R3-E7 WeakPolarHBondContact O-CG 3.44Å; R3-E7 PolarHBondContact O-N 3.28Å; Y5-E7 VanDerWaalsContact C-N 3.32Å; Y5-E7 PolarHBondContact O-N 2.75Å
8	D	57	Low	59	Low	26 Å²	26	96 Å²	96	14%	0.139	50%	0.496	C	S	.	.	H	α-helix	trans	-69.4	-36.9	176	-76.5	-37.4	0	0	0	112.3	T4 Y5 S11 R22 R26	T4-D8 PolarHBondContact O-N 2.84Å; Y5-D8 PolarHBondContact O-N 3.26Å; D8-S11 PolarHBondContact O-OG 3.46Å; D8-R22 IonicContact OD1-NH1 3.25Å; D8-R22 PolarHBondContact OD1-NH1 3.21Å; D8-R26 IonicContact OD1-NH2 2.84Å; D8-R26 IonicContact OD2-CZ 3.95Å; D8-R26 IonicContact OD2-NH1 2.84Å; D8-R26 PolarHBondContact OD2-NH1 3.35Å; D8-R26 IonicContact OD2-NH2 2.99Å; D8-R26 PolarHBondContact OD2-NH2 2.95Å
9	L	59.3	Low	59.7	Low	80 Å²	80	92.4 Å²	92.4	42%	0.419	48%	0.475	S	S	.	.	H	α-helix	trans	-80.3	-16.2	-178.2	-77.8	157	0	0	0	114.5	Y5 S11 F14 L55	Y5-L9 WeakPolarHBondContact O-CB 3.5Å; Y5-L9 WeakPolarHBondContact O-CD1 3.39Å; Y5-L9 WeakPolarHBondContact O-CG 3.37Å; Y5-L9 PolarHBondContact O-N 3.06Å; L9-S11 VanDerWaalsContact C-N 3.3Å; L9-S11 PolarHBondContact O-N 3.05Å; L9-F14 HydrophobicContact CD2-CD2 4.04Å; L9-F14 HydrophobicContact CD2-CE2 4.05Å; L9-L55 HydrophobicContact CD1-CD2 4.34Å
10	Q	55.7	Low	60.4	Low	156 Å²	156	91.5 Å²	91.5	73%	0.729	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.9	4.7	-179.4	-83.7	176.4	7.9	0	0	114.5	A6	A6-Q10 WeakPolarHBondContact O-CB 3.35Å; A6-Q10 WeakPolarHBondContact O-CG 3.47Å; A6-Q10 PolarHBondContact O-N 3.23Å; A6-Q10 VanDerWaalsContact O-N 3.16Å
11	S	56.5	Low	60.8	Low	63 Å²	63	93.1 Å²	93.1	44%	0.441	48%	0.479	S	S	.	.	S	Bend	trans	-75.2	135.3	174.7	60.4	0	0	0	0	111.4	D8 L9 A13	D8-S11 PolarHBondContact O-OG 3.46Å; L9-S11 VanDerWaalsContact C-N 3.3Å; L9-S11 PolarHBondContact O-N 3.05Å; S11-A13 PolarHBondContact O-N 2.83Å
12	D	52	Low	62.1	Low	125 Å²	125	91.5 Å²	91.5	67%	0.668	47%	0.465	S	S	*	.	S	Bend	trans	-60.1	-0	-176.2	-66.6	-50.4	0	0	0	115.6	R494	D12-R494 IonicContact OD2-NH2 3.95Å; D12-R494 PolarHBondContact OD2-NH2 3.03Å
13	A	53.6	Low	63.2	Low	72 Å²	72	87.1 Å²	87.1	60%	0.595	44%	0.442	S	S	*	.	S	Bend	trans	-153.4	86.6	174	0	0	0	0	0	110.1	S11 N15	S11-A13 PolarHBondContact O-N 2.83Å; A13-N15 PolarHBondContact O-N 2.94Å; A13-N15 VanDerWaalsContact O-N 3.15Å
14	F	63.7	Low	64	Low	109 Å²	109	78.4 Å²	78.4	48%	0.478	42%	0.416	S	S	.	.			trans	-58	115.7	170.3	175.5	-99.4	0	0	0	110.3	L9 P16 Y19	L9-F14 HydrophobicContact CD2-CD2 4.04Å; L9-F14 HydrophobicContact CD2-CE2 4.05Å; F14-P16 HydrophobicContact CE1-CB 4.2Å; F14-Y19 HydrophobicContact CE2-CD2 4.34Å; F14-Y19 HydrophobicContact CE2-CG 4.26Å
15	N	69.3	Low	64.5	Low	67 Å²	67	83.1 Å²	83.1	36%	0.358	43%	0.427	S	S	.	.			trans	-105.7	113.5	174	-176	-3.1	0	0	0	109.8	A13 E17 E18 Y19	A13-N15 PolarHBondContact O-N 2.94Å; A13-N15 VanDerWaalsContact O-N 3.15Å; N15-E17 VanDerWaalsContact C-N 3.28Å; N15-E17 PolarHBondContact O-N 3.37Å; N15-E17 PolarHBondContact OD1-N 3.46Å; N15-E17 VanDerWaalsContact OD1-N 3.15Å; N15-E18 HydrophobicContact CB-CB 3.94Å; N15-E18 PolarHBondContact O-N 3.49Å; N15-Y19 PolarHBondContact O-N 3.45Å; N15-Y19 VanDerWaalsContact O-N 3.07Å
16	P	68.2	Low	64.9	Low	78 Å²	78	88.7 Å²	88.7	51%	0.506	45%	0.447	S	S	.	.	H	α-helix	trans	-64.6	-31.5	-177.5	26	-34.1	0	0	0	112.8	F14 V20	F14-P16 HydrophobicContact CE1-CB 4.2Å; P16-V20 VanDerWaalsContact O-CG2 3.25Å; P16-V20 WeakPolarHBondContact O-CG2 3.18Å; P16-V20 PolarHBondContact O-N 3.22Å; P16-V20 VanDerWaalsContact O-N 3.08Å
17	E	71.7	Confident	65.3	Low	153 Å²	153	88.6 Å²	88.6	72%	0.715	44%	0.441	S	S	*	.	H	α-helix	trans	-68.8	-45.4	179.8	-65.6	176.8	175.5	0	0	110.8	N15 Y19 V20 E21	N15-E17 VanDerWaalsContact C-N 3.28Å; N15-E17 PolarHBondContact O-N 3.37Å; N15-E17 PolarHBondContact OD1-N 3.46Å; N15-E17 VanDerWaalsContact OD1-N 3.15Å; E17-Y19 VanDerWaalsContact C-N 3.34Å; E17-Y19 PolarHBondContact O-N 3.4Å; E17-V20 PolarHBondContact O-N 2.77Å; E17-E21 WeakPolarHBondContact O-CB 3.35Å; E17-E21 PolarHBondContact O-N 3.09Å
18	E	68	Low	65.4	Low	84 Å²	84	84.5 Å²	84.5	39%	0.393	43%	0.425	S	S	.	.	H	α-helix	trans	-66.9	-35.7	178.4	-166.9	179.1	174.8	0	0	112.1	N15 E21 R22	N15-E18 HydrophobicContact CB-CB 3.94Å; N15-E18 PolarHBondContact O-N 3.49Å; E18-E21 PolarHBondContact O-N 3.21Å; E18-R22 VanDerWaalsContact O-CG 3.3Å; E18-R22 WeakPolarHBondContact O-CG 3.23Å; E18-R22 PolarHBondContact O-N 3.33Å; E18-R22 IonicContact OE1-CZ 3.98Å; E18-R22 IonicContact OE1-NE 3.85Å; E18-R22 IonicContact OE1-NH2 2.64Å; E18-R22 PolarHBondContact OE1-NH2 3.3Å
19	Y	71.4	Confident	65.4	Low	27 Å²	27	85 Å²	85	11%	0.106	44%	0.437	C	S	.	.	H	α-helix	trans	-63.8	-47.1	173.4	179.3	-94.8	0	0	0	111.7	Y5 F14 N15 E17 E21 R22 L23 L52	Y5-Y19 WeakPolarHBondContact CD1-OH 3.5Å; Y5-Y19 WeakPolarHBondContact CE1-OH 3.29Å; F14-Y19 HydrophobicContact CE2-CD2 4.34Å; F14-Y19 HydrophobicContact CE2-CG 4.26Å; N15-Y19 PolarHBondContact O-N 3.45Å; N15-Y19 VanDerWaalsContact O-N 3.07Å; E17-Y19 VanDerWaalsContact C-N 3.34Å; E17-Y19 PolarHBondContact O-N 3.4Å; Y19-E21 VanDerWaalsContact C-N 3.32Å; Y19-E21 PolarHBondContact O-N 3.28Å; Y19-R22 PolarHBondContact O-N 2.66Å; Y19-L23 HydrophobicContact CE1-CD1 4.48Å; Y19-L23 VanDerWaalsContact O-CB 3.28Å; Y19-L23 WeakPolarHBondContact O-CB 3.26Å; Y19-L23 PolarHBondContact O-N 3.12Å; Y19-L52 HydrophobicContact CE1-CD1 3.95Å
20	V	73.3	Confident	65.1	Low	74 Å²	74	86.3 Å²	86.3	45%	0.448	45%	0.453	S	S	.	.	H	α-helix	trans	-63.9	-38.1	177.9	171.7	0	0	0	0	111.2	P16 E17 L23 A24 M45	P16-V20 VanDerWaalsContact O-CG2 3.25Å; P16-V20 WeakPolarHBondContact O-CG2 3.18Å; P16-V20 PolarHBondContact O-N 3.22Å; P16-V20 VanDerWaalsContact O-N 3.08Å; E17-V20 PolarHBondContact O-N 2.77Å; V20-L23 PolarHBondContact O-N 3.38Å; V20-A24 VanDerWaalsContact O-CB 3.32Å; V20-A24 WeakPolarHBondContact O-CB 3.35Å; V20-A24 PolarHBondContact O-N 3.05Å; V20-M45 HydrophobicContact CG1-CE 4.36Å
21	E	69.5	Low	64.7	Low	127 Å²	127	83.6 Å²	83.6	59%	0.593	45%	0.447	S	S	*	.	H	α-helix	trans	-65.7	-45	177	-170	175.3	-172.2	0	0	112.2	E17 E18 Y19 L23 A24 W25	E17-E21 WeakPolarHBondContact O-CB 3.35Å; E17-E21 PolarHBondContact O-N 3.09Å; E18-E21 PolarHBondContact O-N 3.21Å; Y19-E21 VanDerWaalsContact C-N 3.32Å; Y19-E21 PolarHBondContact O-N 3.28Å; E21-L23 VanDerWaalsContact C-N 3.35Å; E21-A24 PolarHBondContact O-N 2.9Å; E21-W25 PolarHBondContact O-N 3.39Å
22	R	70.6	Confident	64.3	Low	107 Å²	107	86.9 Å²	86.9	40%	0.404	47%	0.47	S	S	.	.	H	α-helix	trans	-64.5	-38.9	173.9	-70.6	177.8	-165	-178.9	5.9	112.2	D8 E18 Y19 W25 R26	D8-R22 IonicContact OD1-NH1 3.25Å; D8-R22 PolarHBondContact OD1-NH1 3.21Å; E18-R22 VanDerWaalsContact O-CG 3.3Å; E18-R22 WeakPolarHBondContact O-CG 3.23Å; E18-R22 PolarHBondContact O-N 3.33Å; E18-R22 IonicContact OE1-CZ 3.98Å; E18-R22 IonicContact OE1-NE 3.85Å; E18-R22 IonicContact OE1-NH2 2.64Å; E18-R22 PolarHBondContact OE1-NH2 3.3Å; Y19-R22 PolarHBondContact O-N 2.66Å; R22-W25 PolarHBondContact O-N 2.83Å; R22-R26 WeakPolarHBondContact O-CG 3.15Å; R22-R26 PolarHBondContact O-N 2.78Å
23	L	70.9	Confident	63.9	Low	15 Å²	15	84.7 Å²	84.7	8%	0.079	46%	0.464	C	S	.	.	H	α-helix	trans	-63.4	-47.6	176.6	-167.4	83.4	0	0	0	110.5	Y19 V20 E21 W25 R26 L27 E48	Y19-L23 HydrophobicContact CE1-CD1 4.48Å; Y19-L23 VanDerWaalsContact O-CB 3.28Å; Y19-L23 WeakPolarHBondContact O-CB 3.26Å; Y19-L23 PolarHBondContact O-N 3.12Å; V20-L23 PolarHBondContact O-N 3.38Å; E21-L23 VanDerWaalsContact C-N 3.35Å; L23-W25 VanDerWaalsContact C-N 3.3Å; L23-W25 PolarHBondContact O-N 3.05Å; L23-R26 PolarHBondContact O-N 3.35Å; L23-R26 VanDerWaalsContact O-N 3.15Å; L23-L27 HydrophobicContact CD2-CD1 4.42Å; L23-L27 HydrophobicContact CG-CD1 4.19Å; L23-L27 WeakPolarHBondContact O-CB 3.23Å; L23-L27 VanDerWaalsContact O-CG 3.31Å; L23-L27 WeakPolarHBondContact O-CG 3.11Å; L23-L27 PolarHBondContact O-N 2.8Å; L23-E48 HydrophobicContact CD1-CB 4.36Å; L23-E48 HydrophobicContact CD1-CG 4.04Å; L23-E48 HydrophobicContact CD2-CB 4.15Å; L23-E48 HydrophobicContact CD2-CG 4.43Å
24	A	69.1	Low	63.4	Low	30 Å²	30	88.3 Å²	88.3	25%	0.248	48%	0.484	C	S	.	.	H	α-helix	trans	-59.1	-41.5	176	0	0	0	0	0	111.5	V20 E21 L27 T28	V20-A24 VanDerWaalsContact O-CB 3.32Å; V20-A24 WeakPolarHBondContact O-CB 3.35Å; V20-A24 PolarHBondContact O-N 3.05Å; E21-A24 PolarHBondContact O-N 2.9Å; A24-L27 PolarHBondContact O-N 3.47Å; A24-T28 WeakPolarHBondContact O-CB 3.17Å; A24-T28 WeakPolarHBondContact O-CG2 3.47Å; A24-T28 PolarHBondContact O-N 3.29Å; A24-T28 PolarHBondContact O-OG1 3.45Å
25	W	70.2	Confident	62.8	Low	166 Å²	166	88.1 Å²	88.1	63%	0.629	50%	0.496	S	S	*	.	H	α-helix	trans	-62.9	-40.3	173.9	-104.2	96.5	0	0	0	113.7	E21 R22 L23 G29	E21-W25 PolarHBondContact O-N 3.39Å; R22-W25 PolarHBondContact O-N 2.83Å; L23-W25 VanDerWaalsContact C-N 3.3Å; L23-W25 PolarHBondContact O-N 3.05Å; W25-G29 PolarHBondContact O-N 3.5Å
26	R	70.6	Confident	62.3	Low	128 Å²	128	90.9 Å²	90.9	48%	0.483	51%	0.51	S	S	.	.	H	α-helix	trans	-66.8	-39	175.8	-72.9	177.5	-160.5	164.9	6.2	112.1	D8 R22 L23	D8-R26 IonicContact OD1-NH2 2.84Å; D8-R26 IonicContact OD2-CZ 3.95Å; D8-R26 IonicContact OD2-NH1 2.84Å; D8-R26 PolarHBondContact OD2-NH1 3.35Å; D8-R26 IonicContact OD2-NH2 2.99Å; D8-R26 PolarHBondContact OD2-NH2 2.95Å; R22-R26 WeakPolarHBondContact O-CG 3.15Å; R22-R26 PolarHBondContact O-N 2.78Å; L23-R26 PolarHBondContact O-N 3.35Å; L23-R26 VanDerWaalsContact O-N 3.15Å
27	L	67.9	Low	62.3	Low	37 Å²	37	92 Å²	92	19%	0.194	51%	0.511	C	S	.	.	H	α-helix	trans	-75.8	-31.3	-178.1	-70	177.5	0	0	0	113.1	L23 A24 L41 A44 M45 E48	L23-L27 HydrophobicContact CD2-CD1 4.42Å; L23-L27 HydrophobicContact CG-CD1 4.19Å; L23-L27 WeakPolarHBondContact O-CB 3.23Å; L23-L27 VanDerWaalsContact O-CG 3.31Å; L23-L27 WeakPolarHBondContact O-CG 3.11Å; L23-L27 PolarHBondContact O-N 2.8Å; A24-L27 PolarHBondContact O-N 3.47Å; L27-L41 HydrophobicContact CB-CD1 4.31Å; L27-A44 HydrophobicContact CD1-CB 4.16Å; L27-A44 HydrophobicContact CD2-CB 3.86Å; L27-M45 HydrophobicContact CD1-CG 4.03Å; L27-E48 HydrophobicContact CD1-CG 4.44Å; L27-E48 HydrophobicContact CD2-CG 4.35Å
28	T	65.7	Low	62.2	Low	50 Å²	50	88.3 Å²	88.3	31%	0.307	51%	0.508	S	S	.	.	H	α-helix	trans	-89.9	-19.7	-177.6	50.2	0	0	0	0	113.7	A24 T31 L36 L41	A24-T28 WeakPolarHBondContact O-CB 3.17Å; A24-T28 WeakPolarHBondContact O-CG2 3.47Å; A24-T28 PolarHBondContact O-N 3.29Å; A24-T28 PolarHBondContact O-OG1 3.45Å; T28-T31 PolarHBondContact O-OG1 3.41Å; T28-L36 HydrophobicContact CG2-CD1 4.23Å; T28-L36 HydrophobicContact CG2-CD2 4.49Å; T28-L41 HydrophobicContact CG2-CD1 4.11Å
29	G	56.8	Low	62.6	Low	37 Å²	37	87.8 Å²	87.8	38%	0.381	51%	0.513	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.8	167.7	-175.3	0	0	0	0	0	112.3	W25 T31	W25-G29 PolarHBondContact O-N 3.5Å; G29-T31 PolarHBondContact O-N 3.43Å
30	S	52.3	Low	62.8	Low	107 Å²	107	93.9 Å²	93.9	75%	0.748	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.4	23.6	-179.9	73.6	0	0	0	0	114.3	S32	S30-S32 PolarHBondContact O-N 3.23Å
31	T	46.5	Very low	62.7	Low	100 Å²	100	92.5 Å²	92.5	61%	0.613	53%	0.527	S	S	*	.			trans	-86.7	91.6	-176.2	31.4	0	0	0	0	111.1	T28 G29 S33	T28-T31 PolarHBondContact O-OG1 3.41Å; G29-T31 PolarHBondContact O-N 3.43Å; T31-S33 PolarHBondContact O-N 3.18Å
32	S	48.8	Very low	63	Low	131 Å²	131	88.9 Å²	88.9	92%	0.916	52%	0.519	S	S	*	.			trans	-66	31	166.4	48.4	0	0	0	0	114.2	S30	S30-S32 PolarHBondContact O-N 3.23Å
33	S	42.8	Very low	63.5	Low	80 Å²	80	87.3 Å²	87.3	56%	0.559	52%	0.524	S	S	*	.			trans	-107.5	126.3	179.9	54.9	0	0	0	0	111.8	T31 S35	T31-S33 PolarHBondContact O-N 3.18Å; S33-S35 VanDerWaalsContact C-N 3.28Å; S33-S35 PolarHBondContact O-N 3.3Å
34	C	43.4	Very low	63.7	Low	148 Å²	148	87 Å²	87	100%	1	52%	0.524	S	S	*	.	S	Bend	trans	-57.2	42.7	-166.9	-128	0	0	0	0	119.3
35	S	52	Low	64.2	Low	105 Å²	105	88.5 Å²	88.5	73%	0.734	53%	0.526	S	S	*	.			trans	-148.4	80.3	170.4	64.4	0	0	0	0	111.7	S33 D37	S33-S35 VanDerWaalsContact C-N 3.28Å; S33-S35 PolarHBondContact O-N 3.3Å; S35-D37 PolarHBondContact O-N 2.95Å
36	L	59	Low	64.8	Low	125 Å²	125	87.3 Å²	87.3	65%	0.654	53%	0.528	S	S	*	.			trans	-78.2	110.8	170.8	-136.8	110.8	0	0	0	108.2	T28 A38 L41	T28-L36 HydrophobicContact CG2-CD1 4.23Å; T28-L36 HydrophobicContact CG2-CD2 4.49Å; L36-A38 PolarHBondContact O-N 3.19Å; L36-L41 HydrophobicContact CD2-CD2 3.96Å
37	D	67.4	Low	65.4	Low	100 Å²	100	87.3 Å²	87.3	54%	0.535	53%	0.533	S	S	.	.			trans	-78.4	104.4	177.1	-163.7	-19.2	0	0	0	109.4	S35 S39 Y40 L41	S35-D37 PolarHBondContact O-N 2.95Å; D37-S39 VanDerWaalsContact CG-OG 3.31Å; D37-S39 PolarHBondContact O-N 3.49Å; D37-S39 PolarHBondContact OD1-N 3.18Å; D37-S39 PolarHBondContact OD1-OG 2.7Å; D37-Y40 WeakPolarHBondContact O-CB 3.32Å; D37-Y40 PolarHBondContact O-N 2.92Å; D37-Y40 VanDerWaalsContact O-N 3.1Å; D37-L41 PolarHBondContact O-N 2.79Å; D37-L41 VanDerWaalsContact O-N 3.15Å
38	A	70.7	Confident	65.9	Low	77 Å²	77	87.1 Å²	87.1	64%	0.636	53%	0.531	S	S	*	.	H	α-helix	trans	-60	-26.5	-177.6	0	0	0	0	0	112.7	L36 A42	L36-A38 PolarHBondContact O-N 3.19Å; A38-A42 WeakPolarHBondContact O-CB 3.15Å; A38-A42 PolarHBondContact O-N 2.81Å; A38-A42 VanDerWaalsContact O-N 3.16Å
39	S	75.2	Confident	66.7	Low	72 Å²	72	88.5 Å²	88.5	50%	0.503	54%	0.54	S	S	.	.	H	α-helix	trans	-70	-42	176.1	69.3	0	0	0	0	111.7	D37 A42 S43	D37-S39 VanDerWaalsContact CG-OG 3.31Å; D37-S39 PolarHBondContact O-N 3.49Å; D37-S39 PolarHBondContact OD1-N 3.18Å; D37-S39 PolarHBondContact OD1-OG 2.7Å; S39-A42 PolarHBondContact O-N 3.41Å; S39-S43 PolarHBondContact O-N 2.86Å; S39-S43 PolarHBondContact O-OG 2.93Å; S39-S43 VanDerWaalsContact O-OG 3.08Å
40	Y	75.2	Confident	68	Low	156 Å²	156	89.4 Å²	89.4	61%	0.612	54%	0.54	S	S	*	.	H	α-helix	trans	-65.6	-44.7	177.1	178.7	-101	0	0	0	112.1	D37 A42 S43 A44	D37-Y40 WeakPolarHBondContact O-CB 3.32Å; D37-Y40 PolarHBondContact O-N 2.92Å; D37-Y40 VanDerWaalsContact O-N 3.1Å; Y40-A42 VanDerWaalsContact C-N 3.34Å; Y40-A42 PolarHBondContact O-N 3.45Å; Y40-S43 PolarHBondContact O-N 2.96Å; Y40-A44 VanDerWaalsContact O-CB 3.29Å; Y40-A44 WeakPolarHBondContact O-CB 3.23Å; Y40-A44 PolarHBondContact O-N 3.07Å
41	L	71.9	Confident	69.4	Low	45 Å²	45	86.1 Å²	86.1	24%	0.236	51%	0.514	C	S	.	.	H	α-helix	trans	-64.1	-39.1	178.3	-173.5	68.4	0	0	0	112	L27 T28 L36 D37 M45	L27-L41 HydrophobicContact CB-CD1 4.31Å; T28-L41 HydrophobicContact CG2-CD1 4.11Å; L36-L41 HydrophobicContact CD2-CD2 3.96Å; D37-L41 PolarHBondContact O-N 2.79Å; D37-L41 VanDerWaalsContact O-N 3.15Å; L41-M45 WeakPolarHBondContact O-CB 3.17Å; L41-M45 WeakPolarHBondContact O-CG 3.32Å; L41-M45 PolarHBondContact O-N 3.12Å
42	A	77	Confident	71	Confident	51 Å²	51	84 Å²	84	42%	0.421	50%	0.499	S	S	.	.	H	α-helix	trans	-64.2	-48.5	175.8	0	0	0	0	0	111.6	A38 S39 Y40 A44 M45 E46	A38-A42 WeakPolarHBondContact O-CB 3.15Å; A38-A42 PolarHBondContact O-N 2.81Å; A38-A42 VanDerWaalsContact O-N 3.16Å; S39-A42 PolarHBondContact O-N 3.41Å; Y40-A42 VanDerWaalsContact C-N 3.34Å; Y40-A42 PolarHBondContact O-N 3.45Å; A42-A44 VanDerWaalsContact C-N 3.33Å; A42-A44 PolarHBondContact O-N 3.3Å; A42-M45 PolarHBondContact O-N 3.43Å; A42-E46 WeakPolarHBondContact O-CG 3.42Å; A42-E46 PolarHBondContact O-N 3.34Å
43	S	79.7	Confident	72.7	Confident	73 Å²	73	83.5 Å²	83.5	51%	0.51	48%	0.482	S	S	.	.	H	α-helix	trans	-61.8	-39.6	176.9	-59.4	0	0	0	0	112.7	S39 Y40 E46 E47	S39-S43 PolarHBondContact O-N 2.86Å; S39-S43 PolarHBondContact O-OG 2.93Å; S39-S43 VanDerWaalsContact O-OG 3.08Å; Y40-S43 PolarHBondContact O-N 2.96Å; S43-E46 PolarHBondContact O-N 2.9Å; S43-E47 PolarHBondContact O-N 3.48Å
44	A	75.8	Confident	74.7	Confident	9 Å²	9	83.7 Å²	83.7	7%	0.074	48%	0.476	C	S	.	.	H	α-helix	trans	-69.7	-36.3	178	0	0	0	0	0	112.8	L27 Y40 A42 E48	L27-A44 HydrophobicContact CD1-CB 4.16Å; L27-A44 HydrophobicContact CD2-CB 3.86Å; Y40-A44 VanDerWaalsContact O-CB 3.29Å; Y40-A44 WeakPolarHBondContact O-CB 3.23Å; Y40-A44 PolarHBondContact O-N 3.07Å; A42-A44 VanDerWaalsContact C-N 3.33Å; A42-A44 PolarHBondContact O-N 3.3Å; A44-E48 WeakPolarHBondContact O-CG 3.38Å; A44-E48 PolarHBondContact O-N 3.23Å; A44-E48 VanDerWaalsContact O-N 3.09Å
45	M	79	Confident	76.5	Confident	62 Å²	62	77.7 Å²	77.7	31%	0.305	43%	0.433	S	S	.	.	H	α-helix	trans	-68.8	-38.4	172.6	-79.8	-158.4	156.4	0	0	112.5	V20 L27 L41 A42 E47 E48 V49	V20-M45 HydrophobicContact CG1-CE 4.36Å; L27-M45 HydrophobicContact CD1-CG 4.03Å; L41-M45 WeakPolarHBondContact O-CB 3.17Å; L41-M45 WeakPolarHBondContact O-CG 3.32Å; L41-M45 PolarHBondContact O-N 3.12Å; A42-M45 PolarHBondContact O-N 3.43Å; M45-E47 VanDerWaalsContact C-N 3.35Å; M45-E48 PolarHBondContact O-N 2.93Å; M45-V49 VanDerWaalsContact O-CG2 3.27Å; M45-V49 WeakPolarHBondContact O-CG2 3.41Å; M45-V49 PolarHBondContact O-N 2.8Å
46	E	83.7	Confident	77.9	Confident	141 Å²	141	79.1 Å²	79.1	66%	0.659	43%	0.427	S	S	*	.	H	α-helix	trans	-62.4	-40.9	174.5	-76.1	179.1	172.3	0	0	112	A42 S43 V49 S50	A42-E46 WeakPolarHBondContact O-CG 3.42Å; A42-E46 PolarHBondContact O-N 3.34Å; S43-E46 PolarHBondContact O-N 2.9Å; E46-V49 PolarHBondContact O-N 3.03Å; E46-S50 PolarHBondContact O-N 3.45Å
47	E	82.5	Confident	79.2	Confident	128 Å²	128	77.8 Å²	77.8	60%	0.598	42%	0.42	S	S	*	.	H	α-helix	trans	-63.3	-45	174.9	-171.7	177.9	176.1	0	0	111.9	S43 M45 S50 N51	S43-E47 PolarHBondContact O-N 3.48Å; M45-E47 VanDerWaalsContact C-N 3.35Å; E47-S50 WeakPolarHBondContact O-CB 3.31Å; E47-S50 PolarHBondContact O-N 3.31Å; E47-N51 PolarHBondContact O-N 3.14Å; E47-N51 PolarHBondContact O-ND2 3.35Å
48	E	78.6	Confident	79.9	Confident	33 Å²	33	77.9 Å²	77.9	15%	0.154	42%	0.418	C	S	.	.	H	α-helix	trans	-65.1	-39	177.5	-76.6	-65	141.4	0	0	112.9	Y5 L23 L27 A44 M45 S50 N51 L52	Y5-E48 PolarHBondContact OH-OE1 3.46Å; Y5-E48 PolarHBondContact OH-OE2 3.29Å; L23-E48 HydrophobicContact CD1-CB 4.36Å; L23-E48 HydrophobicContact CD1-CG 4.04Å; L23-E48 HydrophobicContact CD2-CB 4.15Å; L23-E48 HydrophobicContact CD2-CG 4.43Å; L27-E48 HydrophobicContact CD1-CG 4.44Å; L27-E48 HydrophobicContact CD2-CG 4.35Å; A44-E48 WeakPolarHBondContact O-CG 3.38Å; A44-E48 PolarHBondContact O-N 3.23Å; A44-E48 VanDerWaalsContact O-N 3.09Å; M45-E48 PolarHBondContact O-N 2.93Å; E48-S50 VanDerWaalsContact C-N 3.32Å; E48-N51 PolarHBondContact O-N 3.32Å; E48-L52 WeakPolarHBondContact O-CB 3.39Å; E48-L52 WeakPolarHBondContact O-CD1 3.35Å; E48-L52 PolarHBondContact O-N 2.87Å
49	V	81.7	Confident	80.2	Confident	79 Å²	79	77.3 Å²	77.3	48%	0.479	41%	0.408	S	S	.	.	H	α-helix	trans	-63.4	-40.1	173.3	170.2	0	0	0	0	110.9	M45 E46 L52 Q53	M45-V49 VanDerWaalsContact O-CG2 3.27Å; M45-V49 WeakPolarHBondContact O-CG2 3.41Å; M45-V49 PolarHBondContact O-N 2.8Å; E46-V49 PolarHBondContact O-N 3.03Å; V49-L52 PolarHBondContact O-N 3.4Å; V49-Q53 WeakPolarHBondContact O-CG 3.35Å; V49-Q53 PolarHBondContact O-N 2.81Å
50	S	84.5	Confident	80.6	Confident	56 Å²	56	76.2 Å²	76.2	39%	0.392	40%	0.399	S	S	.	.	H	α-helix	trans	-63.8	-42.6	174.7	-169.3	0	0	0	0	111.9	E46 E47 E48 L52 Q53 I54	E46-S50 PolarHBondContact O-N 3.45Å; E47-S50 WeakPolarHBondContact O-CB 3.31Å; E47-S50 PolarHBondContact O-N 3.31Å; E48-S50 VanDerWaalsContact C-N 3.32Å; S50-L52 PolarHBondContact O-N 2.92Å; S50-Q53 PolarHBondContact O-N 3.27Å; S50-I54 WeakPolarHBondContact O-CG1 3.42Å; S50-I54 PolarHBondContact O-N 3.42Å
51	N	81.2	Confident	81.1	Confident	38 Å²	38	73.2 Å²	73.2	20%	0.203	40%	0.396	C	S	.	.	H	α-helix	trans	-62.2	-41.5	175.5	-72	-30.1	0	0	0	112.4	E47 E48 I54 L55	E47-N51 PolarHBondContact O-N 3.14Å; E47-N51 PolarHBondContact O-ND2 3.35Å; E48-N51 PolarHBondContact O-N 3.32Å; N51-I54 PolarHBondContact O-N 3.48Å; N51-L55 WeakPolarHBondContact O-CB 3.42Å; N51-L55 PolarHBondContact O-N 3.05Å
52	L	80.5	Confident	81.7	Confident	56 Å²	56	78 Å²	78	29%	0.293	42%	0.416	S	S	.	.	H	α-helix	trans	-62.9	-40.4	173.8	-88.3	151	0	0	0	112.5	Y19 E48 V49 S50 L55 F56	Y19-L52 HydrophobicContact CE1-CD1 3.95Å; E48-L52 WeakPolarHBondContact O-CB 3.39Å; E48-L52 WeakPolarHBondContact O-CD1 3.35Å; E48-L52 PolarHBondContact O-N 2.87Å; V49-L52 PolarHBondContact O-N 3.4Å; S50-L52 PolarHBondContact O-N 2.92Å; L52-L55 PolarHBondContact O-N 3.25Å; L52-F56 WeakPolarHBondContact O-CB 3.42Å; L52-F56 PolarHBondContact O-N 3.02Å
53	Q	85	Confident	81.9	Confident	119 Å²	119	79.3 Å²	79.3	56%	0.556	42%	0.418	S	S	*	.	H	α-helix	trans	-63.7	-46.1	175.3	-77.7	177.2	-18	0	0	111.7	V49 S50 L55 F56 D57	V49-Q53 WeakPolarHBondContact O-CG 3.35Å; V49-Q53 PolarHBondContact O-N 2.81Å; S50-Q53 PolarHBondContact O-N 3.27Å; Q53-L55 VanDerWaalsContact C-N 3.29Å; Q53-L55 PolarHBondContact O-N 3.03Å; Q53-F56 WeakPolarHBondContact O-CB 3.22Å; Q53-F56 PolarHBondContact O-N 3.49Å; Q53-D57 PolarHBondContact O-N 2.94Å
54	I	85.3	Confident	82.2	Confident	84 Å²	84	81.1 Å²	81.1	43%	0.431	42%	0.418	S	S	.	.	H	α-helix	trans	-60.1	-41.8	176.2	-66.5	165.6	0	0	0	110.8	S50 N51 D57 Q58	S50-I54 WeakPolarHBondContact O-CG1 3.42Å; S50-I54 PolarHBondContact O-N 3.42Å; N51-I54 PolarHBondContact O-N 3.48Å; I54-D57 PolarHBondContact O-N 3.28Å; I54-Q58 WeakPolarHBondContact O-CB 3.36Å; I54-Q58 VanDerWaalsContact O-CG 3.28Å; I54-Q58 WeakPolarHBondContact O-CG 3.17Å; I54-Q58 PolarHBondContact O-N 3.48Å
55	L	79.8	Confident	82.8	Confident	22 Å²	22	82.4 Å²	82.4	12%	0.115	43%	0.433	C	S	.	.	H	α-helix	trans	-69.9	-35.5	179.7	-165	137.9	0	0	0	112.1	L2 Y5 L9 N51 L52 Q53 C59	L2-L55 HydrophobicContact CD2-CD1 3.53Å; L2-L55 HydrophobicContact CD2-CG 4.11Å; L2-L55 HydrophobicContact CG-CD1 4.02Å; Y5-L55 HydrophobicContact CD2-CD1 3.93Å; Y5-L55 HydrophobicContact CG-CD1 4.26Å; L9-L55 HydrophobicContact CD1-CD2 4.34Å; N51-L55 WeakPolarHBondContact O-CB 3.42Å; N51-L55 PolarHBondContact O-N 3.05Å; L52-L55 PolarHBondContact O-N 3.25Å; Q53-L55 VanDerWaalsContact C-N 3.29Å; Q53-L55 PolarHBondContact O-N 3.03Å; L55-C59 WeakPolarHBondContact O-CB 3.36Å; L55-C59 PolarHBondContact O-N 3.31Å; L55-C59 PolarHBondContact O-SG 2.94Å
56	F	81.7	Confident	83	Confident	135 Å²	135	84.1 Å²	84.1	59%	0.592	44%	0.442	S	S	*	.	H	α-helix	trans	-62.1	-49.2	171.1	177.9	-95.8	0	0	0	111	L52 Q53 Q58 C59 T60	L52-F56 WeakPolarHBondContact O-CB 3.42Å; L52-F56 PolarHBondContact O-N 3.02Å; Q53-F56 WeakPolarHBondContact O-CB 3.22Å; Q53-F56 PolarHBondContact O-N 3.49Å; F56-Q58 VanDerWaalsContact C-N 3.33Å; F56-Q58 PolarHBondContact O-N 3.24Å; F56-C59 PolarHBondContact O-N 3.43Å; F56-T60 WeakPolarHBondContact O-CB 3.43Å; F56-T60 PolarHBondContact O-N 3.26Å; F56-T60 PolarHBondContact O-OG1 2.86Å
57	D	86.6	Confident	83	Confident	97 Å²	97	82 Å²	82	52%	0.519	43%	0.433	S	S	.	.	H	α-helix	trans	-61.8	-40.9	178.4	-70.7	-17.6	0	0	0	111.7	Q53 I54 T60 T61	Q53-D57 PolarHBondContact O-N 2.94Å; I54-D57 PolarHBondContact O-N 3.28Å; D57-T60 PolarHBondContact O-N 3.01Å; D57-T61 WeakPolarHBondContact O-CB 3.17Å; D57-T61 PolarHBondContact O-N 3.37Å; D57-T61 PolarHBondContact O-OG1 3.47Å
58	Q	83	Confident	83.3	Confident	103 Å²	103	80 Å²	80	48%	0.481	43%	0.426	S	S	.	.	H	α-helix	trans	-64	-43.8	174.4	-75.1	177.2	5.6	0	0	112.7	I54 F56 K62	I54-Q58 WeakPolarHBondContact O-CB 3.36Å; I54-Q58 VanDerWaalsContact O-CG 3.28Å; I54-Q58 WeakPolarHBondContact O-CG 3.17Å; I54-Q58 PolarHBondContact O-N 3.48Å; F56-Q58 VanDerWaalsContact C-N 3.33Å; F56-Q58 PolarHBondContact O-N 3.24Å; Q58-K62 VanDerWaalsContact O-CB 3.3Å; Q58-K62 WeakPolarHBondContact O-CB 3.44Å; Q58-K62 PolarHBondContact O-N 3.07Å
59	C	76.1	Confident	83.7	Confident	64 Å²	64	83.1 Å²	83.1	43%	0.432	44%	0.44	S	S	.	.	H	α-helix	trans	-65.7	-42.2	177	-72.9	0	0	0	0	111.2	L55 F56 K62 V63	L55-C59 WeakPolarHBondContact O-CB 3.36Å; L55-C59 PolarHBondContact O-N 3.31Å; L55-C59 PolarHBondContact O-SG 2.94Å; F56-C59 PolarHBondContact O-N 3.43Å; C59-K62 PolarHBondContact O-N 3Å; C59-V63 WeakPolarHBondContact O-CB 3.26Å; C59-V63 VanDerWaalsContact O-CG2 3.28Å; C59-V63 WeakPolarHBondContact O-CG2 3.31Å; C59-V63 PolarHBondContact O-N 2.91Å
60	T	84.7	Confident	83.8	Confident	50 Å²	50	87.3 Å²	87.3	31%	0.307	45%	0.448	S	S	.	.	H	α-helix	trans	-63.3	-47	178.4	-45.7	0	0	0	0	110.6	F56 D57 K62 V63 E64	F56-T60 WeakPolarHBondContact O-CB 3.43Å; F56-T60 PolarHBondContact O-N 3.26Å; F56-T60 PolarHBondContact O-OG1 2.86Å; D57-T60 PolarHBondContact O-N 3.01Å; T60-K62 VanDerWaalsContact C-N 3.3Å; T60-K62 PolarHBondContact O-N 3.23Å; T60-V63 PolarHBondContact O-N 3.04Å; T60-E64 WeakPolarHBondContact O-CG 3.44Å; T60-E64 PolarHBondContact O-N 3.28Å
61	T	85.8	Confident	83.9	Confident	92 Å²	92	91.3 Å²	91.3	56%	0.564	45%	0.454	S	S	*	.	H	α-helix	trans	-60.2	-38.6	174.7	-52.4	0	0	0	0	112	D57 G65	D57-T61 WeakPolarHBondContact O-CB 3.17Å; D57-T61 PolarHBondContact O-N 3.37Å; D57-T61 PolarHBondContact O-OG1 3.47Å; T61-G65 PolarHBondContact O-N 3.44Å
62	K	82.7	Confident	84.1	Confident	147 Å²	147	96 Å²	96	64%	0.639	48%	0.475	S	S	*	.	H	α-helix	trans	-71	-38	177.5	-171.3	176.1	-178.4	-179.9	0	112.3	Q58 C59 T60 G65 L66	Q58-K62 VanDerWaalsContact O-CB 3.3Å; Q58-K62 WeakPolarHBondContact O-CB 3.44Å; Q58-K62 PolarHBondContact O-N 3.07Å; C59-K62 PolarHBondContact O-N 3Å; T60-K62 VanDerWaalsContact C-N 3.3Å; T60-K62 PolarHBondContact O-N 3.23Å; K62-G65 PolarHBondContact O-N 3.43Å; K62-L66 HydrophobicContact CG-CD1 4.24Å; K62-L66 WeakPolarHBondContact O-CB 3.5Å; K62-L66 VanDerWaalsContact O-CG 3.27Å; K62-L66 WeakPolarHBondContact O-CG 3.35Å; K62-L66 PolarHBondContact O-N 2.76Å
63	V	81.3	Confident	84.1	Confident	77 Å²	77	98.7 Å²	98.7	47%	0.467	49%	0.486	S	S	.	.	H	α-helix	trans	-64.1	-47.5	173.6	169.2	0	0	0	0	109.7	C59 T60 G65 L66 E67	C59-V63 WeakPolarHBondContact O-CB 3.26Å; C59-V63 VanDerWaalsContact O-CG2 3.28Å; C59-V63 WeakPolarHBondContact O-CG2 3.31Å; C59-V63 PolarHBondContact O-N 2.91Å; T60-V63 PolarHBondContact O-N 3.04Å; V63-G65 VanDerWaalsContact C-N 3.32Å; V63-G65 PolarHBondContact O-N 2.89Å; V63-L66 PolarHBondContact O-N 3.28Å; V63-E67 HydrophobicContact CG1-CG 4.28Å; V63-E67 WeakPolarHBondContact O-CB 3.5Å; V63-E67 WeakPolarHBondContact O-CG 3.34Å; V63-E67 PolarHBondContact O-N 3.39Å
64	E	86.5	Confident	83.8	Confident	111 Å²	111	96.4 Å²	96.4	52%	0.519	48%	0.475	S	S	.	.	H	α-helix	trans	-58.8	-42.3	174.6	-72.8	179.3	174.9	0	0	111.9	T60 E67 N68	T60-E64 WeakPolarHBondContact O-CG 3.44Å; T60-E64 PolarHBondContact O-N 3.28Å; E64-E67 PolarHBondContact O-N 3.42Å; E64-N68 WeakPolarHBondContact O-CB 3.35Å; E64-N68 VanDerWaalsContact O-CG 3.24Å; E64-N68 PolarHBondContact O-N 3.29Å; E64-N68 PolarHBondContact O-ND2 3.01Å
65	G	88.1	Confident	83.8	Confident	37 Å²	37	98.8 Å²	98.8	38%	0.381	49%	0.485	S	S	.	.	H	α-helix	trans	-62.5	-43.8	174.7	0	0	0	0	0	113.4	T61 K62 V63 N68 Q69	T61-G65 PolarHBondContact O-N 3.44Å; K62-G65 PolarHBondContact O-N 3.43Å; V63-G65 VanDerWaalsContact C-N 3.32Å; V63-G65 PolarHBondContact O-N 2.89Å; G65-N68 PolarHBondContact O-N 3.17Å; G65-Q69 WeakPolarHBondContact O-CB 3.27Å; G65-Q69 PolarHBondContact O-N 3.5Å
66	L	82.9	Confident	83.8	Confident	97 Å²	97	101.2 Å²	101.2	51%	0.508	50%	0.504	S	S	.	.	H	α-helix	trans	-70.2	-35.1	176.9	-72.9	171.1	0	0	0	112.4	K62 V63 R70	K62-L66 HydrophobicContact CG-CD1 4.24Å; K62-L66 WeakPolarHBondContact O-CB 3.5Å; K62-L66 VanDerWaalsContact O-CG 3.27Å; K62-L66 WeakPolarHBondContact O-CG 3.35Å; K62-L66 PolarHBondContact O-N 2.76Å; V63-L66 PolarHBondContact O-N 3.28Å; L66-R70 VanDerWaalsContact O-CB 3.24Å; L66-R70 WeakPolarHBondContact O-CB 3.17Å; L66-R70 PolarHBondContact O-N 2.87Å
67	E	84.7	Confident	83.6	Confident	98 Å²	98	101.9 Å²	101.9	46%	0.458	50%	0.503	S	S	.	.	H	α-helix	trans	-68.2	-38.1	173.7	-76.5	-173.9	173.4	0	0	112	V63 E64 R71	V63-E67 HydrophobicContact CG1-CG 4.28Å; V63-E67 WeakPolarHBondContact O-CB 3.5Å; V63-E67 WeakPolarHBondContact O-CG 3.34Å; V63-E67 PolarHBondContact O-N 3.39Å; E64-E67 PolarHBondContact O-N 3.42Å; E67-R71 WeakPolarHBondContact O-CB 3.49Å; E67-R71 PolarHBondContact O-N 3.44Å
68	N	89.3	Confident	83	Confident	85 Å²	85	103.4 Å²	103.4	46%	0.455	50%	0.503	S	S	.	.	H	α-helix	trans	-67.8	-45.6	173.2	-74.8	-18.4	0	0	0	111.1	E64 G65 R70 R71 E72	E64-N68 WeakPolarHBondContact O-CB 3.35Å; E64-N68 VanDerWaalsContact O-CG 3.24Å; E64-N68 PolarHBondContact O-N 3.29Å; E64-N68 PolarHBondContact O-ND2 3.01Å; G65-N68 PolarHBondContact O-N 3.17Å; N68-R70 VanDerWaalsContact C-N 3.34Å; N68-R70 PolarHBondContact O-N 3.45Å; N68-R71 CarbonylContact O-C 3.6Å; N68-R71 WeakPolarHBondContact O-CB 3.37Å; N68-R71 PolarHBondContact O-N 2.92Å; N68-R71 VanDerWaalsContact O-N 3.12Å; N68-E72 WeakPolarHBondContact O-CG 3.36Å; N68-E72 PolarHBondContact O-N 2.85Å
69	Q	86.5	Confident	82.8	Confident	98 Å²	98	100.7 Å²	100.7	46%	0.458	50%	0.498	S	S	.	.	H	α-helix	trans	-60.6	-43.6	174.9	-173.3	-177.6	-12.3	0	0	111.5	G65 R71 E72 E73	G65-Q69 WeakPolarHBondContact O-CB 3.27Å; G65-Q69 PolarHBondContact O-N 3.5Å; Q69-R71 VanDerWaalsContact C-N 3.32Å; Q69-R71 PolarHBondContact O-N 3.39Å; Q69-E72 PolarHBondContact O-N 3.31Å; Q69-E73 PolarHBondContact NE2-OE1 3.42Å; Q69-E73 WeakPolarHBondContact O-CB 3.34Å; Q69-E73 WeakPolarHBondContact O-CG 3.32Å; Q69-E73 PolarHBondContact O-N 2.9Å
70	R	82.9	Confident	82.8	Confident	167 Å²	167	100.4 Å²	100.4	63%	0.63	50%	0.496	S	S	*	.	H	α-helix	trans	-60.5	-42.6	173.8	-176.8	-162.3	159.4	176.5	-2.5	111.1	L66 N68 E73 E74	L66-R70 VanDerWaalsContact O-CB 3.24Å; L66-R70 WeakPolarHBondContact O-CB 3.17Å; L66-R70 PolarHBondContact O-N 2.87Å; N68-R70 VanDerWaalsContact C-N 3.34Å; N68-R70 PolarHBondContact O-N 3.45Å; R70-E73 PolarHBondContact O-N 3.05Å; R70-E74 IonicContact NE-OE2 3.63Å; R70-E74 IonicContact NH2-OE2 3.49Å; R70-E74 WeakPolarHBondContact O-CB 3.27Å; R70-E74 PolarHBondContact O-N 3.41Å
71	R	86.5	Confident	81.9	Confident	140 Å²	140	100.9 Å²	100.9	53%	0.528	50%	0.497	S	S	.	.	H	α-helix	trans	-62.3	-45.4	176.1	-104	-175.4	-90.9	-153.3	-5.4	111.9	E67 N68 Q69 E74 E75	E67-R71 WeakPolarHBondContact O-CB 3.49Å; E67-R71 PolarHBondContact O-N 3.44Å; N68-R71 CarbonylContact O-C 3.6Å; N68-R71 WeakPolarHBondContact O-CB 3.37Å; N68-R71 PolarHBondContact O-N 2.92Å; N68-R71 VanDerWaalsContact O-N 3.12Å; Q69-R71 VanDerWaalsContact C-N 3.32Å; Q69-R71 PolarHBondContact O-N 3.39Å; R71-E74 PolarHBondContact O-N 2.89Å; R71-E75 WeakPolarHBondContact O-CB 3.37Å; R71-E75 WeakPolarHBondContact O-CG 3.41Å; R71-E75 PolarHBondContact O-N 3.49Å
72	E	86.8	Confident	81.2	Confident	136 Å²	136	103.2 Å²	103.2	64%	0.636	50%	0.501	S	S	*	.	H	α-helix	trans	-63.9	-42	176.6	-72.8	177.7	-177.5	0	0	112.2	N68 Q69 S76	N68-E72 WeakPolarHBondContact O-CG 3.36Å; N68-E72 PolarHBondContact O-N 2.85Å; Q69-E72 PolarHBondContact O-N 3.31Å; E72-S76 WeakPolarHBondContact O-CB 3.38Å; E72-S76 PolarHBondContact O-N 3.49Å
73	E	80.8	Confident	80.6	Confident	114 Å²	114	103.8 Å²	103.8	53%	0.533	50%	0.504	S	S	.	.	H	α-helix	trans	-66	-40	174.5	-74.8	177.3	-168.8	0	0	111.6	Q69 R70 Y77	Q69-E73 PolarHBondContact NE2-OE1 3.42Å; Q69-E73 WeakPolarHBondContact O-CB 3.34Å; Q69-E73 WeakPolarHBondContact O-CG 3.32Å; Q69-E73 PolarHBondContact O-N 2.9Å; R70-E73 PolarHBondContact O-N 3.05Å; E73-Y77 WeakPolarHBondContact O-CB 3.38Å; E73-Y77 PolarHBondContact O-N 2.93Å
74	E	78.3	Confident	79.6	Confident	71 Å²	71	105.5 Å²	105.5	33%	0.332	51%	0.51	S	S	.	.	H	α-helix	trans	-67.2	-43.4	176.4	-175.6	163.9	-174.2	0	0	111.1	R70 R71 Y77 Y78	R70-E74 IonicContact NE-OE2 3.63Å; R70-E74 IonicContact NH2-OE2 3.49Å; R70-E74 WeakPolarHBondContact O-CB 3.27Å; R70-E74 PolarHBondContact O-N 3.41Å; R71-E74 PolarHBondContact O-N 2.89Å; E74-Y77 PolarHBondContact O-N 3.34Å; E74-Y78 HydrophobicContact CG-CD2 3.72Å; E74-Y78 HydrophobicContact CG-CE2 3.34Å; E74-Y78 WeakPolarHBondContact O-CB 3.17Å; E74-Y78 WeakPolarHBondContact O-CD2 3.04Å; E74-Y78 PolarHBondContact O-N 3.4Å; E74-Y78 WeakPolarHBondContact OE1-CE2 3.41Å
75	E	84.7	Confident	78.2	Confident	134 Å²	134	103.1 Å²	103.1	63%	0.626	50%	0.5	S	S	*	.	H	α-helix	trans	-64.8	-44.4	173.1	-77.1	-179	-175.9	0	0	112.3	R71 Y77 Y78 A79	R71-E75 WeakPolarHBondContact O-CB 3.37Å; R71-E75 WeakPolarHBondContact O-CG 3.41Å; R71-E75 PolarHBondContact O-N 3.49Å; E75-Y77 VanDerWaalsContact C-N 3.33Å; E75-Y77 PolarHBondContact O-N 3.12Å; E75-Y78 PolarHBondContact O-N 3.01Å; E75-A79 VanDerWaalsContact O-CB 3.25Å; E75-A79 WeakPolarHBondContact O-CB 3.45Å; E75-A79 PolarHBondContact O-N 3.22Å
76	S	80.9	Confident	76.9	Confident	73 Å²	73	103.1 Å²	103.1	51%	0.51	50%	0.497	S	S	.	.	H	α-helix	trans	-63.7	-39	175.3	-179.8	0	0	0	0	111.9	E72 S80	E72-S76 WeakPolarHBondContact O-CB 3.38Å; E72-S76 PolarHBondContact O-N 3.49Å; S76-S80 VanDerWaalsContact O-CB 3.24Å; S76-S80 WeakPolarHBondContact O-CB 3.31Å; S76-S80 PolarHBondContact O-N 3.06Å; S76-S80 PolarHBondContact O-OG 2.68Å
77	Y	77	Confident	75.8	Confident	149 Å²	149	101.1 Å²	101.1	58%	0.584	49%	0.494	S	S	*	.	H	α-helix	trans	-66	-46.9	173.7	179.4	-97	0	0	0	111.1	E73 E74 E75 S80 L81	E73-Y77 WeakPolarHBondContact O-CB 3.38Å; E73-Y77 PolarHBondContact O-N 2.93Å; E74-Y77 PolarHBondContact O-N 3.34Å; E75-Y77 VanDerWaalsContact C-N 3.33Å; E75-Y77 PolarHBondContact O-N 3.12Å; Y77-S80 PolarHBondContact O-N 3.07Å; Y77-L81 HydrophobicContact CE1-CD1 4.29Å; Y77-L81 WeakPolarHBondContact O-CB 3.48Å; Y77-L81 PolarHBondContact O-N 3.47Å
78	Y	73.9	Confident	74.2	Confident	129 Å²	129	100.7 Å²	100.7	51%	0.506	50%	0.495	S	S	.	.	H	α-helix	trans	-64.6	-38.2	175.6	-77.9	-60.5	0	0	0	112.3	E74 E75 L81 E82	E74-Y78 HydrophobicContact CG-CD2 3.72Å; E74-Y78 HydrophobicContact CG-CE2 3.34Å; E74-Y78 WeakPolarHBondContact O-CB 3.17Å; E74-Y78 WeakPolarHBondContact O-CD2 3.04Å; E74-Y78 PolarHBondContact O-N 3.4Å; E74-Y78 WeakPolarHBondContact OE1-CE2 3.41Å; E75-Y78 PolarHBondContact O-N 3.01Å; Y78-L81 HydrophobicContact CD1-CD2 4.42Å; Y78-L81 CarbonylContact O-C 3.43Å; Y78-L81 WeakPolarHBondContact O-CB 3.16Å; Y78-L81 PolarHBondContact O-N 3.41Å; Y78-E82 WeakPolarHBondContact O-CB 3.21Å; Y78-E82 PolarHBondContact O-N 3.24Å
79	A	78.7	Confident	72.2	Confident	46 Å²	46	100.2 Å²	100.2	38%	0.38	49%	0.49	S	S	.	.	H	α-helix	trans	-68.6	-37	175.4	0	0	0	0	0	112.2	E75 E82 K83	E75-A79 VanDerWaalsContact O-CB 3.25Å; E75-A79 WeakPolarHBondContact O-CB 3.45Å; E75-A79 PolarHBondContact O-N 3.22Å; A79-E82 PolarHBondContact O-N 3.31Å; A79-K83 WeakPolarHBondContact O-CB 3.22Å; A79-K83 WeakPolarHBondContact O-CG 3.42Å; A79-K83 PolarHBondContact O-N 3.38Å
80	S	75.7	Confident	70.4	Confident	57 Å²	57	101.4 Å²	101.4	40%	0.399	50%	0.498	S	S	.	.	H	α-helix	trans	-69.9	-39.8	172.6	-64.2	0	0	0	0	111.3	S76 Y77 E82 K83 L84	S76-S80 VanDerWaalsContact O-CB 3.24Å; S76-S80 WeakPolarHBondContact O-CB 3.31Å; S76-S80 PolarHBondContact O-N 3.06Å; S76-S80 PolarHBondContact O-OG 2.68Å; Y77-S80 PolarHBondContact O-N 3.07Å; S80-E82 VanDerWaalsContact C-N 3.33Å; S80-K83 PolarHBondContact O-N 2.86Å; S80-L84 VanDerWaalsContact O-CB 3.27Å; S80-L84 WeakPolarHBondContact O-CB 3.39Å; S80-L84 VanDerWaalsContact O-CG 3.25Å; S80-L84 WeakPolarHBondContact O-CG 3.43Å; S80-L84 PolarHBondContact O-N 2.86Å
81	L	66.2	Low	68.4	Low	61 Å²	61	96.3 Å²	96.3	32%	0.319	49%	0.488	S	S	.	.	H	α-helix	trans	-63.1	-41.5	172.6	-164.8	91.4	0	0	0	109.8	Y77 Y78 L84 L85	Y77-L81 HydrophobicContact CE1-CD1 4.29Å; Y77-L81 WeakPolarHBondContact O-CB 3.48Å; Y77-L81 PolarHBondContact O-N 3.47Å; Y78-L81 HydrophobicContact CD1-CD2 4.42Å; Y78-L81 CarbonylContact O-C 3.43Å; Y78-L81 WeakPolarHBondContact O-CB 3.16Å; Y78-L81 PolarHBondContact O-N 3.41Å; L81-L84 CarbonylContact O-C 3.56Å; L81-L84 PolarHBondContact O-N 2.87Å; L81-L85 HydrophobicContact CD2-CD1 3.79Å; L81-L85 HydrophobicContact CG-CD1 3.83Å; L81-L85 HydrophobicContact CG-CG 4.27Å; L81-L85 WeakPolarHBondContact O-CA 3.35Å; L81-L85 WeakPolarHBondContact O-CB 3.4Å; L81-L85 WeakPolarHBondContact O-CD1 3.49Å; L81-L85 WeakPolarHBondContact O-CG 3.35Å; L81-L85 PolarHBondContact O-N 2.84Å
82	E	70.3	Confident	66.2	Low	140 Å²	140	96.4 Å²	96.4	65%	0.654	49%	0.488	S	S	*	.	H	α-helix	trans	-68.5	-40.9	176.7	-166.7	175.8	-159	0	0	110.8	Y78 A79 S80 L85 A86	Y78-E82 WeakPolarHBondContact O-CB 3.21Å; Y78-E82 PolarHBondContact O-N 3.24Å; A79-E82 PolarHBondContact O-N 3.31Å; S80-E82 VanDerWaalsContact C-N 3.33Å; E82-L85 CarbonylContact O-C 3.6Å; E82-L85 PolarHBondContact O-N 3.17Å; E82-A86 WeakPolarHBondContact O-CA 3.2Å; E82-A86 WeakPolarHBondContact O-CB 3.45Å; E82-A86 PolarHBondContact O-N 3.39Å
83	K	71.4	Confident	64.3	Low	160 Å²	160	99.5 Å²	99.5	70%	0.696	49%	0.494	S	S	*	.	H	α-helix	trans	-63.2	-42.2	170.3	-81.6	177.7	-179	173.8	0	112.8	A79 S80 A86 A87	A79-K83 WeakPolarHBondContact O-CB 3.22Å; A79-K83 WeakPolarHBondContact O-CG 3.42Å; A79-K83 PolarHBondContact O-N 3.38Å; S80-K83 PolarHBondContact O-N 2.86Å; K83-A86 CarbonylContact O-C 3.53Å; K83-A86 PolarHBondContact O-N 3.41Å; K83-A87 WeakPolarHBondContact O-CB 3.3Å; K83-A87 PolarHBondContact O-N 2.96Å
84	L	59.2	Low	62.6	Low	113 Å²	113	99.4 Å²	99.4	59%	0.592	50%	0.497	S	S	*	.	H	α-helix	trans	-71	-35.9	176.8	-76.9	170.4	0	0	0	111.3	S80 L81 N88	S80-L84 VanDerWaalsContact O-CB 3.27Å; S80-L84 WeakPolarHBondContact O-CB 3.39Å; S80-L84 VanDerWaalsContact O-CG 3.25Å; S80-L84 WeakPolarHBondContact O-CG 3.43Å; S80-L84 PolarHBondContact O-N 2.86Å; L81-L84 CarbonylContact O-C 3.56Å; L81-L84 PolarHBondContact O-N 2.87Å; L84-N88 WeakPolarHBondContact O-CB 3.41Å; L84-N88 PolarHBondContact O-N 3.13Å; L84-N88 PolarHBondContact O-ND2 3.29Å
85	L	57.7	Low	60.6	Low	61 Å²	61	102.5 Å²	102.5	32%	0.319	52%	0.515	S	S	.	.	H	α-helix	trans	-71.1	-37.3	174.5	-76.7	169.7	0	0	0	110.2	L81 E82 N88 E89	L81-L85 HydrophobicContact CD2-CD1 3.79Å; L81-L85 HydrophobicContact CG-CD1 3.83Å; L81-L85 HydrophobicContact CG-CG 4.27Å; L81-L85 WeakPolarHBondContact O-CA 3.35Å; L81-L85 WeakPolarHBondContact O-CB 3.4Å; L81-L85 WeakPolarHBondContact O-CD1 3.49Å; L81-L85 WeakPolarHBondContact O-CG 3.35Å; L81-L85 PolarHBondContact O-N 2.84Å; E82-L85 CarbonylContact O-C 3.6Å; E82-L85 PolarHBondContact O-N 3.17Å; L85-N88 CarbonylContact O-C 3.6Å; L85-N88 WeakPolarHBondContact O-CA 3.46Å; L85-N88 WeakPolarHBondContact O-CB 3.41Å; L85-N88 PolarHBondContact O-N 3.25Å; L85-E89 VanDerWaalsContact O-CA 3.23Å; L85-E89 WeakPolarHBondContact O-CA 3.09Å; L85-E89 WeakPolarHBondContact O-CB 3.44Å; L85-E89 PolarHBondContact O-N 3.34Å
86	A	61.1	Low	58.3	Low	37 Å²	37	100.5 Å²	100.5	31%	0.306	51%	0.513	S	S	.	.	H	α-helix	trans	-72.3	-38.5	175.1	0	0	0	0	0	112.5	E82 K83 E89 I90	E82-A86 WeakPolarHBondContact O-CA 3.2Å; E82-A86 WeakPolarHBondContact O-CB 3.45Å; E82-A86 PolarHBondContact O-N 3.39Å; K83-A86 CarbonylContact O-C 3.53Å; K83-A86 PolarHBondContact O-N 3.41Å; A86-E89 VanDerWaalsContact C-N 3.25Å; A86-E89 VanDerWaalsContact CA-CB 3.47Å; A86-E89 CarbonylContact O-C 3.55Å; A86-E89 WeakPolarHBondContact O-CA 3.5Å; A86-E89 WeakPolarHBondContact O-CB 3.36Å; A86-E89 PolarHBondContact O-N 2.87Å; A86-I90 VanDerWaalsContact O-CG1 3.31Å; A86-I90 WeakPolarHBondContact O-CG1 3.43Å; A86-I90 PolarHBondContact O-N 3.1Å
87	A	59.5	Low	56.4	Low	55 Å²	55	103.2 Å²	103.2	46%	0.455	51%	0.512	S	S	.	.	H	α-helix	trans	-69.2	-40.3	168.5	0	0	0	0	0	110.2	K83 E89 S91	K83-A87 WeakPolarHBondContact O-CB 3.3Å; K83-A87 PolarHBondContact O-N 2.96Å; A87-E89 PolarHBondContact O-N 3.2Å; A87-S91 PolarHBondContact O-N 2.73Å; A87-S91 PolarHBondContact O-OG 3.05Å
88	N	49.7	Very low	54.5	Low	89 Å²	89	100.6 Å²	100.6	48%	0.476	51%	0.512	S	S	.	.	H	α-helix	trans	-68.9	-15.4	163.4	-85.8	-61.4	0	0	0	112.4	L84 L85 S91 R92	L84-N88 WeakPolarHBondContact O-CB 3.41Å; L84-N88 PolarHBondContact O-N 3.13Å; L84-N88 PolarHBondContact O-ND2 3.29Å; L85-N88 CarbonylContact O-C 3.6Å; L85-N88 WeakPolarHBondContact O-CA 3.46Å; L85-N88 WeakPolarHBondContact O-CB 3.41Å; L85-N88 PolarHBondContact O-N 3.25Å; N88-S91 CarbonylContact O-C 3.44Å; N88-S91 VanDerWaalsContact O-C 3.26Å; N88-S91 WeakPolarHBondContact O-CA 3.45Å; N88-S91 WeakPolarHBondContact O-CB 3.43Å; N88-S91 PolarHBondContact O-N 3.4Å; N88-R92 WeakPolarHBondContact O-CA 3.47Å; N88-R92 WeakPolarHBondContact O-CB 3.36Å; N88-R92 WeakPolarHBondContact O-CG 3.49Å; N88-R92 PolarHBondContact O-N 2.92Å
89	E	48.2	Very low	52.9	Low	75 Å²	75	100.9 Å²	100.9	35%	0.35	53%	0.53	S	S	.	.	H	α-helix	trans	-93.7	-30.4	-176.2	-136	174.4	-132	0	0	109.7	L85 A86 A87 S91 R92 R93	L85-E89 VanDerWaalsContact O-CA 3.23Å; L85-E89 WeakPolarHBondContact O-CA 3.09Å; L85-E89 WeakPolarHBondContact O-CB 3.44Å; L85-E89 PolarHBondContact O-N 3.34Å; A86-E89 VanDerWaalsContact C-N 3.25Å; A86-E89 VanDerWaalsContact CA-CB 3.47Å; A86-E89 CarbonylContact O-C 3.55Å; A86-E89 WeakPolarHBondContact O-CA 3.5Å; A86-E89 WeakPolarHBondContact O-CB 3.36Å; A86-E89 PolarHBondContact O-N 2.87Å; A87-E89 PolarHBondContact O-N 3.2Å; E89-S91 PolarHBondContact O-N 3.39Å; E89-R92 HydrophobicContact CG-CB 4.37Å; E89-R92 CarbonylContact O-C 3.09Å; E89-R92 PolarHBondContact O-N 3.09Å; E89-R93 WeakPolarHBondContact O-CA 3.47Å; E89-R93 WeakPolarHBondContact O-CB 3.34Å; E89-R93 WeakPolarHBondContact O-CG 3.38Å; E89-R93 PolarHBondContact O-N 3.33Å; E89-R93 IonicContact OE2-CZ 3.31Å; E89-R93 IonicContact OE2-NE 2.65Å; E89-R93 IonicContact OE2-NH2 3.01Å; E89-R93 PolarHBondContact OE2-NH2 3.4Å
90	I	47.9	Very low	51.1	Low	123 Å²	123	103.5 Å²	103.5	63%	0.631	54%	0.537	S	S	*	.	H	α-helix	trans	-59.3	-34.1	158.5	-65.7	163.8	0	0	0	108.4	A86	A86-I90 VanDerWaalsContact O-CG1 3.31Å; A86-I90 WeakPolarHBondContact O-CG1 3.43Å; A86-I90 PolarHBondContact O-N 3.1Å
91	S	42.1	Very low	49.4	Very low	60 Å²	60	103.1 Å²	103.1	42%	0.42	54%	0.537	S	S	.	.	H	α-helix	trans	-79.6	-28.1	171.1	-57.5	0	0	0	0	114.8	A87 N88 E89	A87-S91 PolarHBondContact O-N 2.73Å; A87-S91 PolarHBondContact O-OG 3.05Å; N88-S91 CarbonylContact O-C 3.44Å; N88-S91 VanDerWaalsContact O-C 3.26Å; N88-S91 WeakPolarHBondContact O-CA 3.45Å; N88-S91 WeakPolarHBondContact O-CB 3.43Å; N88-S91 PolarHBondContact O-N 3.4Å; E89-S91 PolarHBondContact O-N 3.39Å
92	R	40.1	Very low	48.2	Very low	141 Å²	141	103.8 Å²	103.8	53%	0.532	55%	0.552	S	S	.	*	H	α-helix	trans	-88.7	-28.4	179.3	-75.2	166.4	167.3	174.3	0.8	113.2	N88 E89 L94 L95	N88-R92 WeakPolarHBondContact O-CA 3.47Å; N88-R92 WeakPolarHBondContact O-CB 3.36Å; N88-R92 WeakPolarHBondContact O-CG 3.49Å; N88-R92 PolarHBondContact O-N 2.92Å; E89-R92 HydrophobicContact CG-CB 4.37Å; E89-R92 CarbonylContact O-C 3.09Å; E89-R92 PolarHBondContact O-N 3.09Å; R92-L94 PolarHBondContact O-N 3.01Å; R92-L95 CarbonylContact O-C 3.39Å; R92-L95 PolarHBondContact O-N 3.27Å; R92-L95 VanDerWaalsContact O-N 3.1Å
93	R	46.1	Very low	46.8	Very low	201 Å²	201	100.2 Å²	100.2	76%	0.758	54%	0.542	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.9	-14.8	172.3	-75.3	176.3	-168.9	-176.7	7.2	111.2	E89	E89-R93 WeakPolarHBondContact O-CA 3.47Å; E89-R93 WeakPolarHBondContact O-CB 3.34Å; E89-R93 WeakPolarHBondContact O-CG 3.38Å; E89-R93 PolarHBondContact O-N 3.33Å; E89-R93 IonicContact OE2-CZ 3.31Å; E89-R93 IonicContact OE2-NE 2.65Å; E89-R93 IonicContact OE2-NH2 3.01Å; E89-R93 PolarHBondContact OE2-NH2 3.4Å
94	L	45.9	Very low	45.7	Very low	112 Å²	112	95.3 Å²	95.3	59%	0.586	53%	0.531	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.2	-5.8	171.1	-78.7	166.3	0	0	0	115	R92	R92-L94 PolarHBondContact O-N 3.01Å
95	L	36.8	Very low	45.1	Very low	137 Å²	137	95.3 Å²	95.3	72%	0.717	53%	0.527	S	S	*	.			trans	174.2	129.2	165.7	-100.4	140.9	0	0	0	113.3	R92	R92-L95 CarbonylContact O-C 3.39Å; R92-L95 PolarHBondContact O-N 3.27Å; R92-L95 VanDerWaalsContact O-N 3.1Å
96	P	35.9	Very low	45	Very low	91 Å²	91	96.8 Å²	96.8	59%	0.591	54%	0.538	S	S	*	.			trans	-99.3	125.4	179.8	34.6	-27.8	0	0	0	114.1
97	R	41.1	Very low	45	Very low	130 Å²	130	97.5 Å²	97.5	49%	0.491	54%	0.544	S	S	.	.	S	Bend	trans	143.8	132.4	141.2	-80.1	175.3	173.7	162.9	2.2	113.4	I875	R97-I875 VanDerWaalsContact NH1-C 3.34Å; R97-I875 PolarHBondContact NH1-O 3.46Å
98	T	37.5	Very low	45.1	Very low	94 Å²	94	99.3 Å²	99.3	58%	0.577	54%	0.543	S	S	*	.	S	Bend	trans	81	144.4	176.6	74.1	0	0	0	0	116.7	L100 A101	T98-L100 PolarHBondContact O-N 2.91Å; T98-A101 PolarHBondContact O-N 3.35Å
99	P	39.7	Very low	46	Very low	136 Å²	136	100.3 Å²	100.3	88%	0.883	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	11.1	172.4	28.5	-33.9	0	0	0	113.4
100	L	41.5	Very low	47	Very low	100 Å²	100	100.1 Å²	100.1	52%	0.524	56%	0.555	S	S	.	*	T	Hydrogen-bonded Turn	trans	-89.5	0.3	169.6	-78.8	98.8	0	0	0	113.9	T98 A102 S103 A104	T98-L100 PolarHBondContact O-N 2.91Å; L100-A102 PolarHBondContact O-N 2.96Å; L100-S103 CarbonylContact O-C 3.49Å; L100-S103 VanDerWaalsContact O-C 3.23Å; L100-S103 WeakPolarHBondContact O-CA 3.39Å; L100-S103 WeakPolarHBondContact O-CB 3.45Å; L100-S103 PolarHBondContact O-N 3.37Å; L100-A104 PolarHBondContact O-N 2.72Å
101	A	39.6	Very low	48.2	Very low	49 Å²	49	100.8 Å²	100.8	41%	0.405	56%	0.555	S	S	.	*	H	α-helix	trans	-65.1	-33.4	-175.1	0	0	0	0	0	114.6	T98 S103 A104 K105	T98-A101 PolarHBondContact O-N 3.35Å; A101-S103 VanDerWaalsContact C-N 3.31Å; A101-A104 PolarHBondContact O-N 2.66Å; A101-K105 PolarHBondContact O-N 3.31Å
102	A	41.4	Very low	49.7	Very low	75 Å²	75	103.6 Å²	103.6	62%	0.62	56%	0.56	S	S	*	*	H	α-helix	trans	-63.8	-40.3	166.6	0	0	0	0	0	110.5	L100 A104 V106	L100-A102 PolarHBondContact O-N 2.96Å; A102-A104 VanDerWaalsContact C-N 3.32Å; A102-A104 PolarHBondContact O-N 2.79Å; A102-V106 WeakPolarHBondContact O-CB 3.31Å; A102-V106 WeakPolarHBondContact O-CG2 3.45Å; A102-V106 PolarHBondContact O-N 2.82Å
103	S	41.4	Very low	51.4	Low	65 Å²	65	100.4 Å²	100.4	46%	0.455	56%	0.556	S	S	.	*	H	α-helix	trans	-67.2	-24.5	172.4	171.7	0	0	0	0	113.8	L100 A101 A107	L100-S103 CarbonylContact O-C 3.49Å; L100-S103 VanDerWaalsContact O-C 3.23Å; L100-S103 WeakPolarHBondContact O-CA 3.39Å; L100-S103 WeakPolarHBondContact O-CB 3.45Å; L100-S103 PolarHBondContact O-N 3.37Å; A101-S103 VanDerWaalsContact C-N 3.31Å; S103-A107 WeakPolarHBondContact O-CA 3.25Å; S103-A107 WeakPolarHBondContact O-CB 3.38Å; S103-A107 PolarHBondContact O-N 3.45Å
104	A	47.2	Very low	52.8	Low	57 Å²	57	94.6 Å²	94.6	47%	0.471	55%	0.546	S	S	.	.	H	α-helix	trans	-86.3	-40.5	-179.7	0	0	0	0	0	111.3	L100 A101 A102 V106 A107 E108	L100-A104 PolarHBondContact O-N 2.72Å; A101-A104 PolarHBondContact O-N 2.66Å; A102-A104 VanDerWaalsContact C-N 3.32Å; A102-A104 PolarHBondContact O-N 2.79Å; A104-V106 VanDerWaalsContact C-N 3.34Å; A104-A107 CarbonylContact O-C 3.26Å; A104-A107 PolarHBondContact O-N 2.65Å; A104-E108 WeakPolarHBondContact O-CB 3.47Å; A104-E108 PolarHBondContact O-N 3.12Å
105	K	46.8	Very low	54.2	Low	114 Å²	114	92.1 Å²	92.1	50%	0.496	54%	0.538	S	S	.	.	H	α-helix	trans	-67.6	-35.3	165.9	-85.8	-163.5	175.3	-175.8	0	111.8	A101 A107 L109	A101-K105 PolarHBondContact O-N 3.31Å; K105-A107 VanDerWaalsContact C-N 3.34Å; K105-L109 WeakPolarHBondContact O-CA 3.4Å; K105-L109 WeakPolarHBondContact O-CB 3.27Å; K105-L109 PolarHBondContact O-N 3.03Å
106	V	56.4	Low	56.1	Low	92 Å²	92	89.1 Å²	89.1	56%	0.558	53%	0.525	S	S	*	.	H	α-helix	trans	-69.1	-32.2	170.4	169.3	0	0	0	0	110.9	A102 A104 S110	A102-V106 WeakPolarHBondContact O-CB 3.31Å; A102-V106 WeakPolarHBondContact O-CG2 3.45Å; A102-V106 PolarHBondContact O-N 2.82Å; A104-V106 VanDerWaalsContact C-N 3.34Å; V106-S110 WeakPolarHBondContact O-CA 3.4Å; V106-S110 WeakPolarHBondContact O-CB 3.36Å; V106-S110 PolarHBondContact O-N 3.28Å
107	A	60.9	Low	57.9	Low	52 Å²	52	87.3 Å²	87.3	43%	0.43	52%	0.515	S	S	.	.	H	α-helix	trans	-75.9	-40.6	175	0	0	0	0	0	112.6	S103 A104 K105 S110 E111	S103-A107 WeakPolarHBondContact O-CA 3.25Å; S103-A107 WeakPolarHBondContact O-CB 3.38Å; S103-A107 PolarHBondContact O-N 3.45Å; A104-A107 CarbonylContact O-C 3.26Å; A104-A107 PolarHBondContact O-N 2.65Å; K105-A107 VanDerWaalsContact C-N 3.34Å; A107-S110 CarbonylContact O-C 3.23Å; A107-S110 PolarHBondContact O-N 3.17Å; A107-E111 WeakPolarHBondContact O-CB 3.33Å; A107-E111 PolarHBondContact O-N 3.37Å
108	E	62.1	Low	59.5	Low	92 Å²	92	84.2 Å²	84.2	43%	0.43	52%	0.517	S	S	.	.	H	α-helix	trans	-68.5	-40.8	173.4	-169.5	-160	152.9	0	0	110.4	A104 S110 E111 K112	A104-E108 WeakPolarHBondContact O-CB 3.47Å; A104-E108 PolarHBondContact O-N 3.12Å; E108-S110 VanDerWaalsContact C-N 3.32Å; E108-E111 PolarHBondContact O-N 2.96Å; E108-K112 VanDerWaalsContact O-CB 3.32Å; E108-K112 WeakPolarHBondContact O-CB 3.15Å; E108-K112 PolarHBondContact O-N 3.21Å; E108-K112 IonicContact OE1-NZ 3.1Å; E108-K112 PolarHBondContact OE1-NZ 3.42Å
109	L	68.8	Low	61.3	Low	110 Å²	110	89.2 Å²	89.2	58%	0.576	53%	0.525	S	S	*	.	H	α-helix	trans	-63.2	-41.2	169.4	-175.9	70.1	0	0	0	109.8	K105 V113	K105-L109 WeakPolarHBondContact O-CA 3.4Å; K105-L109 WeakPolarHBondContact O-CB 3.27Å; K105-L109 PolarHBondContact O-N 3.03Å; L109-V113 HydrophobicContact CD1-CG2 4.11Å; L109-V113 HydrophobicContact CG-CG2 4.03Å; L109-V113 WeakPolarHBondContact O-CA 3.42Å; L109-V113 WeakPolarHBondContact O-CB 3.43Å; L109-V113 WeakPolarHBondContact O-CG2 3.29Å; L109-V113 PolarHBondContact O-N 2.88Å
110	S	67.5	Low	63.2	Low	72 Å²	72	87.5 Å²	87.5	50%	0.503	51%	0.508	S	S	.	.	H	α-helix	trans	-67.5	-35.1	177	-173.8	0	0	0	0	111.7	V106 A107 E108 V113 S114	V106-S110 WeakPolarHBondContact O-CA 3.4Å; V106-S110 WeakPolarHBondContact O-CB 3.36Å; V106-S110 PolarHBondContact O-N 3.28Å; A107-S110 CarbonylContact O-C 3.23Å; A107-S110 PolarHBondContact O-N 3.17Å; E108-S110 VanDerWaalsContact C-N 3.32Å; S110-V113 CarbonylContact O-C 3.59Å; S110-S114 WeakPolarHBondContact O-CA 3.5Å; S110-S114 WeakPolarHBondContact O-CB 3.38Å; S110-S114 PolarHBondContact O-N 3.3Å
111	E	73.4	Confident	64.9	Low	136 Å²	136	86.8 Å²	86.8	64%	0.636	51%	0.507	S	S	*	.	H	α-helix	trans	-71.8	-46.8	175.4	-174.2	178.8	-168.5	0	0	110.9	A107 E108 S114 S115	A107-E111 WeakPolarHBondContact O-CB 3.33Å; A107-E111 PolarHBondContact O-N 3.37Å; E108-E111 PolarHBondContact O-N 2.96Å; E111-S114 CarbonylContact O-C 3.49Å; E111-S114 PolarHBondContact O-N 3.33Å; E111-S114 VanDerWaalsContact O-N 3.15Å; E111-S115 WeakPolarHBondContact O-CB 2.99Å; E111-S115 PolarHBondContact O-N 2.94Å
112	K	74.7	Confident	66.7	Low	120 Å²	120	90.5 Å²	90.5	52%	0.522	52%	0.516	S	S	.	.	H	α-helix	trans	-62.1	-44.2	172.1	-82.4	175.4	174.5	159.3	0	111.1	E108 S114 S115 V116	E108-K112 VanDerWaalsContact O-CB 3.32Å; E108-K112 WeakPolarHBondContact O-CB 3.15Å; E108-K112 PolarHBondContact O-N 3.21Å; E108-K112 IonicContact OE1-NZ 3.1Å; E108-K112 PolarHBondContact OE1-NZ 3.42Å; K112-S114 VanDerWaalsContact C-N 3.28Å; K112-S114 PolarHBondContact O-N 3.39Å; K112-S115 PolarHBondContact O-N 3.12Å; K112-V116 WeakPolarHBondContact O-CB 3.33Å; K112-V116 WeakPolarHBondContact O-CG2 3.4Å; K112-V116 PolarHBondContact O-N 2.82Å
113	V	74.4	Confident	68.4	Low	74 Å²	74	91.4 Å²	91.4	45%	0.448	51%	0.51	S	S	.	.	H	α-helix	trans	-61.2	-39	173.1	166.6	0	0	0	0	109.4	L109 S110 S117	L109-V113 HydrophobicContact CD1-CG2 4.11Å; L109-V113 HydrophobicContact CG-CG2 4.03Å; L109-V113 WeakPolarHBondContact O-CA 3.42Å; L109-V113 WeakPolarHBondContact O-CB 3.43Å; L109-V113 WeakPolarHBondContact O-CG2 3.29Å; L109-V113 PolarHBondContact O-N 2.88Å; S110-V113 CarbonylContact O-C 3.59Å; V113-S117 WeakPolarHBondContact O-CA 3.5Å; V113-S117 WeakPolarHBondContact O-CB 3.31Å; V113-S117 PolarHBondContact O-N 3Å; V113-S117 PolarHBondContact O-OG 3.4Å
114	S	75.3	Confident	70.2	Confident	79 Å²	79	89.5 Å²	89.5	55%	0.552	50%	0.5	S	S	*	.	H	α-helix	trans	-71.8	-40.5	178.3	-162	0	0	0	0	112	S110 E111 K112 A118	S110-S114 WeakPolarHBondContact O-CA 3.5Å; S110-S114 WeakPolarHBondContact O-CB 3.38Å; S110-S114 PolarHBondContact O-N 3.3Å; E111-S114 CarbonylContact O-C 3.49Å; E111-S114 PolarHBondContact O-N 3.33Å; E111-S114 VanDerWaalsContact O-N 3.15Å; K112-S114 VanDerWaalsContact C-N 3.28Å; K112-S114 PolarHBondContact O-N 3.39Å; S114-A118 VanDerWaalsContact O-CB 3.27Å; S114-A118 WeakPolarHBondContact O-CB 3.39Å; S114-A118 PolarHBondContact O-N 2.84Å
115	S	75.8	Confident	71.7	Confident	60 Å²	60	91.4 Å²	91.4	42%	0.42	50%	0.503	S	S	.	.	H	α-helix	trans	-66.2	-45.5	174.4	130.2	0	0	0	0	111.9	E111 K112 A118 R119	E111-S115 WeakPolarHBondContact O-CB 2.99Å; E111-S115 PolarHBondContact O-N 2.94Å; K112-S115 PolarHBondContact O-N 3.12Å; S115-A118 PolarHBondContact O-N 3.34Å; S115-R119 PolarHBondContact O-N 3.3Å; S115-R119 VanDerWaalsContact O-N 3.07Å
116	V	77.3	Confident	73.4	Confident	73 Å²	73	91.2 Å²	91.2	44%	0.442	50%	0.504	S	S	.	.	H	α-helix	trans	-69.1	-41.5	177.3	171.2	0	0	0	0	109.7	K112 A118 R119 I120	K112-V116 WeakPolarHBondContact O-CB 3.33Å; K112-V116 WeakPolarHBondContact O-CG2 3.4Å; K112-V116 PolarHBondContact O-N 2.82Å; V116-A118 VanDerWaalsContact C-N 3.35Å; V116-A118 PolarHBondContact O-N 3.08Å; V116-R119 PolarHBondContact O-N 3.49Å; V116-I120 HydrophobicContact CG1-CD1 3.43Å; V116-I120 VanDerWaalsContact CG1-CD1 3.43Å; V116-I120 HydrophobicContact CG1-CG1 4.04Å; V116-I120 VanDerWaalsContact O-CB 3.26Å; V116-I120 WeakPolarHBondContact O-CB 3.24Å; V116-I120 VanDerWaalsContact O-CG1 3.22Å; V116-I120 WeakPolarHBondContact O-CG1 3.47Å; V116-I120 PolarHBondContact O-N 2.89Å
117	S	72.9	Confident	74.3	Confident	54 Å²	54	91.7 Å²	91.7	38%	0.378	50%	0.502	S	S	.	.	H	α-helix	trans	-62.6	-40	173.1	-61.8	0	0	0	0	111.2	V113 R119 I120 V121	V113-S117 WeakPolarHBondContact O-CA 3.5Å; V113-S117 WeakPolarHBondContact O-CB 3.31Å; V113-S117 PolarHBondContact O-N 3Å; V113-S117 PolarHBondContact O-OG 3.4Å; S117-R119 PolarHBondContact O-N 3.31Å; S117-I120 PolarHBondContact O-N 3.47Å; S117-V121 WeakPolarHBondContact O-CB 3.48Å; S117-V121 WeakPolarHBondContact O-CG2 3.09Å; S117-V121 PolarHBondContact O-N 3.49Å
118	A	75.6	Confident	75.1	Confident	65 Å²	65	95.6 Å²	95.6	54%	0.537	51%	0.512	S	S	.	.	H	α-helix	trans	-62.9	-40.9	176	0	0	0	0	0	112.2	S114 S115 V116 H122	S114-A118 VanDerWaalsContact O-CB 3.27Å; S114-A118 WeakPolarHBondContact O-CB 3.39Å; S114-A118 PolarHBondContact O-N 2.84Å; S115-A118 PolarHBondContact O-N 3.34Å; V116-A118 VanDerWaalsContact C-N 3.35Å; V116-A118 PolarHBondContact O-N 3.08Å; A118-H122 PolarHBondContact O-N 2.98Å
119	R	75.9	Confident	75.9	Confident	199 Å²	199	95 Å²	95	75%	0.751	52%	0.518	S	S	*	.	H	α-helix	trans	-71.3	-39	174.3	-69.2	-177.7	-177.2	-168.4	1.6	112.6	S115 V116 S117 H122 L123	S115-R119 PolarHBondContact O-N 3.3Å; S115-R119 VanDerWaalsContact O-N 3.07Å; V116-R119 PolarHBondContact O-N 3.49Å; S117-R119 PolarHBondContact O-N 3.31Å; R119-H122 PolarHBondContact O-N 3.42Å; R119-L123 PolarHBondContact O-N 3.4Å; R119-L123 VanDerWaalsContact O-N 3.09Å
120	I	79.2	Confident	76.3	Confident	100 Å²	100	94.9 Å²	94.9	51%	0.513	52%	0.521	S	S	.	.	H	α-helix	trans	-71	-33.6	178.1	-72.3	176.6	0	0	0	111.3	V116 S117 H122 L123 G124	V116-I120 HydrophobicContact CG1-CD1 3.43Å; V116-I120 VanDerWaalsContact CG1-CD1 3.43Å; V116-I120 HydrophobicContact CG1-CG1 4.04Å; V116-I120 VanDerWaalsContact O-CB 3.26Å; V116-I120 WeakPolarHBondContact O-CB 3.24Å; V116-I120 VanDerWaalsContact O-CG1 3.22Å; V116-I120 WeakPolarHBondContact O-CG1 3.47Å; V116-I120 PolarHBondContact O-N 2.89Å; S117-I120 PolarHBondContact O-N 3.47Å; I120-H122 VanDerWaalsContact C-N 3.32Å; I120-L123 CarbonylContact O-C 3.6Å; I120-L123 PolarHBondContact O-N 2.77Å; I120-G124 WeakPolarHBondContact O-CA 3.37Å; I120-G124 PolarHBondContact O-N 3.19Å
121	V	77	Confident	76.9	Confident	84 Å²	84	95.1 Å²	95.1	51%	0.509	52%	0.52	S	S	.	.	H	α-helix	trans	-61.9	-44.8	173	166.5	0	0	0	0	109.2	S117 L123 G124 D125	S117-V121 WeakPolarHBondContact O-CB 3.48Å; S117-V121 WeakPolarHBondContact O-CG2 3.09Å; S117-V121 PolarHBondContact O-N 3.49Å; V121-L123 VanDerWaalsContact C-N 3.33Å; V121-L123 PolarHBondContact O-N 2.76Å; V121-G124 CarbonylContact O-C 3.59Å; V121-G124 PolarHBondContact O-N 2.86Å; V121-D125 WeakPolarHBondContact O-CB 3.38Å; V121-D125 VanDerWaalsContact O-CG 3.24Å; V121-D125 PolarHBondContact O-N 3.31Å
122	H	76.1	Confident	77.2	Confident	127 Å²	127	89.4 Å²	89.4	59%	0.588	50%	0.497	S	S	*	.	H	α-helix	trans	-65.7	-34.4	177.3	-153.4	-52.2	0	0	0	113.2	A118 R119 I120 Q126	A118-H122 PolarHBondContact O-N 2.98Å; R119-H122 PolarHBondContact O-N 3.42Å; I120-H122 VanDerWaalsContact C-N 3.32Å; H122-Q126 WeakPolarHBondContact O-CG 3.4Å; H122-Q126 PolarHBondContact O-N 3.39Å
123	L	78.3	Confident	77.5	Confident	94 Å²	94	86.7 Å²	86.7	49%	0.492	49%	0.492	S	S	.	.	H	α-helix	trans	-75	-34.8	173.1	-170.8	71.3	0	0	0	112.1	R119 I120 V121 Q126 L127	R119-L123 PolarHBondContact O-N 3.4Å; R119-L123 VanDerWaalsContact O-N 3.09Å; I120-L123 CarbonylContact O-C 3.6Å; I120-L123 PolarHBondContact O-N 2.77Å; V121-L123 VanDerWaalsContact C-N 3.33Å; V121-L123 PolarHBondContact O-N 2.76Å; L123-Q126 PolarHBondContact O-N 3.09Å; L123-L127 HydrophobicContact CG-CD1 4.17Å; L123-L127 WeakPolarHBondContact O-CB 3.45Å; L123-L127 WeakPolarHBondContact O-CG 3.38Å; L123-L127 PolarHBondContact O-N 2.73Å
124	G	79	Confident	77.9	Confident	25 Å²	25	93 Å²	93	26%	0.258	51%	0.508	S	S	.	.	H	α-helix	trans	-68.2	-42.3	178.1	0	0	0	0	0	111	I120 V121 Q126 L127 Q128	I120-G124 WeakPolarHBondContact O-CA 3.37Å; I120-G124 PolarHBondContact O-N 3.19Å; V121-G124 CarbonylContact O-C 3.59Å; V121-G124 PolarHBondContact O-N 2.86Å; G124-Q126 VanDerWaalsContact C-N 3.32Å; G124-Q126 PolarHBondContact O-N 3.3Å; G124-L127 PolarHBondContact O-N 2.64Å; G124-Q128 WeakPolarHBondContact O-CA 3.22Å; G124-Q128 WeakPolarHBondContact O-CB 3.26Å; G124-Q128 PolarHBondContact O-N 3.2Å
125	D	78.5	Confident	78.2	Confident	98 Å²	98	92 Å²	92	52%	0.524	51%	0.505	S	S	.	.	H	α-helix	trans	-61.6	-40.8	172	-71.8	-19.8	0	0	0	110.8	V121 S129	V121-D125 WeakPolarHBondContact O-CB 3.38Å; V121-D125 VanDerWaalsContact O-CG 3.24Å; V121-D125 PolarHBondContact O-N 3.31Å; D125-S129 WeakPolarHBondContact O-CB 3.32Å; D125-S129 PolarHBondContact O-N 3.32Å; D125-S129 PolarHBondContact O-OG 2.87Å
126	Q	81.9	Confident	78.5	Confident	109 Å²	109	97.4 Å²	97.4	51%	0.509	52%	0.516	S	S	.	.	H	α-helix	trans	-66.2	-47.1	174.1	-74.6	-177.8	-15	0	0	112.3	H122 L123 G124 S129 V130	H122-Q126 WeakPolarHBondContact O-CG 3.4Å; H122-Q126 PolarHBondContact O-N 3.39Å; L123-Q126 PolarHBondContact O-N 3.09Å; G124-Q126 VanDerWaalsContact C-N 3.32Å; G124-Q126 PolarHBondContact O-N 3.3Å; Q126-S129 PolarHBondContact O-N 3.47Å; Q126-S129 PolarHBondContact O-OG 3.29Å; Q126-V130 PolarHBondContact O-N 3.01Å
127	L	76	Confident	78.8	Confident	102 Å²	102	96.8 Å²	96.8	53%	0.534	52%	0.518	S	S	.	.	H	α-helix	trans	-64.2	-42.2	177.3	-80.9	164.3	0	0	0	111.9	L123 G124 V130 T131	L123-L127 HydrophobicContact CG-CD1 4.17Å; L123-L127 WeakPolarHBondContact O-CB 3.45Å; L123-L127 WeakPolarHBondContact O-CG 3.38Å; L123-L127 PolarHBondContact O-N 2.73Å; G124-L127 PolarHBondContact O-N 2.64Å; L127-V130 PolarHBondContact O-N 3.38Å; L127-T131 WeakPolarHBondContact O-CB 3.27Å; L127-T131 WeakPolarHBondContact O-CG2 2.99Å; L127-T131 PolarHBondContact O-N 2.6Å; L127-T131 PolarHBondContact O-OG1 2.85Å
128	Q	76.9	Confident	79.4	Confident	135 Å²	135	102.1 Å²	102.1	63%	0.631	53%	0.531	S	S	*	.	H	α-helix	trans	-71.4	-30.5	178.8	-168.8	163.8	-4.6	0	0	111.6	G124 V130 G132 P133	G124-Q128 WeakPolarHBondContact O-CA 3.22Å; G124-Q128 WeakPolarHBondContact O-CB 3.26Å; G124-Q128 PolarHBondContact O-N 3.2Å; Q128-V130 VanDerWaalsContact C-N 3.27Å; Q128-V130 PolarHBondContact O-N 3.03Å; Q128-G132 VanDerWaalsContact O-CA 3.22Å; Q128-G132 WeakPolarHBondContact O-CA 3.38Å; Q128-G132 PolarHBondContact O-N 3.15Å; Q128-P133 WeakPolarHBondContact O-CD 3.3Å
129	S	78.7	Confident	79.9	Confident	79 Å²	79	102.9 Å²	102.9	55%	0.552	52%	0.524	S	S	*	.	H	α-helix	trans	-63.5	-31.6	170.7	78.7	0	0	0	0	112.8	D125 Q126 P133	D125-S129 WeakPolarHBondContact O-CB 3.32Å; D125-S129 PolarHBondContact O-N 3.32Å; D125-S129 PolarHBondContact O-OG 2.87Å; Q126-S129 PolarHBondContact O-N 3.47Å; Q126-S129 PolarHBondContact O-OG 3.29Å; S129-P133 WeakPolarHBondContact O-CD 3.29Å; S129-P133 VanDerWaalsContact O-CG 3.26Å; S129-P133 WeakPolarHBondContact O-CG 3.29Å
130	V	77.6	Confident	80.3	Confident	107 Å²	107	95.6 Å²	95.6	65%	0.648	51%	0.506	S	S	*	.	H	α-helix	trans	-91.1	-46	179.2	177.5	0	0	0	0	112.1	Q126 L127 Q128	Q126-V130 PolarHBondContact O-N 3.01Å; L127-V130 PolarHBondContact O-N 3.38Å; Q128-V130 VanDerWaalsContact C-N 3.27Å; Q128-V130 PolarHBondContact O-N 3.03Å
131	T	79.7	Confident	80.7	Confident	77 Å²	77	97.4 Å²	97.4	47%	0.472	51%	0.511	S	S	.	.	H	α-helix	trans	-84	-34.2	-175	57.6	0	0	0	0	113	L127 R134 A135	L127-T131 WeakPolarHBondContact O-CB 3.27Å; L127-T131 WeakPolarHBondContact O-CG2 2.99Å; L127-T131 PolarHBondContact O-N 2.6Å; L127-T131 PolarHBondContact O-OG1 2.85Å; T131-R134 PolarHBondContact O-N 3.32Å; T131-A135 WeakPolarHBondContact O-CB 3.39Å; T131-A135 PolarHBondContact O-N 3.1Å
132	G	81.5	Confident	81.2	Confident	16 Å²	16	96.9 Å²	96.9	17%	0.165	50%	0.502	C	S	.	.	H	α-helix	trans	-61.1	-49	-177.3	0	0	0	0	0	113.4	Q128 R134 R136	Q128-G132 VanDerWaalsContact O-CA 3.22Å; Q128-G132 WeakPolarHBondContact O-CA 3.38Å; Q128-G132 PolarHBondContact O-N 3.15Å; G132-R134 VanDerWaalsContact C-N 3.34Å; G132-R134 PolarHBondContact O-N 3.22Å; G132-R136 WeakPolarHBondContact O-CB 3.4Å; G132-R136 VanDerWaalsContact O-CG 3.31Å; G132-R136 WeakPolarHBondContact O-CG 3.2Å; G132-R136 PolarHBondContact O-N 2.94Å; G132-R136 PolarHBondContact O-NE 2.89Å
133	P	80.7	Confident	81.7	Confident	64 Å²	64	91.9 Å²	91.9	42%	0.416	48%	0.479	S	S	.	.	H	α-helix	trans	-60.9	-40	174.1	-24.1	34.5	0	0	0	112.8	Q128 S129 A137	Q128-P133 WeakPolarHBondContact O-CD 3.3Å; S129-P133 WeakPolarHBondContact O-CD 3.29Å; S129-P133 VanDerWaalsContact O-CG 3.26Å; S129-P133 WeakPolarHBondContact O-CG 3.29Å; P133-A137 VanDerWaalsContact O-CB 3.23Å; P133-A137 WeakPolarHBondContact O-CB 3.39Å; P133-A137 PolarHBondContact O-N 2.84Å
134	R	83.2	Confident	82.1	Confident	206 Å²	206	94 Å²	94	78%	0.777	49%	0.488	S	S	*	.	H	α-helix	trans	-67.8	-45.1	-179.7	-174.7	176.8	175.9	173	-0.9	112.5	T131 G132 A137 Y138	T131-R134 PolarHBondContact O-N 3.32Å; G132-R134 VanDerWaalsContact C-N 3.34Å; G132-R134 PolarHBondContact O-N 3.22Å; R134-A137 PolarHBondContact O-N 3.24Å; R134-Y138 WeakPolarHBondContact O-CB 3.38Å; R134-Y138 PolarHBondContact O-N 2.91Å
135	A	80.1	Confident	82.5	Confident	59 Å²	59	96.3 Å²	96.3	49%	0.488	50%	0.497	S	S	.	.	H	α-helix	trans	-64.7	-46	177.5	0	0	0	0	0	111.4	T131 A137 Y138 E139	T131-A135 WeakPolarHBondContact O-CB 3.39Å; T131-A135 PolarHBondContact O-N 3.1Å; A135-A137 VanDerWaalsContact C-N 3.35Å; A135-A137 PolarHBondContact O-N 3.43Å; A135-Y138 PolarHBondContact O-N 3.16Å; A135-E139 WeakPolarHBondContact O-CB 3.32Å; A135-E139 PolarHBondContact O-N 2.95Å
136	R	82.1	Confident	82.9	Confident	172 Å²	172	92.4 Å²	92.4	65%	0.649	48%	0.476	S	S	*	.	H	α-helix	trans	-60.8	-41.4	175	-73.5	-174	-66.3	170	-1.4	112.4	G132 A140	G132-R136 WeakPolarHBondContact O-CB 3.4Å; G132-R136 VanDerWaalsContact O-CG 3.31Å; G132-R136 WeakPolarHBondContact O-CG 3.2Å; G132-R136 PolarHBondContact O-N 2.94Å; G132-R136 PolarHBondContact O-NE 2.89Å; R136-A140 WeakPolarHBondContact O-CB 3.44Å; R136-A140 PolarHBondContact O-N 3.39Å
137	A	83.9	Confident	83.2	Confident	60 Å²	60	88.5 Å²	88.5	50%	0.496	46%	0.457	S	S	.	.	H	α-helix	trans	-64.7	-41.8	177.2	0	0	0	0	0	112.2	P133 R134 A135 F141	P133-A137 VanDerWaalsContact O-CB 3.23Å; P133-A137 WeakPolarHBondContact O-CB 3.39Å; P133-A137 PolarHBondContact O-N 2.84Å; R134-A137 PolarHBondContact O-N 3.24Å; A135-A137 VanDerWaalsContact C-N 3.35Å; A135-A137 PolarHBondContact O-N 3.43Å; A137-F141 VanDerWaalsContact O-CB 3.32Å; A137-F141 WeakPolarHBondContact O-CB 3.45Å; A137-F141 PolarHBondContact O-N 3.33Å
138	Y	86.6	Confident	83.6	Confident	166 Å²	166	88.7 Å²	88.7	65%	0.651	46%	0.459	S	S	*	.	H	α-helix	trans	-66.9	-44.4	176.3	178.4	-99.6	0	0	0	112.4	R134 A135 F141 K142	R134-Y138 WeakPolarHBondContact O-CB 3.38Å; R134-Y138 PolarHBondContact O-N 2.91Å; A135-Y138 PolarHBondContact O-N 3.16Å; Y138-F141 PolarHBondContact O-N 3.08Å; Y138-K142 PolarHBondContact O-N 3.03Å
139	E	84.3	Confident	84.1	Confident	81 Å²	81	83.6 Å²	83.6	38%	0.379	44%	0.435	S	S	.	.	H	α-helix	trans	-64.3	-43.6	176.5	-173.8	173.1	-154.8	0	0	111.6	A135 F141 K142 L143 K176	A135-E139 WeakPolarHBondContact O-CB 3.32Å; A135-E139 PolarHBondContact O-N 2.95Å; E139-F141 VanDerWaalsContact C-N 3.34Å; E139-F141 PolarHBondContact O-N 3.22Å; E139-K142 PolarHBondContact O-N 3.3Å; E139-L143 HydrophobicContact CG-CD1 4.15Å; E139-L143 WeakPolarHBondContact O-CG 3.48Å; E139-L143 PolarHBondContact O-N 2.97Å; E139-K176 WeakPolarHBondContact OE1-CE 3.45Å; E139-K176 IonicContact OE1-NZ 3.68Å; E139-K176 PolarHBondContact OE1-NZ 3.37Å
140	A	84.6	Confident	84.5	Confident	46 Å²	46	80 Å²	80	38%	0.38	41%	0.41	S	S	.	.	H	α-helix	trans	-59.3	-44.1	173.3	0	0	0	0	0	111.4	R136 K142 L143 M144	R136-A140 WeakPolarHBondContact O-CB 3.44Å; R136-A140 PolarHBondContact O-N 3.39Å; A140-K142 PolarHBondContact O-N 3.15Å; A140-L143 PolarHBondContact O-N 3.36Å; A140-M144 WeakPolarHBondContact O-CB 3.44Å; A140-M144 WeakPolarHBondContact O-CG 3.43Å; A140-M144 PolarHBondContact O-N 3.28Å
141	F	88.3	Confident	84.8	Confident	139 Å²	139	78.5 Å²	78.5	61%	0.61	40%	0.398	S	S	*	.	H	α-helix	trans	-60.4	-43.9	175.4	177	-97.8	0	0	0	112.4	A137 Y138 E139 M144 T145	A137-F141 VanDerWaalsContact O-CB 3.32Å; A137-F141 WeakPolarHBondContact O-CB 3.45Å; A137-F141 PolarHBondContact O-N 3.33Å; Y138-F141 PolarHBondContact O-N 3.08Å; E139-F141 VanDerWaalsContact C-N 3.34Å; E139-F141 PolarHBondContact O-N 3.22Å; F141-M144 PolarHBondContact O-N 3.38Å; F141-T145 PolarHBondContact O-N 2.93Å; F141-T145 PolarHBondContact O-OG1 3.4Å
142	K	87	Confident	84.8	Confident	73 Å²	73	77 Å²	77	32%	0.317	39%	0.39	S	S	.	.	H	α-helix	trans	-61	-47.7	175.7	-172	-176.5	178.7	-173.7	0	111.3	Y138 E139 A140 T145 H146	Y138-K142 PolarHBondContact O-N 3.03Å; E139-K142 PolarHBondContact O-N 3.3Å; A140-K142 PolarHBondContact O-N 3.15Å; K142-T145 PolarHBondContact O-N 3.47Å; K142-H146 PolarHBondContact O-CD2 2.76Å; K142-H146 VanDerWaalsContact O-CD2 3.25Å; K142-H146 PolarHBondContact O-N 3.33Å
143	L	88	Confident	84.4	Confident	22 Å²	22	83.6 Å²	83.6	12%	0.115	42%	0.421	C	S	.	.	H	α-helix	trans	-65.5	-40.3	178.8	-69.1	171.7	0	0	0	112.3	E139 A140 T145 H146 F147 V173 K176 L177 I180	E139-L143 HydrophobicContact CG-CD1 4.15Å; E139-L143 WeakPolarHBondContact O-CG 3.48Å; E139-L143 PolarHBondContact O-N 2.97Å; A140-L143 PolarHBondContact O-N 3.36Å; L143-T145 VanDerWaalsContact C-N 3.29Å; L143-T145 PolarHBondContact O-N 3.07Å; L143-H146 PolarHBondContact O-N 3.45Å; L143-F147 VanDerWaalsContact O-CB 3.26Å; L143-F147 WeakPolarHBondContact O-CB 2.96Å; L143-F147 PolarHBondContact O-N 3.46Å; L143-V173 HydrophobicContact CD2-CG1 4.31Å; L143-K176 HydrophobicContact CD1-CB 4.16Å; L143-K176 HydrophobicContact CD1-CD 4.42Å; L143-K176 HydrophobicContact CD2-CB 3.7Å; L143-K176 HydrophobicContact CD2-CD 4.31Å; L143-L177 HydrophobicContact CD2-CD2 4.24Å; L143-L177 HydrophobicContact CD2-CG 4.28Å; L143-I180 HydrophobicContact CB-CD1 4.37Å; L143-I180 HydrophobicContact CD1-CD1 3.92Å
144	M	86.1	Confident	84.2	Confident	137 Å²	137	86 Å²	86	68%	0.675	43%	0.427	S	S	*	.	H	α-helix	trans	-63	-36.7	175.6	-72.9	175.5	84.4	0	0	111.9	A140 F141 F147 N148	A140-M144 WeakPolarHBondContact O-CB 3.44Å; A140-M144 WeakPolarHBondContact O-CG 3.43Å; A140-M144 PolarHBondContact O-N 3.28Å; F141-M144 PolarHBondContact O-N 3.38Å; M144-F147 PolarHBondContact O-N 2.82Å; M144-N148 WeakPolarHBondContact O-CB 3.34Å; M144-N148 PolarHBondContact O-N 3.49Å
145	T	86.9	Confident	83.9	Confident	74 Å²	74	81.3 Å²	81.3	45%	0.454	42%	0.423	S	S	.	.	H	α-helix	trans	-64.5	-49.1	177.2	-54.9	0	0	0	0	111.1	F141 K142 L143 N148 E149	F141-T145 PolarHBondContact O-N 2.93Å; F141-T145 PolarHBondContact O-OG1 3.4Å; K142-T145 PolarHBondContact O-N 3.47Å; L143-T145 VanDerWaalsContact C-N 3.29Å; L143-T145 PolarHBondContact O-N 3.07Å; T145-N148 WeakPolarHBondContact O-CB 3.41Å; T145-N148 PolarHBondContact O-N 3.12Å; T145-E149 PolarHBondContact O-N 2.81Å
146	H	87.2	Confident	83.8	Confident	16 Å²	16	80 Å²	80	7%	0.074	41%	0.408	C	S	.	.	H	α-helix	trans	-67.9	-37.9	175.7	-68.3	-64.3	0	0	0	112.2	K142 L143 N148 E149 F150 F161 V173 L177	K142-H146 PolarHBondContact O-CD2 2.76Å; K142-H146 VanDerWaalsContact O-CD2 3.25Å; K142-H146 PolarHBondContact O-N 3.33Å; L143-H146 PolarHBondContact O-N 3.45Å; H146-N148 VanDerWaalsContact C-N 3.26Å; H146-N148 PolarHBondContact O-N 3.44Å; H146-E149 IonicContact ND1-OE2 3.32Å; H146-E149 PolarHBondContact ND1-OE2 2.87Å; H146-E149 WeakPolarHBondContact O-CA 3.49Å; H146-E149 WeakPolarHBondContact O-CB 3.31Å; H146-E149 PolarHBondContact O-N 3.23Å; H146-F150 VanDerWaalsContact O-CD2 3.23Å; H146-F150 WeakPolarHBondContact O-CD2 3.46Å; H146-F150 PolarHBondContact O-N 2.92Å; H146-F161 HydrophobicContact CB-CE2 4.36Å; H146-F161 AromaticContact ND1-CE2 3.89Å; H146-V173 HydrophobicContact CB-CG1 4.18Å; H146-L177 HydrophobicContact CB-CD1 4.01Å
147	F	87.4	Confident	83.5	Confident	27 Å²	27	78.8 Å²	78.8	12%	0.118	41%	0.409	C	S	.	.	H	α-helix	trans	-61.2	-36.9	175.4	-168.4	-89.4	0	0	0	111.8	L143 M144 E149 F150 L151 L177 L184 V192 I196	L143-F147 VanDerWaalsContact O-CB 3.26Å; L143-F147 WeakPolarHBondContact O-CB 2.96Å; L143-F147 PolarHBondContact O-N 3.46Å; M144-F147 PolarHBondContact O-N 2.82Å; F147-E149 VanDerWaalsContact C-N 3.29Å; F147-E149 PolarHBondContact O-N 3.2Å; F147-F150 PolarHBondContact O-N 3.36Å; F147-L151 HydrophobicContact CD1-CD1 3.79Å; F147-L151 HydrophobicContact CD1-CG 4.13Å; F147-L151 HydrophobicContact CE1-CD1 3.82Å; F147-L151 HydrophobicContact CE1-CD2 4.32Å; F147-L151 HydrophobicContact CE1-CG 3.95Å; F147-L151 PolarHBondContact O-N 3.49Å; F147-L177 HydrophobicContact CB-CD2 3.9Å; F147-L177 HydrophobicContact CD2-CD2 4.09Å; F147-L184 HydrophobicContact CE1-CD1 4.27Å; F147-L184 HydrophobicContact CE2-CD1 3.77Å; F147-L184 HydrophobicContact CZ-CD1 3.33Å; F147-V192 HydrophobicContact CE1-CG1 4.36Å; F147-V192 HydrophobicContact CE2-CG1 3.98Å; F147-V192 HydrophobicContact CZ-CG1 3.77Å; F147-I196 HydrophobicContact CD2-CD1 3.94Å; F147-I196 HydrophobicContact CE2-CD1 3.76Å
148	N	85.7	Confident	83.3	Confident	107 Å²	107	77 Å²	77	57%	0.572	39%	0.394	S	S	*	.	H	α-helix	trans	-65.3	-32.3	173.8	-167.8	53.2	0	0	0	112.8	M144 T145 H146 L151 S152	M144-N148 WeakPolarHBondContact O-CB 3.34Å; M144-N148 PolarHBondContact O-N 3.49Å; T145-N148 WeakPolarHBondContact O-CB 3.41Å; T145-N148 PolarHBondContact O-N 3.12Å; H146-N148 VanDerWaalsContact C-N 3.26Å; H146-N148 PolarHBondContact O-N 3.44Å; N148-L151 WeakPolarHBondContact O-CB 3.4Å; N148-L151 PolarHBondContact O-N 3.16Å; N148-S152 PolarHBondContact O-N 2.93Å
149	E	86.3	Confident	83	Confident	27 Å²	27	73.9 Å²	73.9	13%	0.126	39%	0.388	C	S	.	.	H	α-helix	trans	-61.7	-44.9	171.6	-155.4	-173.4	162	0	0	111.3	T145 H146 F147 L151 S152 L156 E157 S158	T145-E149 PolarHBondContact O-N 2.81Å; H146-E149 IonicContact ND1-OE2 3.32Å; H146-E149 PolarHBondContact ND1-OE2 2.87Å; H146-E149 WeakPolarHBondContact O-CA 3.49Å; H146-E149 WeakPolarHBondContact O-CB 3.31Å; H146-E149 PolarHBondContact O-N 3.23Å; F147-E149 VanDerWaalsContact C-N 3.29Å; F147-E149 PolarHBondContact O-N 3.2Å; E149-L151 VanDerWaalsContact C-N 3.29Å; E149-L151 PolarHBondContact O-N 3.31Å; E149-S152 PolarHBondContact O-N 2.94Å; E149-S152 PolarHBondContact O-OG 3.49Å; E149-L156 HydrophobicContact CB-CD2 4.26Å; E149-L156 HydrophobicContact CG-CD2 3.8Å; E149-L156 VanDerWaalsContact OE1-C 3.24Å; E149-L156 WeakPolarHBondContact OE1-CA 3.16Å; E149-L156 VanDerWaalsContact OE1-CB 3.32Å; E149-L156 WeakPolarHBondContact OE1-CB 3.18Å; E149-E157 PolarHBondContact OE1-N 2.95Å; E149-S158 VanDerWaalsContact CD-OG 3.26Å; E149-S158 WeakPolarHBondContact OE1-CB 3.38Å; E149-S158 PolarHBondContact OE1-N 3.01Å; E149-S158 PolarHBondContact OE1-OG 2.99Å; E149-S158 WeakPolarHBondContact OE2-CB 3.07Å; E149-S158 PolarHBondContact OE2-OG 3.31Å
150	F	87.1	Confident	82.8	Confident	4 Å²	4	70.8 Å²	70.8	2%	0.018	38%	0.375	C	S	.	.	H	α-helix	trans	-70.3	-20.6	175.7	-74.4	-83.7	0	0	0	114.1	H146 F147 L156 F161 L177 V192 R195 I196 K199	H146-F150 VanDerWaalsContact O-CD2 3.23Å; H146-F150 WeakPolarHBondContact O-CD2 3.46Å; H146-F150 PolarHBondContact O-N 2.92Å; F147-F150 PolarHBondContact O-N 3.36Å; F150-L156 HydrophobicContact CD1-CD2 4Å; F150-L156 HydrophobicContact CD2-CD2 4.19Å; F150-L156 HydrophobicContact CE1-CD1 3.77Å; F150-L156 HydrophobicContact CE1-CD2 3.86Å; F150-L156 HydrophobicContact CE1-CG 4.37Å; F150-L156 HydrophobicContact CE2-CD2 4.02Å; F150-L156 HydrophobicContact CG-CD2 4.16Å; F150-L156 HydrophobicContact CZ-CD1 3.72Å; F150-L156 HydrophobicContact CZ-CD2 3.85Å; F150-L156 HydrophobicContact CZ-CG 4.46Å; F150-F161 HydrophobicContact CE2-CD2 4.27Å; F150-F161 AromaticContact CE2-CE2 3.62Å; F150-F161 HydrophobicContact CE2-CE2 3.62Å; F150-F161 AromaticContact CE2-CZ 3.89Å; F150-F161 HydrophobicContact CE2-CZ 3.89Å; F150-F161 HydrophobicContact CZ-CD2 4.34Å; F150-F161 AromaticContact CZ-CE2 3.99Å; F150-F161 HydrophobicContact CZ-CE2 3.99Å; F150-F161 HydrophobicContact CZ-CZ 4.09Å; F150-L177 HydrophobicContact CD2-CD1 3.92Å; F150-L177 HydrophobicContact CE2-CD1 3.56Å; F150-V192 HydrophobicContact CB-CG1 4.08Å; F150-R195 HydrophobicContact CD1-CB 4.26Å; F150-R195 PolarHBondContact O-NH1 3.32Å; F150-I196 HydrophobicContact CB-CD1 4.4Å; F150-I196 HydrophobicContact CB-CG1 4.12Å; F150-I196 HydrophobicContact CD1-CG1 3.76Å; F150-I196 HydrophobicContact CD2-CG1 4.18Å; F150-I196 HydrophobicContact CE1-CG1 4.19Å; F150-I196 HydrophobicContact CG-CD1 4.42Å; F150-I196 HydrophobicContact CG-CG1 3.76Å; F150-K199 HydrophobicContact CE1-CB 4.13Å; F150-K199 HydrophobicContact CE1-CG 4.38Å; F150-K199 HydrophobicContact CZ-CB 4.37Å; F150-K199 HydrophobicContact CZ-CG 4.25Å
151	L	84.5	Confident	82.8	Confident	76 Å²	76	69.4 Å²	69.4	40%	0.398	36%	0.36	S	S	.	.	H	α-helix	trans	-73.1	-27.8	171.8	-81	165.7	0	0	0	112.5	F147 N148 E149 Y189 V192	F147-L151 HydrophobicContact CD1-CD1 3.79Å; F147-L151 HydrophobicContact CD1-CG 4.13Å; F147-L151 HydrophobicContact CE1-CD1 3.82Å; F147-L151 HydrophobicContact CE1-CD2 4.32Å; F147-L151 HydrophobicContact CE1-CG 3.95Å; F147-L151 PolarHBondContact O-N 3.49Å; N148-L151 WeakPolarHBondContact O-CB 3.4Å; N148-L151 PolarHBondContact O-N 3.16Å; E149-L151 VanDerWaalsContact C-N 3.29Å; E149-L151 PolarHBondContact O-N 3.31Å; L151-Y189 HydrophobicContact CD2-CD1 4.32Å; L151-Y189 HydrophobicContact CD2-CE1 4.29Å; L151-V192 HydrophobicContact CD2-CG2 3.59Å; L151-V192 HydrophobicContact CG-CG2 4.24Å
152	S	80.1	Confident	82.5	Confident	44 Å²	44	66.6 Å²	66.6	31%	0.308	35%	0.354	S	S	.	.	S	Bend	trans	-81.5	132.5	178.3	75.4	0	0	0	0	110.7	N148 E149 Q154 R195	N148-S152 PolarHBondContact O-N 2.93Å; E149-S152 PolarHBondContact O-N 2.94Å; E149-S152 PolarHBondContact O-OG 3.49Å; S152-Q154 PolarHBondContact O-N 3.45Å; S152-R195 PolarHBondContact O-NH1 3.08Å; S152-R195 PolarHBondContact O-NH2 3.05Å
153	D	73.1	Confident	82.2	Confident	155 Å²	155	65.6 Å²	65.6	83%	0.829	35%	0.353	S	S	*	.	S	Bend	trans	-68.2	9	178.1	-71.2	-31.9	0	0	0	114.3
154	Q	75.6	Confident	81.8	Confident	116 Å²	116	69.1 Å²	69.1	54%	0.542	38%	0.377	S	S	.	.	S	Bend	trans	-85.5	157.2	178.8	-69.2	-179	-5.3	0	0	111.3	S152 R195	S152-Q154 PolarHBondContact O-N 3.45Å; Q154-R195 PolarHBondContact O-NH2 3.36Å
155	P	76.8	Confident	81.6	Confident	106 Å²	106	69.8 Å²	69.8	69%	0.688	38%	0.383	S	S	*	.	P	Polyproline II helix	trans	-56.4	147.7	168.7	25	-33.8	0	0	0	110.4	E157	P155-E157 PolarHBondContact O-N 3.37Å
156	L	79.2	Confident	81.5	Confident	31 Å²	31	69 Å²	69	16%	0.162	37%	0.374	C	S	.	.	P	Polyproline II helix	trans	-61.3	121.1	175.9	-63.5	168.8	0	0	0	108.6	E149 F150 F161 T162 K199	E149-L156 HydrophobicContact CB-CD2 4.26Å; E149-L156 HydrophobicContact CG-CD2 3.8Å; E149-L156 VanDerWaalsContact OE1-C 3.24Å; E149-L156 WeakPolarHBondContact OE1-CA 3.16Å; E149-L156 VanDerWaalsContact OE1-CB 3.32Å; E149-L156 WeakPolarHBondContact OE1-CB 3.18Å; F150-L156 HydrophobicContact CD1-CD2 4Å; F150-L156 HydrophobicContact CD2-CD2 4.19Å; F150-L156 HydrophobicContact CE1-CD1 3.77Å; F150-L156 HydrophobicContact CE1-CD2 3.86Å; F150-L156 HydrophobicContact CE1-CG 4.37Å; F150-L156 HydrophobicContact CE2-CD2 4.02Å; F150-L156 HydrophobicContact CG-CD2 4.16Å; F150-L156 HydrophobicContact CZ-CD1 3.72Å; F150-L156 HydrophobicContact CZ-CD2 3.85Å; F150-L156 HydrophobicContact CZ-CG 4.46Å; L156-F161 HydrophobicContact CB-CB 4.3Å; L156-F161 HydrophobicContact CD1-CB 3.88Å; L156-F161 HydrophobicContact CD1-CD2 4.15Å; L156-F161 HydrophobicContact CD1-CG 4.04Å; L156-T162 WeakPolarHBondContact O-CG2 3.02Å; L156-K199 HydrophobicContact CD1-CD 4.49Å; L156-K199 HydrophobicContact CD1-CG 4.34Å
157	E	75.1	Confident	81.5	Confident	147 Å²	147	69.2 Å²	69.2	69%	0.687	38%	0.375	S	S	*	.			trans	-96.3	-18.6	-179.6	-64.8	-170.7	161.7	0	0	112	E149 P155 D159	E149-E157 PolarHBondContact OE1-N 2.95Å; P155-E157 PolarHBondContact O-N 3.37Å; E157-D159 PolarHBondContact O-N 3.47Å
158	S	78.8	Confident	81.5	Confident	24 Å²	24	70.1 Å²	70.1	17%	0.168	38%	0.383	C	S	.	.	S	Bend	trans	-66.6	133.5	-176.3	64.9	0	0	0	0	111.3	E149 T160 F161 T162	E149-S158 VanDerWaalsContact CD-OG 3.26Å; E149-S158 WeakPolarHBondContact OE1-CB 3.38Å; E149-S158 PolarHBondContact OE1-N 3.01Å; E149-S158 PolarHBondContact OE1-OG 2.99Å; E149-S158 WeakPolarHBondContact OE2-CB 3.07Å; E149-S158 PolarHBondContact OE2-OG 3.31Å; S158-T160 PolarHBondContact O-N 3.41Å; S158-F161 PolarHBondContact O-N 3.31Å; S158-F161 VanDerWaalsContact O-N 3.07Å; S158-F161 WeakPolarHBondContact OG-CD2 3.47Å; S158-T162 PolarHBondContact O-N 2.91Å; S158-T162 PolarHBondContact O-OG1 3.23Å
159	D	80.2	Confident	81.5	Confident	99 Å²	99	69.7 Å²	69.7	53%	0.529	38%	0.377	S	S	.	.	H	α-helix	trans	-51	-30.2	174.7	-63.2	-3.6	0	0	0	111.9	E157 F161 T162 D163 K166	E157-D159 PolarHBondContact O-N 3.47Å; D159-F161 VanDerWaalsContact C-N 3.29Å; D159-F161 PolarHBondContact O-N 3.25Å; D159-T162 WeakPolarHBondContact CA-OG1 3.39Å; D159-T162 PolarHBondContact O-N 3.33Å; D159-D163 WeakPolarHBondContact O-CB 3.3Å; D159-D163 PolarHBondContact O-N 2.82Å; D159-K166 HydrophobicContact CB-CD 4.18Å; D159-K166 IonicContact OD2-NZ 3.89Å; D159-K166 PolarHBondContact OD2-NZ 2.98Å
160	T	81.3	Confident	81.6	Confident	16 Å²	16	68.6 Å²	68.6	10%	0.098	37%	0.373	C	S	.	.	H	α-helix	trans	-60.4	-34.9	-178.5	-54.4	0	0	0	0	112.9	S158 E169 A170 V173	S158-T160 PolarHBondContact O-N 3.41Å; T160-E169 HydrophobicContact CG2-CB 4.27Å; T160-A170 HydrophobicContact CG2-CB 4.5Å; T160-A170 WeakPolarHBondContact O-CB 3.33Å; T160-V173 HydrophobicContact CG2-CG2 4.28Å
161	F	83.6	Confident	81.7	Confident	18 Å²	18	68.4 Å²	68.4	8%	0.079	37%	0.372	C	S	.	.	H	α-helix	trans	-104.6	-11	-179.3	-64.8	-63.6	0	0	0	114.3	H146 F150 L156 S158 D159 A170 V173 V174 L177 K199	H146-F161 HydrophobicContact CB-CE2 4.36Å; H146-F161 AromaticContact ND1-CE2 3.89Å; F150-F161 HydrophobicContact CE2-CD2 4.27Å; F150-F161 AromaticContact CE2-CE2 3.62Å; F150-F161 HydrophobicContact CE2-CE2 3.62Å; F150-F161 AromaticContact CE2-CZ 3.89Å; F150-F161 HydrophobicContact CE2-CZ 3.89Å; F150-F161 HydrophobicContact CZ-CD2 4.34Å; F150-F161 AromaticContact CZ-CE2 3.99Å; F150-F161 HydrophobicContact CZ-CE2 3.99Å; F150-F161 HydrophobicContact CZ-CZ 4.09Å; L156-F161 HydrophobicContact CB-CB 4.3Å; L156-F161 HydrophobicContact CD1-CB 3.88Å; L156-F161 HydrophobicContact CD1-CD2 4.15Å; L156-F161 HydrophobicContact CD1-CG 4.04Å; S158-F161 PolarHBondContact O-N 3.31Å; S158-F161 VanDerWaalsContact O-N 3.07Å; S158-F161 WeakPolarHBondContact OG-CD2 3.47Å; D159-F161 VanDerWaalsContact C-N 3.29Å; D159-F161 PolarHBondContact O-N 3.25Å; F161-A170 HydrophobicContact CD1-CB 4Å; F161-A170 HydrophobicContact CE1-CB 4.22Å; F161-V173 HydrophobicContact CE2-CG1 4.38Å; F161-V173 HydrophobicContact CZ-CB 4.21Å; F161-V173 HydrophobicContact CZ-CG1 3.79Å; F161-V174 HydrophobicContact CE1-CB 4.06Å; F161-L177 HydrophobicContact CZ-CD1 4.16Å; F161-K199 HydrophobicContact CD1-CG 4.39Å
162	T	81.6	Confident	81.8	Confident	79 Å²	79	67.3 Å²	67.3	49%	0.485	37%	0.366	S	S	.	.	H	α-helix	trans	-103.2	-30.1	-178.9	53.1	0	0	0	0	113.1	L156 S158 D159 P164	L156-T162 WeakPolarHBondContact O-CG2 3.02Å; S158-T162 PolarHBondContact O-N 2.91Å; S158-T162 PolarHBondContact O-OG1 3.23Å; D159-T162 WeakPolarHBondContact CA-OG1 3.39Å; D159-T162 PolarHBondContact O-N 3.33Å; T162-P164 WeakPolarHBondContact O-CD 3.05Å
163	D	82.4	Confident	82.2	Confident	52 Å²	52	65.3 Å²	65.3	28%	0.278	35%	0.353	S	S	.	.			trans	-83.5	115.4	179.8	-171.2	-4.2	0	0	0	111.1	D159 D165 K166	D159-D163 WeakPolarHBondContact O-CB 3.3Å; D159-D163 PolarHBondContact O-N 2.82Å; D163-D165 PolarHBondContact O-N 3.05Å; D163-D165 WeakPolarHBondContact OD1-CB 3.35Å; D163-D165 PolarHBondContact OD1-N 3.16Å; D163-K166 HydrophobicContact CB-CB 4.24Å; D163-K166 HydrophobicContact CB-CD 4.17Å; D163-K166 HydrophobicContact CB-CG 4.13Å; D163-K166 PolarHBondContact O-N 3.24Å
164	P	79.3	Confident	83.1	Confident	97 Å²	97	58 Å²	58	63%	0.63	31%	0.313	S	S	*	.	G	3₁₀ helix	trans	-61.8	-24.9	177.8	24.9	-33.2	0	0	0	113	T162 K166 L167	T162-P164 WeakPolarHBondContact O-CD 3.05Å; P164-K166 PolarHBondContact O-N 3Å; P164-L167 WeakPolarHBondContact O-CB 3.27Å; P164-L167 PolarHBondContact O-N 3.13Å
165	D	81.7	Confident	83.7	Confident	151 Å²	151	53.3 Å²	53.3	81%	0.807	29%	0.292	S	S	*	.	G	3₁₀ helix	trans	-71.7	-20.7	177.2	-71.6	-25.5	0	0	0	112.2	D163	D163-D165 PolarHBondContact O-N 3.05Å; D163-D165 WeakPolarHBondContact OD1-CB 3.35Å; D163-D165 PolarHBondContact OD1-N 3.16Å
166	K	84.9	Confident	84.3	Confident	57 Å²	57	50.2 Å²	50.2	25%	0.248	27%	0.267	C	S	.	.	G	3₁₀ helix	trans	-96.6	14.7	178.3	-63.8	-177.8	-172.5	171.1	0	113.4	D159 D163 P164 V168 E169 A170	D159-K166 HydrophobicContact CB-CD 4.18Å; D159-K166 IonicContact OD2-NZ 3.89Å; D159-K166 PolarHBondContact OD2-NZ 2.98Å; D163-K166 HydrophobicContact CB-CB 4.24Å; D163-K166 HydrophobicContact CB-CD 4.17Å; D163-K166 HydrophobicContact CB-CG 4.13Å; D163-K166 PolarHBondContact O-N 3.24Å; P164-K166 PolarHBondContact O-N 3Å; K166-V168 PolarHBondContact O-N 3.49Å; K166-V168 VanDerWaalsContact O-N 3.12Å; K166-E169 HydrophobicContact CB-CB 4.44Å; K166-E169 CarbonylContact O-C 3.56Å; K166-E169 WeakPolarHBondContact O-CA 3.35Å; K166-E169 WeakPolarHBondContact O-CB 3.46Å; K166-E169 PolarHBondContact O-N 3.14Å; K166-A170 PolarHBondContact O-N 3.4Å
167	L	87.8	Confident	84.8	Confident	21 Å²	21	48.8 Å²	48.8	11%	0.11	26%	0.259	C	S	.	.	H	α-helix	trans	-54.2	-36	-178.4	-176.6	65	0	0	0	113.7	P164 A170 G171 V203 M206 L207 E210	P164-L167 WeakPolarHBondContact O-CB 3.27Å; P164-L167 PolarHBondContact O-N 3.13Å; L167-A170 WeakPolarHBondContact O-CB 3.08Å; L167-A170 PolarHBondContact O-N 3.13Å; L167-G171 PolarHBondContact O-N 3.02Å; L167-V203 HydrophobicContact CD1-CG1 4.16Å; L167-M206 HydrophobicContact CD1-CB 3.99Å; L167-M206 HydrophobicContact CD1-CE 4.17Å; L167-M206 HydrophobicContact CD1-SD 4.39Å; L167-M206 HydrophobicContact CD2-CB 3.98Å; L167-L207 HydrophobicContact CD2-CD2 4.09Å; L167-L207 HydrophobicContact CD2-CG 4.42Å; L167-L207 HydrophobicContact CG-CD2 3.84Å; L167-L207 HydrophobicContact CG-CG 4.22Å; L167-E210 HydrophobicContact CD2-CB 4.29Å
168	V	86.5	Confident	85.5	Confident	46 Å²	46	44.3 Å²	44.3	28%	0.279	24%	0.239	S	C	.	.	H	α-helix	trans	-67.1	-39.3	176.8	-177.4	0	0	0	0	111.2	K166 G171 D172 V226 V229	K166-V168 PolarHBondContact O-N 3.49Å; K166-V168 VanDerWaalsContact O-N 3.12Å; V168-G171 PolarHBondContact O-N 2.95Å; V168-D172 PolarHBondContact O-N 3.48Å; V168-V226 HydrophobicContact CG2-CG2 4.33Å; V168-V229 HydrophobicContact CG1-CG2 3.56Å
169	E	85.8	Confident	85.9	Confident	98 Å²	98	48.2 Å²	48.2	46%	0.458	26%	0.256	S	S	.	.	H	α-helix	trans	-70	-39.6	174.3	-59.3	-174.7	-177.9	0	0	111.3	T160 K166 G171 D172 V173	T160-E169 HydrophobicContact CG2-CB 4.27Å; K166-E169 HydrophobicContact CB-CB 4.44Å; K166-E169 CarbonylContact O-C 3.56Å; K166-E169 WeakPolarHBondContact O-CA 3.35Å; K166-E169 WeakPolarHBondContact O-CB 3.46Å; K166-E169 PolarHBondContact O-N 3.14Å; E169-G171 VanDerWaalsContact C-N 3.27Å; E169-G171 PolarHBondContact O-N 3.06Å; E169-D172 PolarHBondContact O-N 3.1Å; E169-V173 WeakPolarHBondContact O-CG2 3.47Å; E169-V173 PolarHBondContact O-N 3.44Å
170	A	88.3	Confident	86.2	Confident	3 Å²	3	46.8 Å²	46.8	3%	0.025	25%	0.247	C	C	.	.	H	α-helix	trans	-56.6	-43.3	173.1	0	0	0	0	0	111.2	T160 F161 K166 L167 V173 V174	T160-A170 HydrophobicContact CG2-CB 4.5Å; T160-A170 WeakPolarHBondContact O-CB 3.33Å; F161-A170 HydrophobicContact CD1-CB 4Å; F161-A170 HydrophobicContact CE1-CB 4.22Å; K166-A170 PolarHBondContact O-N 3.4Å; L167-A170 WeakPolarHBondContact O-CB 3.08Å; L167-A170 PolarHBondContact O-N 3.13Å; A170-V173 PolarHBondContact O-N 3.09Å; A170-V174 WeakPolarHBondContact O-CB 3.32Å; A170-V174 WeakPolarHBondContact O-CG1 3.44Å; A170-V174 PolarHBondContact O-N 2.91Å
171	G	88.8	Confident	86.5	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-59.4	-49.2	176	0	0	0	0	0	113.4	L167 V168 E169 V173 Q175 F233	L167-G171 PolarHBondContact O-N 3.02Å; V168-G171 PolarHBondContact O-N 2.95Å; E169-G171 VanDerWaalsContact C-N 3.27Å; E169-G171 PolarHBondContact O-N 3.06Å; G171-V173 PolarHBondContact O-N 3.46Å; G171-Q175 VanDerWaalsContact O-CB 3.27Å; G171-Q175 WeakPolarHBondContact O-CB 3.48Å; G171-Q175 PolarHBondContact O-N 3.12Å; G171-Q175 VanDerWaalsContact O-N 3.17Å; G171-F233 WeakPolarHBondContact O-CZ 3.01Å
172	D	87.6	Confident	86.6	Confident	53 Å²	53	49 Å²	49	28%	0.283	27%	0.27	S	S	.	.	H	α-helix	trans	-63.3	-42	178.2	-175.6	53.7	0	0	0	111.9	V168 E169 K176	V168-D172 PolarHBondContact O-N 3.48Å; E169-D172 PolarHBondContact O-N 3.1Å; D172-K176 WeakPolarHBondContact O-CD 3.31Å; D172-K176 WeakPolarHBondContact O-CG 3.48Å; D172-K176 PolarHBondContact O-N 3Å; D172-K176 WeakPolarHBondContact OD1-CE 3.33Å; D172-K176 IonicContact OD1-NZ 3.26Å; D172-K176 PolarHBondContact OD1-NZ 3.3Å; D172-K176 IonicContact OD2-NZ 3.45Å; D172-K176 PolarHBondContact OD2-NZ 3.15Å
173	V	88.6	Confident	86.8	Confident	3 Å²	3	53.6 Å²	53.6	2%	0.018	29%	0.286	C	S	.	.	H	α-helix	trans	-71.4	-46.3	-179.2	178	0	0	0	0	111.6	L143 H146 T160 F161 E169 A170 G171 Q175 K176 L177	L143-V173 HydrophobicContact CD2-CG1 4.31Å; H146-V173 HydrophobicContact CB-CG1 4.18Å; T160-V173 HydrophobicContact CG2-CG2 4.28Å; F161-V173 HydrophobicContact CE2-CG1 4.38Å; F161-V173 HydrophobicContact CZ-CB 4.21Å; F161-V173 HydrophobicContact CZ-CG1 3.79Å; E169-V173 WeakPolarHBondContact O-CG2 3.47Å; E169-V173 PolarHBondContact O-N 3.44Å; A170-V173 PolarHBondContact O-N 3.09Å; G171-V173 PolarHBondContact O-N 3.46Å; V173-Q175 VanDerWaalsContact C-N 3.32Å; V173-Q175 PolarHBondContact O-N 3.45Å; V173-K176 PolarHBondContact O-N 3.44Å; V173-L177 HydrophobicContact CG1-CD1 3.83Å; V173-L177 HydrophobicContact CG1-CG 4.21Å; V173-L177 VanDerWaalsContact O-CG 3.31Å; V173-L177 WeakPolarHBondContact O-CG 3.37Å; V173-L177 PolarHBondContact O-N 2.77Å
174	V	90.3	Very high	87	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-65.9	-35.6	-177.3	78.8	0	0	0	0	112	F161 A170 L177 Q178 K199 Y200 V203 F233	F161-V174 HydrophobicContact CE1-CB 4.06Å; A170-V174 WeakPolarHBondContact O-CB 3.32Å; A170-V174 WeakPolarHBondContact O-CG1 3.44Å; A170-V174 PolarHBondContact O-N 2.91Å; V174-L177 PolarHBondContact O-N 3.38Å; V174-Q178 WeakPolarHBondContact O-CB 3.29Å; V174-Q178 PolarHBondContact O-N 2.75Å; V174-K199 HydrophobicContact CG2-CB 4.31Å; V174-K199 HydrophobicContact CG2-CG 4.39Å; V174-Y200 HydrophobicContact CG1-CD2 4.33Å; V174-V203 HydrophobicContact CG1-CB 4.13Å; V174-V203 HydrophobicContact CG1-CG1 4.05Å; V174-V203 HydrophobicContact CG1-CG2 4.45Å; V174-F233 HydrophobicContact CG1-CE1 4.27Å; V174-F233 HydrophobicContact CG1-CZ 3.92Å
175	Q	89.4	Confident	87.4	Confident	19 Å²	19	52.1 Å²	52.1	9%	0.089	28%	0.277	C	S	.	.	H	α-helix	trans	-62.3	-45.8	176.1	-174.4	-81	-12.4	0	0	110.9	G171 V173 Q178 M179 Y200 Q232 F233	G171-Q175 VanDerWaalsContact O-CB 3.27Å; G171-Q175 WeakPolarHBondContact O-CB 3.48Å; G171-Q175 PolarHBondContact O-N 3.12Å; G171-Q175 VanDerWaalsContact O-N 3.17Å; V173-Q175 VanDerWaalsContact C-N 3.32Å; V173-Q175 PolarHBondContact O-N 3.45Å; Q175-Q178 PolarHBondContact O-N 3.45Å; Q175-M179 WeakPolarHBondContact O-CG 3.26Å; Q175-M179 PolarHBondContact O-N 2.58Å; Q175-M179 VanDerWaalsContact O-N 3.14Å; Q175-Y200 HydrophobicContact CB-CE2 4.42Å; Q175-Y200 HydrophobicContact CG-CE2 4.44Å; Q175-Q232 HydrophobicContact CG-CB 4.11Å; Q175-F233 HydrophobicContact CB-CD2 4.5Å; Q175-F233 HydrophobicContact CB-CE2 3.77Å; Q175-F233 HydrophobicContact CB-CZ 3.88Å; Q175-F233 HydrophobicContact CG-CD2 4.32Å; Q175-F233 HydrophobicContact CG-CE2 4.07Å; Q175-F233 HydrophobicContact CG-CZ 4.49Å
176	K	88.5	Confident	87.5	Confident	41 Å²	41	52.4 Å²	52.4	18%	0.178	27%	0.271	C	S	.	.	H	α-helix	trans	-66	-42	176.8	-69.2	170.9	-174.6	173.2	0	112.2	E139 L143 D172 V173 Q178 M179 I180	E139-K176 WeakPolarHBondContact OE1-CE 3.45Å; E139-K176 IonicContact OE1-NZ 3.68Å; E139-K176 PolarHBondContact OE1-NZ 3.37Å; L143-K176 HydrophobicContact CD1-CB 4.16Å; L143-K176 HydrophobicContact CD1-CD 4.42Å; L143-K176 HydrophobicContact CD2-CB 3.7Å; L143-K176 HydrophobicContact CD2-CD 4.31Å; D172-K176 WeakPolarHBondContact O-CD 3.31Å; D172-K176 WeakPolarHBondContact O-CG 3.48Å; D172-K176 PolarHBondContact O-N 3Å; D172-K176 WeakPolarHBondContact OD1-CE 3.33Å; D172-K176 IonicContact OD1-NZ 3.26Å; D172-K176 PolarHBondContact OD1-NZ 3.3Å; D172-K176 IonicContact OD2-NZ 3.45Å; D172-K176 PolarHBondContact OD2-NZ 3.15Å; V173-K176 PolarHBondContact O-N 3.44Å; K176-Q178 VanDerWaalsContact C-N 3.33Å; K176-Q178 PolarHBondContact O-N 2.71Å; K176-M179 HydrophobicContact CG-CE 4.26Å; K176-M179 PolarHBondContact O-N 2.72Å; K176-I180 WeakPolarHBondContact O-CG1 3.3Å; K176-I180 PolarHBondContact O-N 2.77Å; K176-I180 VanDerWaalsContact O-N 3.12Å
177	L	89.9	Confident	87.4	Confident	0 Å²	0	58.6 Å²	58.6	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-62.4	-39.5	175.4	-71.8	174.5	0	0	0	111.8	L143 H146 F147 F150 F161 V173 V174 I180 A181 I196	L143-L177 HydrophobicContact CD2-CD2 4.24Å; L143-L177 HydrophobicContact CD2-CG 4.28Å; H146-L177 HydrophobicContact CB-CD1 4.01Å; F147-L177 HydrophobicContact CB-CD2 3.9Å; F147-L177 HydrophobicContact CD2-CD2 4.09Å; F150-L177 HydrophobicContact CD2-CD1 3.92Å; F150-L177 HydrophobicContact CE2-CD1 3.56Å; F161-L177 HydrophobicContact CZ-CD1 4.16Å; V173-L177 HydrophobicContact CG1-CD1 3.83Å; V173-L177 HydrophobicContact CG1-CG 4.21Å; V173-L177 VanDerWaalsContact O-CG 3.31Å; V173-L177 WeakPolarHBondContact O-CG 3.37Å; V173-L177 PolarHBondContact O-N 2.77Å; V174-L177 PolarHBondContact O-N 3.38Å; L177-I180 PolarHBondContact O-N 3.19Å; L177-A181 VanDerWaalsContact O-CB 3.23Å; L177-A181 WeakPolarHBondContact O-CB 3.16Å; L177-A181 PolarHBondContact O-N 3.41Å; L177-I196 HydrophobicContact CB-CD1 4.44Å; L177-I196 HydrophobicContact CB-CG2 4Å
178	Q	89.9	Confident	87.1	Confident	53 Å²	53	65.6 Å²	65.6	25%	0.248	33%	0.33	C	S	.	.	H	α-helix	trans	-65.9	-37.5	177.6	-176.1	62	15.7	0	0	112	V174 Q175 K176 A181 A182 I196 Y200	V174-Q178 WeakPolarHBondContact O-CB 3.29Å; V174-Q178 PolarHBondContact O-N 2.75Å; Q175-Q178 PolarHBondContact O-N 3.45Å; K176-Q178 VanDerWaalsContact C-N 3.33Å; K176-Q178 PolarHBondContact O-N 2.71Å; Q178-A181 PolarHBondContact O-N 3.37Å; Q178-A182 WeakPolarHBondContact O-CB 3.29Å; Q178-A182 PolarHBondContact O-N 3.13Å; Q178-I196 HydrophobicContact CB-CG2 4.15Å; Q178-I196 VanDerWaalsContact OE1-CG2 3.31Å; Q178-Y200 HydrophobicContact CB-CD2 3.82Å; Q178-Y200 HydrophobicContact CB-CE2 4.35Å; Q178-Y200 HydrophobicContact CB-CG 4.43Å; Q178-Y200 HydrophobicContact CG-CD2 3.98Å; Q178-Y200 HydrophobicContact CG-CE2 4.39Å; Q178-Y200 HydrophobicContact CG-CG 4.25Å
179	M	86.9	Confident	87.1	Confident	107 Å²	107	67 Å²	67	53%	0.527	33%	0.331	S	S	.	.	H	α-helix	trans	-62.6	-44.6	173.1	-67.7	-167.8	-62.3	0	0	111.6	Q175 K176 A182	Q175-M179 WeakPolarHBondContact O-CG 3.26Å; Q175-M179 PolarHBondContact O-N 2.58Å; Q175-M179 VanDerWaalsContact O-N 3.14Å; K176-M179 HydrophobicContact CG-CE 4.26Å; K176-M179 PolarHBondContact O-N 2.72Å; M179-A182 PolarHBondContact O-N 3.29Å
180	I	87.1	Confident	87.2	Confident	69 Å²	69	68.7 Å²	68.7	35%	0.354	34%	0.339	S	S	.	.	H	α-helix	trans	-66	-45	177.3	-65.4	167.4	0	0	0	110.9	L143 K176 L177 A182 E183	L143-I180 HydrophobicContact CB-CD1 4.37Å; L143-I180 HydrophobicContact CD1-CD1 3.92Å; K176-I180 WeakPolarHBondContact O-CG1 3.3Å; K176-I180 PolarHBondContact O-N 2.77Å; K176-I180 VanDerWaalsContact O-N 3.12Å; L177-I180 PolarHBondContact O-N 3.19Å; I180-A182 PolarHBondContact O-N 3.16Å; I180-E183 PolarHBondContact O-N 2.74Å; I180-E183 VanDerWaalsContact O-N 3.12Å
181	A	87.3	Confident	87	Confident	1 Å²	1	71.9 Å²	71.9	1%	0.008	37%	0.365	C	S	.	.	H	α-helix	trans	-59.6	-36.3	179.9	0	0	0	0	0	111.5	L177 Q178 E183 L184 Q193 I196	L177-A181 VanDerWaalsContact O-CB 3.23Å; L177-A181 WeakPolarHBondContact O-CB 3.16Å; L177-A181 PolarHBondContact O-N 3.41Å; Q178-A181 PolarHBondContact O-N 3.37Å; A181-E183 VanDerWaalsContact C-N 3.29Å; A181-E183 PolarHBondContact O-N 3.06Å; A181-L184 PolarHBondContact O-N 3.25Å; A181-Q193 HydrophobicContact CB-CG 4.21Å; A181-Q193 WeakPolarHBondContact O-CG 3.32Å; A181-Q193 PolarHBondContact O-NE2 3.39Å; A181-I196 HydrophobicContact CB-CD1 3.85Å; A181-I196 HydrophobicContact CB-CG2 4.46Å
182	A	86.2	Confident	87	Confident	79 Å²	79	72.5 Å²	72.5	65%	0.653	37%	0.369	S	S	*	.	H	α-helix	trans	-67.1	-23.7	178.4	0	0	0	0	0	114.3	Q178 M179 I180	Q178-A182 WeakPolarHBondContact O-CB 3.29Å; Q178-A182 PolarHBondContact O-N 3.13Å; M179-A182 PolarHBondContact O-N 3.29Å; I180-A182 PolarHBondContact O-N 3.16Å
183	E	86.5	Confident	87.1	Confident	176 Å²	176	71.4 Å²	71.4	82%	0.822	36%	0.362	S	S	*	.	H	α-helix	trans	-86.7	-12.9	177.4	-66.3	-172.1	171.2	0	0	113.4	I180 A181	I180-E183 PolarHBondContact O-N 2.74Å; I180-E183 VanDerWaalsContact O-N 3.12Å; A181-E183 VanDerWaalsContact C-N 3.29Å; A181-E183 PolarHBondContact O-N 3.06Å
184	L	86.3	Confident	87.1	Confident	46 Å²	46	74.6 Å²	74.6	24%	0.241	39%	0.385	C	S	.	.	S	Bend	trans	-79.5	147.1	-177.9	-68.7	172	0	0	0	112.7	F147 A181 K186 Y189 Q193	F147-L184 HydrophobicContact CE1-CD1 4.27Å; F147-L184 HydrophobicContact CE2-CD1 3.77Å; F147-L184 HydrophobicContact CZ-CD1 3.33Å; A181-L184 PolarHBondContact O-N 3.25Å; L184-K186 PolarHBondContact O-N 2.65Å; L184-Y189 HydrophobicContact CB-CD2 4.02Å; L184-Y189 HydrophobicContact CB-CG 4.36Å; L184-Y189 HydrophobicContact CD1-CD1 4.48Å; L184-Y189 HydrophobicContact CD1-CD2 4.41Å; L184-Y189 HydrophobicContact CD1-CG 4.22Å; L184-Y189 HydrophobicContact CD2-CD2 4.44Å; L184-Y189 HydrophobicContact CD2-CE2 4.35Å; L184-Q193 PolarHBondContact O-NE2 2.95Å
185	P	87.3	Confident	87	Confident	71 Å²	71	77.9 Å²	77.9	46%	0.461	40%	0.397	S	S	.	.			trans	-65.7	123	177.4	24.4	-31.1	0	0	0	111.1	E187 K188 Y189	P185-E187 PolarHBondContact O-N 3.43Å; P185-K188 PolarHBondContact O-N 3.38Å; P185-Y189 HydrophobicContact CG-CD2 4.25Å; P185-Y189 HydrophobicContact CG-CE2 4.34Å; P185-Y189 PolarHBondContact O-N 3.45Å
186	K	83.8	Confident	87	Confident	157 Å²	157	77 Å²	77	68%	0.683	39%	0.393	S	S	*	.	H	α-helix	trans	-54	-39.2	-176.4	-66.8	-173.3	174.6	-175.3	0	113	L184 K188 Y189 E190	L184-K186 PolarHBondContact O-N 2.65Å; K186-K188 PolarHBondContact O-N 3.49Å; K186-Y189 PolarHBondContact O-N 2.92Å; K186-E190 WeakPolarHBondContact O-CB 3.33Å; K186-E190 PolarHBondContact O-N 2.82Å
187	E	82.5	Confident	87.1	Confident	187 Å²	187	76.4 Å²	76.4	87%	0.874	40%	0.396	S	S	*	.	H	α-helix	trans	-54.2	-29.4	-176.2	-63.6	162.7	-171	0	0	114.7	P185	P185-E187 PolarHBondContact O-N 3.43Å
188	K	82.7	Confident	87.1	Confident	169 Å²	169	84.4 Å²	84.4	74%	0.735	43%	0.427	S	S	*	.	H	α-helix	trans	-108.3	-24.2	-176.9	-69.1	-175	179.9	-179.9	0	113.9	P185 K186	P185-K188 PolarHBondContact O-N 3.38Å; K186-K188 PolarHBondContact O-N 3.49Å
189	Y	86.2	Confident	87.1	Confident	74 Å²	74	83.2 Å²	83.2	29%	0.29	42%	0.421	S	S	.	.	H	α-helix	trans	-123.3	11.9	-167.9	-61.6	-78.8	0	0	0	113.6	L151 L184 P185 K186 A191 V192 Q193	L151-Y189 HydrophobicContact CD2-CD1 4.32Å; L151-Y189 HydrophobicContact CD2-CE1 4.29Å; L184-Y189 HydrophobicContact CB-CD2 4.02Å; L184-Y189 HydrophobicContact CB-CG 4.36Å; L184-Y189 HydrophobicContact CD1-CD1 4.48Å; L184-Y189 HydrophobicContact CD1-CD2 4.41Å; L184-Y189 HydrophobicContact CD1-CG 4.22Å; L184-Y189 HydrophobicContact CD2-CD2 4.44Å; L184-Y189 HydrophobicContact CD2-CE2 4.35Å; P185-Y189 HydrophobicContact CG-CD2 4.25Å; P185-Y189 HydrophobicContact CG-CE2 4.34Å; P185-Y189 PolarHBondContact O-N 3.45Å; K186-Y189 PolarHBondContact O-N 2.92Å; Y189-A191 VanDerWaalsContact C-N 3.32Å; Y189-A191 PolarHBondContact O-N 2.93Å; Y189-V192 PolarHBondContact O-N 3.37Å; Y189-Q193 WeakPolarHBondContact O-CB 3.38Å; Y189-Q193 WeakPolarHBondContact O-CG 3.36Å; Y189-Q193 PolarHBondContact O-N 3.16Å
190	E	86.4	Confident	87.3	Confident	135 Å²	135	79.1 Å²	79.1	63%	0.631	40%	0.4	S	S	*	.	H	α-helix	trans	-52.5	-44.2	-178	-177	171.2	-154.7	0	0	113.6	K186 V192 Q193 S194	K186-E190 WeakPolarHBondContact O-CB 3.33Å; K186-E190 PolarHBondContact O-N 2.82Å; E190-V192 PolarHBondContact O-N 2.77Å; E190-Q193 PolarHBondContact O-N 3.44Å; E190-S194 WeakPolarHBondContact O-CB 3.33Å; E190-S194 PolarHBondContact O-N 3.24Å; E190-S194 PolarHBondContact O-OG 3.21Å
191	A	85.7	Confident	87.4	Confident	70 Å²	70	80.4 Å²	80.4	58%	0.579	41%	0.408	S	S	*	.	H	α-helix	trans	-61.8	-43.1	178.1	0	0	0	0	0	112	Y189 S194 R195	Y189-A191 VanDerWaalsContact C-N 3.32Å; Y189-A191 PolarHBondContact O-N 2.93Å; A191-S194 PolarHBondContact O-N 3.22Å; A191-R195 WeakPolarHBondContact O-CG 3.26Å; A191-R195 PolarHBondContact O-N 3.17Å; A191-R195 VanDerWaalsContact O-N 3.09Å
192	V	87.9	Confident	87.6	Confident	13 Å²	13	83.5 Å²	83.5	8%	0.079	42%	0.422	C	S	.	.	H	α-helix	trans	-69.6	-45.3	179.4	-177.4	0	0	0	0	110.7	F147 F150 L151 Y189 E190 S194 R195 I196	F147-V192 HydrophobicContact CE1-CG1 4.36Å; F147-V192 HydrophobicContact CE2-CG1 3.98Å; F147-V192 HydrophobicContact CZ-CG1 3.77Å; F150-V192 HydrophobicContact CB-CG1 4.08Å; L151-V192 HydrophobicContact CD2-CG2 3.59Å; L151-V192 HydrophobicContact CG-CG2 4.24Å; Y189-V192 PolarHBondContact O-N 3.37Å; E190-V192 PolarHBondContact O-N 2.77Å; V192-S194 VanDerWaalsContact C-N 3.29Å; V192-S194 PolarHBondContact O-N 2.89Å; V192-R195 PolarHBondContact O-N 3.14Å; V192-I196 HydrophobicContact CG1-CD1 3.79Å; V192-I196 HydrophobicContact CG1-CG1 4.38Å; V192-I196 WeakPolarHBondContact O-CG1 3.45Å; V192-I196 PolarHBondContact O-N 2.49Å
193	Q	89	Confident	87.8	Confident	29 Å²	29	79.9 Å²	79.9	14%	0.136	39%	0.392	C	S	.	.	H	α-helix	trans	-56.7	-43.6	175.7	-74.4	175	-21.1	0	0	111.3	A181 L184 Y189 E190 A197	A181-Q193 HydrophobicContact CB-CG 4.21Å; A181-Q193 WeakPolarHBondContact O-CG 3.32Å; A181-Q193 PolarHBondContact O-NE2 3.39Å; L184-Q193 PolarHBondContact O-NE2 2.95Å; Y189-Q193 WeakPolarHBondContact O-CB 3.38Å; Y189-Q193 WeakPolarHBondContact O-CG 3.36Å; Y189-Q193 PolarHBondContact O-N 3.16Å; E190-Q193 PolarHBondContact O-N 3.44Å; Q193-A197 VanDerWaalsContact O-CB 3.29Å; Q193-A197 WeakPolarHBondContact O-CB 3.45Å; Q193-A197 PolarHBondContact O-N 3.26Å
194	S	88.6	Confident	88	Confident	70 Å²	70	72.6 Å²	72.6	49%	0.49	36%	0.358	S	S	.	.	H	α-helix	trans	-66.4	-39.6	178.4	-58.2	0	0	0	0	112.1	E190 A191 V192 A197 Y198	E190-S194 WeakPolarHBondContact O-CB 3.33Å; E190-S194 PolarHBondContact O-N 3.24Å; E190-S194 PolarHBondContact O-OG 3.21Å; A191-S194 PolarHBondContact O-N 3.22Å; V192-S194 VanDerWaalsContact C-N 3.29Å; V192-S194 PolarHBondContact O-N 2.89Å; S194-A197 PolarHBondContact O-N 3.39Å; S194-Y198 WeakPolarHBondContact O-CB 3.33Å; S194-Y198 PolarHBondContact O-N 2.98Å
195	R	89.9	Confident	88.3	Confident	69 Å²	69	76.9 Å²	76.9	26%	0.26	37%	0.374	S	S	.	.	H	α-helix	trans	-67.8	-41.9	176.9	-73.4	179.4	68.7	-172.2	1.6	112.7	F150 S152 Q154 A191 V192 K199	F150-R195 HydrophobicContact CD1-CB 4.26Å; F150-R195 PolarHBondContact O-NH1 3.32Å; S152-R195 PolarHBondContact O-NH1 3.08Å; S152-R195 PolarHBondContact O-NH2 3.05Å; Q154-R195 PolarHBondContact O-NH2 3.36Å; A191-R195 WeakPolarHBondContact O-CG 3.26Å; A191-R195 PolarHBondContact O-N 3.17Å; A191-R195 VanDerWaalsContact O-N 3.09Å; V192-R195 PolarHBondContact O-N 3.14Å; R195-K199 PolarHBondContact O-N 3.05Å
196	I	89.6	Confident	88.4	Confident	0 Å²	0	76.9 Å²	76.9	0%	0	37%	0.369	C	S	.	.	H	α-helix	trans	-65.7	-42.7	176	-63.7	169.8	0	0	0	109.9	F147 F150 L177 Q178 A181 V192 K199 Y200	F147-I196 HydrophobicContact CD2-CD1 3.94Å; F147-I196 HydrophobicContact CE2-CD1 3.76Å; F150-I196 HydrophobicContact CB-CD1 4.4Å; F150-I196 HydrophobicContact CB-CG1 4.12Å; F150-I196 HydrophobicContact CD1-CG1 3.76Å; F150-I196 HydrophobicContact CD2-CG1 4.18Å; F150-I196 HydrophobicContact CE1-CG1 4.19Å; F150-I196 HydrophobicContact CG-CD1 4.42Å; F150-I196 HydrophobicContact CG-CG1 3.76Å; L177-I196 HydrophobicContact CB-CD1 4.44Å; L177-I196 HydrophobicContact CB-CG2 4Å; Q178-I196 HydrophobicContact CB-CG2 4.15Å; Q178-I196 VanDerWaalsContact OE1-CG2 3.31Å; A181-I196 HydrophobicContact CB-CD1 3.85Å; A181-I196 HydrophobicContact CB-CG2 4.46Å; V192-I196 HydrophobicContact CG1-CD1 3.79Å; V192-I196 HydrophobicContact CG1-CG1 4.38Å; V192-I196 WeakPolarHBondContact O-CG1 3.45Å; V192-I196 PolarHBondContact O-N 2.49Å; I196-K199 PolarHBondContact O-N 3.45Å; I196-Y200 WeakPolarHBondContact O-CB 3.45Å; I196-Y200 PolarHBondContact O-N 2.94Å
197	A	89.3	Confident	88.8	Confident	29 Å²	29	69.4 Å²	69.4	24%	0.24	34%	0.336	C	S	.	.	H	α-helix	trans	-62.5	-44.7	177.3	0	0	0	0	0	112.6	Q193 S194 K199 Y200 D201	Q193-A197 VanDerWaalsContact O-CB 3.29Å; Q193-A197 WeakPolarHBondContact O-CB 3.45Å; Q193-A197 PolarHBondContact O-N 3.26Å; S194-A197 PolarHBondContact O-N 3.39Å; A197-K199 VanDerWaalsContact C-N 3.33Å; A197-K199 PolarHBondContact O-N 2.82Å; A197-Y200 WeakPolarHBondContact O-CB 3.34Å; A197-Y200 PolarHBondContact O-N 3.33Å; A197-D201 PolarHBondContact O-N 3.45Å
198	Y	90.5	Very high	89.2	Confident	168 Å²	168	61.6 Å²	61.6	66%	0.659	30%	0.3	S	S	*	.	H	α-helix	trans	-59.3	-44.7	174.8	179.1	-91.2	0	0	0	111.5	S194 Y200 D201 E202	S194-Y198 WeakPolarHBondContact O-CB 3.33Å; S194-Y198 PolarHBondContact O-N 2.98Å; Y198-Y200 VanDerWaalsContact C-N 3.33Å; Y198-Y200 PolarHBondContact O-N 3.39Å; Y198-D201 PolarHBondContact O-N 2.86Å; Y198-E202 WeakPolarHBondContact O-CB 2.97Å; Y198-E202 PolarHBondContact O-N 3.39Å
199	K	89.5	Confident	89.6	Confident	28 Å²	28	57.5 Å²	57.5	12%	0.122	28%	0.284	C	S	.	.	H	α-helix	trans	-69	-32.5	178.8	-163.1	53.9	166.1	176.9	0	112.3	F150 L156 F161 V174 R195 I196 A197 E202 V203	F150-K199 HydrophobicContact CE1-CB 4.13Å; F150-K199 HydrophobicContact CE1-CG 4.38Å; F150-K199 HydrophobicContact CZ-CB 4.37Å; F150-K199 HydrophobicContact CZ-CG 4.25Å; L156-K199 HydrophobicContact CD1-CD 4.49Å; L156-K199 HydrophobicContact CD1-CG 4.34Å; F161-K199 HydrophobicContact CD1-CG 4.39Å; V174-K199 HydrophobicContact CG2-CB 4.31Å; V174-K199 HydrophobicContact CG2-CG 4.39Å; R195-K199 PolarHBondContact O-N 3.05Å; I196-K199 PolarHBondContact O-N 3.45Å; A197-K199 VanDerWaalsContact C-N 3.33Å; A197-K199 PolarHBondContact O-N 2.82Å; K199-E202 HydrophobicContact CD-CB 4.49Å; K199-E202 WeakPolarHBondContact CD-OE2 3.32Å; K199-E202 IonicContact NZ-OE1 2.66Å; K199-E202 PolarHBondContact NZ-OE1 3.48Å; K199-E202 IonicContact NZ-OE2 2.94Å; K199-E202 PolarHBondContact NZ-OE2 3.07Å; K199-V203 HydrophobicContact CD-CG2 4.32Å; K199-V203 HydrophobicContact CG-CG2 4.33Å; K199-V203 WeakPolarHBondContact O-CB 3.39Å; K199-V203 WeakPolarHBondContact O-CG2 3Å; K199-V203 PolarHBondContact O-N 2.98Å
200	Y	91.4	Very high	89.7	Confident	21 Å²	21	55.9 Å²	55.9	8%	0.082	28%	0.279	C	S	.	.	H	α-helix	trans	-60.4	-50.9	173.4	178.1	-85.7	0	0	0	111.1	V174 Q175 Q178 I196 A197 Y198 E202 V203 E204 F233 K234	V174-Y200 HydrophobicContact CG1-CD2 4.33Å; Q175-Y200 HydrophobicContact CB-CE2 4.42Å; Q175-Y200 HydrophobicContact CG-CE2 4.44Å; Q178-Y200 HydrophobicContact CB-CD2 3.82Å; Q178-Y200 HydrophobicContact CB-CE2 4.35Å; Q178-Y200 HydrophobicContact CB-CG 4.43Å; Q178-Y200 HydrophobicContact CG-CD2 3.98Å; Q178-Y200 HydrophobicContact CG-CE2 4.39Å; Q178-Y200 HydrophobicContact CG-CG 4.25Å; I196-Y200 WeakPolarHBondContact O-CB 3.45Å; I196-Y200 PolarHBondContact O-N 2.94Å; A197-Y200 WeakPolarHBondContact O-CB 3.34Å; A197-Y200 PolarHBondContact O-N 3.33Å; Y198-Y200 VanDerWaalsContact C-N 3.33Å; Y198-Y200 PolarHBondContact O-N 3.39Å; Y200-E202 PolarHBondContact O-N 3.23Å; Y200-V203 PolarHBondContact O-N 3.3Å; Y200-E204 WeakPolarHBondContact O-CB 3.1Å; Y200-E204 PolarHBondContact O-N 2.92Å; Y200-F233 HydrophobicContact CD2-CD1 4.24Å; Y200-F233 AromaticContact CD2-CE1 3.75Å; Y200-F233 HydrophobicContact CD2-CE1 3.75Å; Y200-F233 HydrophobicContact CD2-CZ 4.47Å; Y200-F233 AromaticContact CE1-CD1 3.93Å; Y200-F233 HydrophobicContact CE1-CD1 3.93Å; Y200-F233 HydrophobicContact CE1-CE1 4.31Å; Y200-F233 AromaticContact CE2-CD1 3.51Å; Y200-F233 HydrophobicContact CE2-CD1 3.51Å; Y200-F233 AromaticContact CE2-CE1 3.41Å; Y200-F233 HydrophobicContact CE2-CE1 3.41Å; Y200-F233 VanDerWaalsContact CE2-CE1 3.41Å; Y200-F233 HydrophobicContact CE2-CG 4.31Å; Y200-F233 HydrophobicContact CE2-CZ 4.15Å; Y200-F233 HydrophobicContact CG-CE1 4.33Å; Y200-F233 AromaticContact CZ-CD1 3.32Å; Y200-F233 AromaticContact CZ-CE1 3.73Å; Y200-F233 WeakPolarHBondContact OH-CA 3.24Å; Y200-F233 WeakPolarHBondContact OH-CD1 3.49Å; Y200-K234 PolarHBondContact OH-N 2.65Å
201	D	90.2	Very high	90	Very high	97 Å²	97	49.5 Å²	49.5	52%	0.519	25%	0.249	S	C	.	.	H	α-helix	trans	-65.3	-39	179.5	-67.8	-15.5	0	0	0	111.7	A197 Y198 K205	A197-D201 PolarHBondContact O-N 3.45Å; Y198-D201 PolarHBondContact O-N 2.86Å; D201-K205 WeakPolarHBondContact O-CB 3.49Å; D201-K205 PolarHBondContact O-N 2.79Å
202	E	90.4	Very high	90.3	Very high	65 Å²	65	47.4 Å²	47.4	30%	0.304	23%	0.229	S	C	.	.	H	α-helix	trans	-61.6	-50.4	175.6	-170.8	-165	152	0	0	111.6	Y198 K199 Y200 K205 M206	Y198-E202 WeakPolarHBondContact O-CB 2.97Å; Y198-E202 PolarHBondContact O-N 3.39Å; K199-E202 HydrophobicContact CD-CB 4.49Å; K199-E202 WeakPolarHBondContact CD-OE2 3.32Å; K199-E202 IonicContact NZ-OE1 2.66Å; K199-E202 PolarHBondContact NZ-OE1 3.48Å; K199-E202 IonicContact NZ-OE2 2.94Å; K199-E202 PolarHBondContact NZ-OE2 3.07Å; Y200-E202 PolarHBondContact O-N 3.23Å; E202-K205 PolarHBondContact O-N 2.9Å; E202-M206 HydrophobicContact CG-SD 4.37Å; E202-M206 VanDerWaalsContact O-CG 3.31Å; E202-M206 WeakPolarHBondContact O-CG 3.3Å; E202-M206 PolarHBondContact O-N 3.36Å
203	V	90.4	Very high	90.5	Very high	3 Å²	3	53.8 Å²	53.8	2%	0.018	25%	0.252	C	S	.	.	H	α-helix	trans	-66.5	-39.6	179.7	171.6	0	0	0	0	111.2	L167 V174 K199 Y200 K205 M206 L207	L167-V203 HydrophobicContact CD1-CG1 4.16Å; V174-V203 HydrophobicContact CG1-CB 4.13Å; V174-V203 HydrophobicContact CG1-CG1 4.05Å; V174-V203 HydrophobicContact CG1-CG2 4.45Å; K199-V203 HydrophobicContact CD-CG2 4.32Å; K199-V203 HydrophobicContact CG-CG2 4.33Å; K199-V203 WeakPolarHBondContact O-CB 3.39Å; K199-V203 WeakPolarHBondContact O-CG2 3Å; K199-V203 PolarHBondContact O-N 2.98Å; Y200-V203 PolarHBondContact O-N 3.3Å; V203-K205 PolarHBondContact O-N 3.23Å; V203-M206 PolarHBondContact O-N 3.3Å; V203-L207 HydrophobicContact CG1-CD1 3.87Å; V203-L207 HydrophobicContact CG1-CG 4.24Å; V203-L207 WeakPolarHBondContact O-CB 3.49Å; V203-L207 VanDerWaalsContact O-CG 3.27Å; V203-L207 WeakPolarHBondContact O-CG 3.35Å; V203-L207 PolarHBondContact O-N 2.75Å
204	E	91.4	Very high	90.6	Very high	24 Å²	24	54.7 Å²	54.7	11%	0.112	25%	0.254	C	S	.	.	H	α-helix	trans	-58.2	-48.7	175.4	-174.6	178.5	-119.4	0	0	111.3	Y200 L207 I208 L230 F233 G235	Y200-E204 WeakPolarHBondContact O-CB 3.1Å; Y200-E204 PolarHBondContact O-N 2.92Å; E204-L207 PolarHBondContact O-N 3.02Å; E204-I208 HydrophobicContact CG-CD1 4.37Å; E204-I208 WeakPolarHBondContact O-CG1 3.48Å; E204-I208 PolarHBondContact O-N 3.26Å; E204-I208 VanDerWaalsContact O-N 3.09Å; E204-L230 HydrophobicContact CG-CD2 4.42Å; E204-F233 HydrophobicContact CB-CD1 3.76Å; E204-F233 HydrophobicContact CB-CE1 4.04Å; E204-F233 HydrophobicContact CG-CB 4.45Å; E204-F233 HydrophobicContact CG-CD1 3.82Å; E204-F233 HydrophobicContact CG-CG 4.49Å; E204-F233 WeakPolarHBondContact OE1-CB 3.26Å; E204-G235 WeakPolarHBondContact OE1-CA 3.43Å; E204-G235 PolarHBondContact OE1-N 3.36Å
205	K	91.2	Very high	90.6	Very high	135 Å²	135	52.6 Å²	52.6	59%	0.587	24%	0.237	S	C	*	.	H	α-helix	trans	-61.8	-45.5	177.4	-177	179.7	174.7	-173.3	0	111.9	D201 E202 V203 L207 I208 E209	D201-K205 WeakPolarHBondContact O-CB 3.49Å; D201-K205 PolarHBondContact O-N 2.79Å; E202-K205 PolarHBondContact O-N 2.9Å; V203-K205 PolarHBondContact O-N 3.23Å; K205-L207 VanDerWaalsContact C-N 3.34Å; K205-L207 PolarHBondContact O-N 3.41Å; K205-I208 PolarHBondContact O-N 3.36Å; K205-E209 WeakPolarHBondContact CE-OE1 3.34Å; K205-E209 WeakPolarHBondContact O-CG 3.35Å; K205-E209 PolarHBondContact O-N 3.17Å
206	M	90.9	Very high	90.6	Very high	71 Å²	71	54.9 Å²	54.9	35%	0.35	25%	0.25	S	S	.	.	H	α-helix	trans	-62.2	-39.9	177.8	-72	-179.7	70.2	0	0	112.2	L167 E202 V203 E209 E210	L167-M206 HydrophobicContact CD1-CB 3.99Å; L167-M206 HydrophobicContact CD1-CE 4.17Å; L167-M206 HydrophobicContact CD1-SD 4.39Å; L167-M206 HydrophobicContact CD2-CB 3.98Å; E202-M206 HydrophobicContact CG-SD 4.37Å; E202-M206 VanDerWaalsContact O-CG 3.31Å; E202-M206 WeakPolarHBondContact O-CG 3.3Å; E202-M206 PolarHBondContact O-N 3.36Å; V203-M206 PolarHBondContact O-N 3.3Å; M206-E209 PolarHBondContact O-N 3.42Å; M206-E210 VanDerWaalsContact O-CB 3.3Å; M206-E210 WeakPolarHBondContact O-CB 3.35Å; M206-E210 PolarHBondContact O-N 3.48Å
207	L	90.8	Very high	90.6	Very high	0 Å²	0	58.2 Å²	58.2	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-63.9	-40.1	176.1	-75.3	169.2	0	0	0	111.8	L167 V203 E204 K205 E210 F211 V226 V229 L230 F233	L167-L207 HydrophobicContact CD2-CD2 4.09Å; L167-L207 HydrophobicContact CD2-CG 4.42Å; L167-L207 HydrophobicContact CG-CD2 3.84Å; L167-L207 HydrophobicContact CG-CG 4.22Å; V203-L207 HydrophobicContact CG1-CD1 3.87Å; V203-L207 HydrophobicContact CG1-CG 4.24Å; V203-L207 WeakPolarHBondContact O-CB 3.49Å; V203-L207 VanDerWaalsContact O-CG 3.27Å; V203-L207 WeakPolarHBondContact O-CG 3.35Å; V203-L207 PolarHBondContact O-N 2.75Å; E204-L207 PolarHBondContact O-N 3.02Å; K205-L207 VanDerWaalsContact C-N 3.34Å; K205-L207 PolarHBondContact O-N 3.41Å; L207-E210 PolarHBondContact O-N 3.14Å; L207-F211 WeakPolarHBondContact O-CB 3.37Å; L207-F211 PolarHBondContact O-N 3.32Å; L207-V226 HydrophobicContact CB-CG1 4.24Å; L207-V226 HydrophobicContact CD2-CG1 4.18Å; L207-V226 VanDerWaalsContact O-CG1 3.25Å; L207-V226 WeakPolarHBondContact O-CG1 3.48Å; L207-V229 HydrophobicContact CD1-CG1 4.05Å; L207-L230 HydrophobicContact CB-CD1 4.11Å; L207-L230 HydrophobicContact CB-CD2 3.67Å; L207-L230 HydrophobicContact CB-CG 3.92Å; L207-L230 HydrophobicContact CD1-CD2 4Å; L207-L230 HydrophobicContact CD1-CG 4.37Å; L207-L230 HydrophobicContact CG-CD2 4.5Å; L207-F233 HydrophobicContact CD1-CE2 4.42Å; L207-F233 HydrophobicContact CD1-CZ 4.33Å
208	I	90.9	Very high	90.4	Very high	23 Å²	23	62.6 Å²	62.6	12%	0.118	30%	0.297	C	S	.	.	H	α-helix	trans	-66	-44.3	175.9	-65.6	169	0	0	0	110.9	E204 K205 E210 F211 V212 L230 Q238 C239 A242	E204-I208 HydrophobicContact CG-CD1 4.37Å; E204-I208 WeakPolarHBondContact O-CG1 3.48Å; E204-I208 PolarHBondContact O-N 3.26Å; E204-I208 VanDerWaalsContact O-N 3.09Å; K205-I208 PolarHBondContact O-N 3.36Å; I208-E210 VanDerWaalsContact C-N 3.34Å; I208-E210 PolarHBondContact O-N 2.94Å; I208-F211 WeakPolarHBondContact O-CB 3.4Å; I208-F211 PolarHBondContact O-N 3.11Å; I208-V212 WeakPolarHBondContact O-CG2 3.48Å; I208-V212 PolarHBondContact O-N 3.4Å; I208-V212 VanDerWaalsContact O-N 3.08Å; I208-L230 HydrophobicContact CG1-CD1 4.03Å; I208-L230 HydrophobicContact CG1-CD2 4.24Å; I208-Q238 HydrophobicContact CD1-CB 4.07Å; I208-C239 HydrophobicContact CG1-CB 4.33Å; I208-A242 HydrophobicContact CG2-CB 4.44Å
209	E	90.8	Very high	90.4	Very high	84 Å²	84	56 Å²	56	39%	0.393	28%	0.277	S	S	.	.	H	α-helix	trans	-60.9	-43.3	176.3	-72.7	179	-169.2	0	0	111.7	K205 M206 V212 R213	K205-E209 WeakPolarHBondContact CE-OE1 3.34Å; K205-E209 WeakPolarHBondContact O-CG 3.35Å; K205-E209 PolarHBondContact O-N 3.17Å; M206-E209 PolarHBondContact O-N 3.42Å; E209-V212 PolarHBondContact O-N 3.25Å; E209-R213 WeakPolarHBondContact O-CG 3.45Å; E209-R213 PolarHBondContact O-N 2.94Å
210	E	89.8	Confident	90.4	Very high	40 Å²	40	57.9 Å²	57.9	19%	0.187	29%	0.285	C	S	.	.	H	α-helix	trans	-69.7	-34.6	179	-162.8	65.3	-165.7	0	0	111.7	L167 M206 L207 I208 V212 R213 Y214	L167-E210 HydrophobicContact CD2-CB 4.29Å; M206-E210 VanDerWaalsContact O-CB 3.3Å; M206-E210 WeakPolarHBondContact O-CB 3.35Å; M206-E210 PolarHBondContact O-N 3.48Å; L207-E210 PolarHBondContact O-N 3.14Å; I208-E210 VanDerWaalsContact C-N 3.34Å; I208-E210 PolarHBondContact O-N 2.94Å; E210-V212 PolarHBondContact O-N 3.01Å; E210-R213 PolarHBondContact O-N 3.38Å; E210-R213 WeakPolarHBondContact OE2-CD 3.36Å; E210-R213 IonicContact OE2-CZ 3.01Å; E210-R213 IonicContact OE2-NH1 2.86Å; E210-R213 PolarHBondContact OE2-NH1 3.15Å; E210-Y214 HydrophobicContact CG-CD2 4.05Å; E210-Y214 HydrophobicContact CG-CE1 4.35Å; E210-Y214 HydrophobicContact CG-CE2 3.42Å; E210-Y214 VanDerWaalsContact CG-CE2 3.42Å; E210-Y214 VanDerWaalsContact O-CD2 3.29Å; E210-Y214 WeakPolarHBondContact O-CD2 3.34Å; E210-Y214 PolarHBondContact O-N 3.47Å; E210-Y214 VanDerWaalsContact OE1-CE1 3.27Å; E210-Y214 WeakPolarHBondContact OE1-CE1 3.42Å; E210-Y214 PolarHBondContact OE1-OH 3.03Å
211	F	92.2	Very high	90.3	Very high	0 Å²	0	62.2 Å²	62.2	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-58.8	-46.4	170.7	-178.2	-90.1	0	0	0	111.7	L207 I208 Y214 H215 M223 V226 A227 F243 V275 F276	L207-F211 WeakPolarHBondContact O-CB 3.37Å; L207-F211 PolarHBondContact O-N 3.32Å; I208-F211 WeakPolarHBondContact O-CB 3.4Å; I208-F211 PolarHBondContact O-N 3.11Å; F211-Y214 PolarHBondContact O-N 3.04Å; F211-H215 WeakPolarHBondContact O-CB 3.5Å; F211-H215 PolarHBondContact O-N 3.23Å; F211-M223 HydrophobicContact CD2-CB 4.18Å; F211-M223 HydrophobicContact CE1-CE 3.92Å; F211-M223 HydrophobicContact CE2-CB 3.79Å; F211-M223 HydrophobicContact CE2-CE 3.9Å; F211-M223 HydrophobicContact CE2-CG 4.35Å; F211-M223 HydrophobicContact CZ-CB 4.49Å; F211-M223 HydrophobicContact CZ-CE 3.45Å; F211-M223 VanDerWaalsContact CZ-CE 3.45Å; F211-V226 HydrophobicContact CB-CG1 3.78Å; F211-V226 HydrophobicContact CD2-CB 4.32Å; F211-V226 HydrophobicContact CD2-CG1 4.2Å; F211-V226 HydrophobicContact CG-CG1 4.48Å; F211-A227 HydrophobicContact CD2-CB 4.41Å; F211-A227 HydrophobicContact CE2-CB 3.95Å; F211-F243 HydrophobicContact CE1-CB 4Å; F211-F243 HydrophobicContact CE1-CD2 4.13Å; F211-F243 HydrophobicContact CZ-CD2 4.23Å; F211-V275 HydrophobicContact CE2-CG1 3.84Å; F211-V275 HydrophobicContact CZ-CG1 4.14Å; F211-F276 HydrophobicContact CE1-CZ 4.28Å; F211-F276 HydrophobicContact CE2-CE1 4.43Å; F211-F276 HydrophobicContact CE2-CZ 4.34Å; F211-F276 HydrophobicContact CZ-CE1 4.02Å; F211-F276 HydrophobicContact CZ-CE2 4.32Å; F211-F276 AromaticContact CZ-CZ 3.55Å; F211-F276 HydrophobicContact CZ-CZ 3.55Å
212	V	91.5	Very high	90.3	Very high	27 Å²	27	62.6 Å²	62.6	16%	0.164	31%	0.307	C	S	.	.	H	α-helix	trans	-63.9	-41.7	177.2	172.7	0	0	0	0	111.1	I208 E209 E210 H215 H216 A242 Q246	I208-V212 WeakPolarHBondContact O-CG2 3.48Å; I208-V212 PolarHBondContact O-N 3.4Å; I208-V212 VanDerWaalsContact O-N 3.08Å; E209-V212 PolarHBondContact O-N 3.25Å; E210-V212 PolarHBondContact O-N 3.01Å; V212-H215 WeakPolarHBondContact O-CB 3.23Å; V212-H215 PolarHBondContact O-N 2.72Å; V212-H216 PolarHBondContact O-CD2 3.09Å; V212-H216 PolarHBondContact O-N 3.12Å; V212-A242 HydrophobicContact CG2-CB 3.94Å; V212-Q246 HydrophobicContact CG1-CG 4.2Å
213	R	91.5	Very high	90.3	Very high	147 Å²	147	59.6 Å²	59.6	56%	0.555	29%	0.293	S	S	*	.	H	α-helix	trans	-60.9	-45.2	174.1	-71.7	175	-171.7	166.8	2.7	112.1	E209 E210 H215 H216 A217	E209-R213 WeakPolarHBondContact O-CG 3.45Å; E209-R213 PolarHBondContact O-N 2.94Å; E210-R213 PolarHBondContact O-N 3.38Å; E210-R213 WeakPolarHBondContact OE2-CD 3.36Å; E210-R213 IonicContact OE2-CZ 3.01Å; E210-R213 IonicContact OE2-NH1 2.86Å; E210-R213 PolarHBondContact OE2-NH1 3.15Å; R213-H215 VanDerWaalsContact C-N 3.29Å; R213-H215 PolarHBondContact O-N 2.68Å; R213-H216 PolarHBondContact O-N 3.25Å; R213-A217 WeakPolarHBondContact O-CB 3.32Å; R213-A217 PolarHBondContact O-N 2.95Å
214	Y	91.6	Very high	90.4	Very high	47 Å²	47	64.7 Å²	64.7	18%	0.184	32%	0.315	C	S	.	.	H	α-helix	trans	-66	-31.4	176	-67.7	-33.5	0	0	0	113	E210 F211 A217 N218 A219 K222 V226	E210-Y214 HydrophobicContact CG-CD2 4.05Å; E210-Y214 HydrophobicContact CG-CE1 4.35Å; E210-Y214 HydrophobicContact CG-CE2 3.42Å; E210-Y214 VanDerWaalsContact CG-CE2 3.42Å; E210-Y214 VanDerWaalsContact O-CD2 3.29Å; E210-Y214 WeakPolarHBondContact O-CD2 3.34Å; E210-Y214 PolarHBondContact O-N 3.47Å; E210-Y214 VanDerWaalsContact OE1-CE1 3.27Å; E210-Y214 WeakPolarHBondContact OE1-CE1 3.42Å; E210-Y214 PolarHBondContact OE1-OH 3.03Å; F211-Y214 PolarHBondContact O-N 3.04Å; Y214-A217 CarbonylContact O-C 3.59Å; Y214-A217 PolarHBondContact O-N 2.71Å; Y214-N218 PolarHBondContact O-N 3.37Å; Y214-N218 VanDerWaalsContact O-N 3.16Å; Y214-A219 HydrophobicContact CD1-CB 4.19Å; Y214-A219 HydrophobicContact CG-CB 4.45Å; Y214-A219 PolarHBondContact O-N 2.79Å; Y214-K222 HydrophobicContact CD1-CB 3.99Å; Y214-K222 HydrophobicContact CD1-CD 3.71Å; Y214-K222 HydrophobicContact CD2-CB 3.45Å; Y214-K222 VanDerWaalsContact CD2-CB 3.45Å; Y214-K222 HydrophobicContact CD2-CD 4.37Å; Y214-K222 HydrophobicContact CE1-CB 4.2Å; Y214-K222 HydrophobicContact CE1-CD 3.32Å; Y214-K222 HydrophobicContact CE1-CG 4.42Å; Y214-K222 HydrophobicContact CE2-CB 3.62Å; Y214-K222 HydrophobicContact CE2-CD 3.98Å; Y214-K222 HydrophobicContact CE2-CG 4.42Å; Y214-K222 HydrophobicContact CG-CB 3.66Å; Y214-K222 HydrophobicContact CG-CD 4.25Å; Y214-K222 VanDerWaalsContact CZ-CD 3.48Å; Y214-V226 HydrophobicContact CD2-CG2 4.04Å; Y214-V226 HydrophobicContact CE2-CG2 3.94Å
215	H	90	Very high	90.3	Very high	27 Å²	27	68.9 Å²	68.9	13%	0.125	33%	0.334	C	S	.	.	H	α-helix	trans	-63	-48.8	171.9	-172.9	-153.8	0	0	0	111.6	F211 V212 R213 A217 N218 M223 F243 Q246	F211-H215 WeakPolarHBondContact O-CB 3.5Å; F211-H215 PolarHBondContact O-N 3.23Å; V212-H215 WeakPolarHBondContact O-CB 3.23Å; V212-H215 PolarHBondContact O-N 2.72Å; R213-H215 VanDerWaalsContact C-N 3.29Å; R213-H215 PolarHBondContact O-N 2.68Å; H215-A217 VanDerWaalsContact C-N 3.28Å; H215-A217 PolarHBondContact O-N 3.38Å; H215-N218 PolarHBondContact O-N 3.03Å; H215-N218 VanDerWaalsContact O-N 3.1Å; H215-M223 VanDerWaalsContact CA-SD 3.5Å; H215-M223 HydrophobicContact CB-CE 3.62Å; H215-M223 HydrophobicContact CB-SD 4Å; H215-F243 AromaticContact CE1-CD2 3.94Å; H215-F243 AromaticContact CE1-CE2 3.98Å; H215-F243 AromaticContact NE2-CE2 3.83Å; H215-Q246 WeakPolarHBondContact ND1-CB 3.44Å
216	H	88.7	Confident	90.3	Very high	117 Å²	117	62.5 Å²	62.5	54%	0.542	31%	0.307	S	S	.	.	H	α-helix	trans	-62.5	-33.9	175	-71.5	-60.7	0	0	0	113.1	V212 R213 N218 Q246	V212-H216 PolarHBondContact O-CD2 3.09Å; V212-H216 PolarHBondContact O-N 3.12Å; R213-H216 PolarHBondContact O-N 3.25Å; H216-N218 VanDerWaalsContact C-N 3.25Å; H216-N218 PolarHBondContact O-N 3.39Å; H216-Q246 PolarHBondContact CE1-OE1 3.39Å; H216-Q246 PolarHBondContact NE2-NE2 3.32Å; H216-Q246 PolarHBondContact NE2-OE1 3.5Å
217	A	89.4	Confident	90.3	Very high	69 Å²	69	59.1 Å²	59.1	57%	0.57	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.2	0.4	176.6	0	0	0	0	0	114.2	R213 Y214 H215 A219	R213-A217 WeakPolarHBondContact O-CB 3.32Å; R213-A217 PolarHBondContact O-N 2.95Å; Y214-A217 CarbonylContact O-C 3.59Å; Y214-A217 PolarHBondContact O-N 2.71Å; H215-A217 VanDerWaalsContact C-N 3.28Å; H215-A217 PolarHBondContact O-N 3.38Å; A217-A219 HydrophobicContact CB-CB 4.35Å; A217-A219 PolarHBondContact O-N 3.32Å; A217-A219 VanDerWaalsContact O-N 3.16Å
218	N	86.2	Confident	90.3	Very high	122 Å²	122	64.6 Å²	64.6	65%	0.652	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.7	25.9	-172.5	-92.9	-35.4	0	0	0	113.9	Y214 H215 H216 K220	Y214-N218 PolarHBondContact O-N 3.37Å; Y214-N218 VanDerWaalsContact O-N 3.16Å; H215-N218 PolarHBondContact O-N 3.03Å; H215-N218 VanDerWaalsContact O-N 3.1Å; H216-N218 VanDerWaalsContact C-N 3.25Å; H216-N218 PolarHBondContact O-N 3.39Å; N218-K220 VanDerWaalsContact C-N 3.35Å; N218-K220 PolarHBondContact O-N 3Å
219	A	90	Very high	90.2	Very high	28 Å²	28	64.2 Å²	64.2	23%	0.231	31%	0.314	C	S	.	.			trans	-86.8	68.6	-175.7	0	0	0	0	0	111.8	Y214 A217 N221 K222 M223	Y214-A219 HydrophobicContact CD1-CB 4.19Å; Y214-A219 HydrophobicContact CG-CB 4.45Å; Y214-A219 PolarHBondContact O-N 2.79Å; A217-A219 HydrophobicContact CB-CB 4.35Å; A217-A219 PolarHBondContact O-N 3.32Å; A217-A219 VanDerWaalsContact O-N 3.16Å; A219-N221 VanDerWaalsContact C-N 3.35Å; A219-N221 PolarHBondContact O-N 3.5Å; A219-K222 HydrophobicContact CB-CB 4.29Å; A219-K222 HydrophobicContact CB-CD 4.41Å; A219-K222 HydrophobicContact CB-CG 4.39Å; A219-K222 PolarHBondContact O-N 3.23Å; A219-M223 PolarHBondContact O-N 2.93Å
220	K	89	Confident	90.2	Very high	68 Å²	68	60.2 Å²	60.2	30%	0.296	30%	0.295	S	S	.	.	H	α-helix	trans	-53.4	-42.8	-172.5	-58.9	-173	-178.9	179.5	0	115	N218 K222 M223 K224 E274 V275	N218-K220 VanDerWaalsContact C-N 3.35Å; N218-K220 PolarHBondContact O-N 3Å; K220-K222 VanDerWaalsContact C-N 3.29Å; K220-K222 PolarHBondContact O-N 3.23Å; K220-M223 WeakPolarHBondContact O-CB 3.29Å; K220-M223 PolarHBondContact O-N 3.3Å; K220-K224 WeakPolarHBondContact O-CB 3.29Å; K220-K224 PolarHBondContact O-N 3.3Å; K220-E274 VanDerWaalsContact CD-CD 3.47Å; K220-E274 WeakPolarHBondContact CD-OE1 3.26Å; K220-E274 WeakPolarHBondContact CD-OE2 3.3Å; K220-E274 IonicContact NZ-OE2 2.63Å; K220-E274 PolarHBondContact NZ-OE2 3.22Å; K220-V275 HydrophobicContact CB-CG2 4.47Å
221	N	89.1	Confident	90.2	Very high	113 Å²	113	60.5 Å²	60.5	60%	0.604	30%	0.302	S	S	*	.	H	α-helix	trans	-61.9	-38.4	179.2	-72.7	-33.5	0	0	0	112.2	A219 K224 Q225	A219-N221 VanDerWaalsContact C-N 3.35Å; A219-N221 PolarHBondContact O-N 3.5Å; N221-K224 WeakPolarHBondContact O-CB 3.48Å; N221-K224 PolarHBondContact O-N 3.16Å; N221-Q225 WeakPolarHBondContact O-CG 3.07Å; N221-Q225 PolarHBondContact O-N 3.47Å; N221-Q225 VanDerWaalsContact O-N 3.15Å
222	K	89.9	Confident	89.8	Confident	105 Å²	105	64.7 Å²	64.7	46%	0.457	32%	0.322	S	S	.	.	H	α-helix	trans	-73.4	-41.5	177.3	-61.6	-166.7	175.4	-168.2	0	111.1	Y214 A219 K220 K224 Q225 V226	Y214-K222 HydrophobicContact CD1-CB 3.99Å; Y214-K222 HydrophobicContact CD1-CD 3.71Å; Y214-K222 HydrophobicContact CD2-CB 3.45Å; Y214-K222 VanDerWaalsContact CD2-CB 3.45Å; Y214-K222 HydrophobicContact CD2-CD 4.37Å; Y214-K222 HydrophobicContact CE1-CB 4.2Å; Y214-K222 HydrophobicContact CE1-CD 3.32Å; Y214-K222 HydrophobicContact CE1-CG 4.42Å; Y214-K222 HydrophobicContact CE2-CB 3.62Å; Y214-K222 HydrophobicContact CE2-CD 3.98Å; Y214-K222 HydrophobicContact CE2-CG 4.42Å; Y214-K222 HydrophobicContact CG-CB 3.66Å; Y214-K222 HydrophobicContact CG-CD 4.25Å; Y214-K222 VanDerWaalsContact CZ-CD 3.48Å; A219-K222 HydrophobicContact CB-CB 4.29Å; A219-K222 HydrophobicContact CB-CD 4.41Å; A219-K222 HydrophobicContact CB-CG 4.39Å; A219-K222 PolarHBondContact O-N 3.23Å; K220-K222 VanDerWaalsContact C-N 3.29Å; K220-K222 PolarHBondContact O-N 3.23Å; K222-K224 PolarHBondContact O-N 3.49Å; K222-Q225 PolarHBondContact O-N 2.96Å; K222-V226 WeakPolarHBondContact O-CG2 3.3Å; K222-V226 PolarHBondContact O-N 2.87Å
223	M	91.7	Very high	89.7	Confident	2 Å²	2	63.9 Å²	63.9	1%	0.01	32%	0.316	C	S	.	.	H	α-helix	trans	-55.2	-42.9	171.4	-64.8	175.8	70.1	0	0	111.5	F211 H215 A219 K220 V226 A227 F243 V275	F211-M223 HydrophobicContact CD2-CB 4.18Å; F211-M223 HydrophobicContact CE1-CE 3.92Å; F211-M223 HydrophobicContact CE2-CB 3.79Å; F211-M223 HydrophobicContact CE2-CE 3.9Å; F211-M223 HydrophobicContact CE2-CG 4.35Å; F211-M223 HydrophobicContact CZ-CB 4.49Å; F211-M223 HydrophobicContact CZ-CE 3.45Å; F211-M223 VanDerWaalsContact CZ-CE 3.45Å; H215-M223 VanDerWaalsContact CA-SD 3.5Å; H215-M223 HydrophobicContact CB-CE 3.62Å; H215-M223 HydrophobicContact CB-SD 4Å; A219-M223 PolarHBondContact O-N 2.93Å; K220-M223 WeakPolarHBondContact O-CB 3.29Å; K220-M223 PolarHBondContact O-N 3.3Å; M223-V226 PolarHBondContact O-N 2.92Å; M223-A227 VanDerWaalsContact O-CB 3.24Å; M223-A227 WeakPolarHBondContact O-CB 3.33Å; M223-A227 PolarHBondContact O-N 2.91Å; M223-F243 HydrophobicContact CE-CD2 4.29Å; M223-F243 HydrophobicContact CE-CE2 4.32Å; M223-V275 HydrophobicContact CB-CG1 3.77Å; M223-V275 HydrophobicContact CB-CG2 4.12Å; M223-V275 HydrophobicContact CE-CG1 4.32Å; M223-V275 HydrophobicContact CE-CG2 4.46Å; M223-V275 HydrophobicContact SD-CG2 4.49Å
224	K	92.2	Very high	89.4	Confident	109 Å²	109	66.3 Å²	66.3	47%	0.474	33%	0.331	S	S	.	.	H	α-helix	trans	-61.8	-45.2	178.1	-175.4	-178.5	-172.2	163.8	0	112.2	K220 N221 K222 H228 E274	K220-K224 WeakPolarHBondContact O-CB 3.29Å; K220-K224 PolarHBondContact O-N 3.3Å; N221-K224 WeakPolarHBondContact O-CB 3.48Å; N221-K224 PolarHBondContact O-N 3.16Å; K222-K224 PolarHBondContact O-N 3.49Å; K224-H228 WeakPolarHBondContact O-CB 3.16Å; K224-H228 PolarHBondContact O-N 3.48Å; K224-E274 VanDerWaalsContact CD-O 3.3Å; K224-E274 WeakPolarHBondContact CD-O 3.22Å
225	Q	89.7	Confident	88.9	Confident	112 Å²	112	64.3 Å²	64.3	52%	0.523	32%	0.324	S	S	.	.	H	α-helix	trans	-61.3	-47.6	177.1	-71.2	171.5	9.4	0	0	111.1	N221 K222 H228 V229	N221-Q225 WeakPolarHBondContact O-CG 3.07Å; N221-Q225 PolarHBondContact O-N 3.47Å; N221-Q225 VanDerWaalsContact O-N 3.15Å; K222-Q225 PolarHBondContact O-N 2.96Å; Q225-H228 PolarHBondContact O-N 3.29Å; Q225-V229 PolarHBondContact O-N 3.45Å
226	V	91	Very high	88.8	Confident	2 Å²	2	64.1 Å²	64.1	1%	0.012	32%	0.322	C	S	.	.	H	α-helix	trans	-65.1	-44.9	179.2	176.2	0	0	0	0	111.6	V168 L207 F211 Y214 K222 M223 H228 V229 L230	V168-V226 HydrophobicContact CG2-CG2 4.33Å; L207-V226 HydrophobicContact CB-CG1 4.24Å; L207-V226 HydrophobicContact CD2-CG1 4.18Å; L207-V226 VanDerWaalsContact O-CG1 3.25Å; L207-V226 WeakPolarHBondContact O-CG1 3.48Å; F211-V226 HydrophobicContact CB-CG1 3.78Å; F211-V226 HydrophobicContact CD2-CB 4.32Å; F211-V226 HydrophobicContact CD2-CG1 4.2Å; F211-V226 HydrophobicContact CG-CG1 4.48Å; Y214-V226 HydrophobicContact CD2-CG2 4.04Å; Y214-V226 HydrophobicContact CE2-CG2 3.94Å; K222-V226 WeakPolarHBondContact O-CG2 3.3Å; K222-V226 PolarHBondContact O-N 2.87Å; M223-V226 PolarHBondContact O-N 2.92Å; V226-H228 VanDerWaalsContact C-N 3.29Å; V226-H228 PolarHBondContact O-N 3.02Å; V226-V229 PolarHBondContact O-N 3.45Å; V226-L230 HydrophobicContact CG1-CD1 3.76Å; V226-L230 HydrophobicContact CG1-CG 4.28Å; V226-L230 WeakPolarHBondContact O-CB 3.45Å; V226-L230 WeakPolarHBondContact O-CG 3.43Å; V226-L230 PolarHBondContact O-N 3.18Å
227	A	91.3	Very high	88.8	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-63.1	-33.8	177	0	0	0	0	0	112.8	F211 M223 S231 V275 F276	F211-A227 HydrophobicContact CD2-CB 4.41Å; F211-A227 HydrophobicContact CE2-CB 3.95Å; M223-A227 VanDerWaalsContact O-CB 3.24Å; M223-A227 WeakPolarHBondContact O-CB 3.33Å; M223-A227 PolarHBondContact O-N 2.91Å; A227-S231 WeakPolarHBondContact O-CB 3.48Å; A227-S231 PolarHBondContact O-N 3.01Å; A227-V275 HydrophobicContact CB-CG1 4.2Å; A227-F276 HydrophobicContact CB-CD1 4.12Å; A227-F276 HydrophobicContact CB-CE1 4.34Å
228	H	90.1	Very high	88.9	Confident	114 Å²	114	62.4 Å²	62.4	53%	0.528	31%	0.311	S	S	.	.	H	α-helix	trans	-66.6	-44.5	175.8	-171.2	68.1	0	0	0	111.6	K224 Q225 V226 S231	K224-H228 WeakPolarHBondContact O-CB 3.16Å; K224-H228 PolarHBondContact O-N 3.48Å; Q225-H228 PolarHBondContact O-N 3.29Å; V226-H228 VanDerWaalsContact C-N 3.29Å; V226-H228 PolarHBondContact O-N 3.02Å; H228-S231 WeakPolarHBondContact O-CB 3.39Å; H228-S231 PolarHBondContact O-N 2.94Å; H228-S231 PolarHBondContact O-OG 3.46Å
229	V	88.7	Confident	89.1	Confident	15 Å²	15	56.6 Å²	56.6	9%	0.091	28%	0.279	C	S	.	.	H	α-helix	trans	-66.6	-48	175.6	175.5	0	0	0	0	111.1	V168 L207 Q225 V226 S231 Q232 F233	V168-V229 HydrophobicContact CG1-CG2 3.56Å; L207-V229 HydrophobicContact CD1-CG1 4.05Å; Q225-V229 PolarHBondContact O-N 3.45Å; V226-V229 PolarHBondContact O-N 3.45Å; V229-S231 PolarHBondContact O-N 3.38Å; V229-S231 VanDerWaalsContact O-N 3.13Å; V229-Q232 PolarHBondContact O-N 2.99Å; V229-F233 HydrophobicContact CG1-CE2 3.9Å; V229-F233 WeakPolarHBondContact O-CD2 3.34Å
230	L	90.5	Very high	89.2	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-61	-22.8	178.2	-77.2	174.7	0	0	0	113.5	E204 L207 I208 V226 Q232 F233 Y236 C239	E204-L230 HydrophobicContact CG-CD2 4.42Å; L207-L230 HydrophobicContact CB-CD1 4.11Å; L207-L230 HydrophobicContact CB-CD2 3.67Å; L207-L230 HydrophobicContact CB-CG 3.92Å; L207-L230 HydrophobicContact CD1-CD2 4Å; L207-L230 HydrophobicContact CD1-CG 4.37Å; L207-L230 HydrophobicContact CG-CD2 4.5Å; I208-L230 HydrophobicContact CG1-CD1 4.03Å; I208-L230 HydrophobicContact CG1-CD2 4.24Å; V226-L230 HydrophobicContact CG1-CD1 3.76Å; V226-L230 HydrophobicContact CG1-CG 4.28Å; V226-L230 WeakPolarHBondContact O-CB 3.45Å; V226-L230 WeakPolarHBondContact O-CG 3.43Å; V226-L230 PolarHBondContact O-N 3.18Å; L230-Q232 PolarHBondContact O-N 3.4Å; L230-Q232 VanDerWaalsContact O-N 3.12Å; L230-F233 HydrophobicContact CD2-CB 4.41Å; L230-F233 HydrophobicContact CD2-CG 4.42Å; L230-F233 WeakPolarHBondContact O-CB 3.27Å; L230-F233 PolarHBondContact O-N 2.92Å; L230-Y236 HydrophobicContact CB-CD2 4.19Å; L230-Y236 WeakPolarHBondContact O-CB 3.01Å; L230-C239 HydrophobicContact CD1-CB 3.93Å
231	S	88.9	Confident	89.3	Confident	46 Å²	46	55.2 Å²	55.2	32%	0.322	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-19.9	178.1	74.9	0	0	0	0	114.1	A227 H228 V229	A227-S231 WeakPolarHBondContact O-CB 3.48Å; A227-S231 PolarHBondContact O-N 3.01Å; H228-S231 WeakPolarHBondContact O-CB 3.39Å; H228-S231 PolarHBondContact O-N 2.94Å; H228-S231 PolarHBondContact O-OG 3.46Å; V229-S231 PolarHBondContact O-N 3.38Å; V229-S231 VanDerWaalsContact O-N 3.13Å
232	Q	85.6	Confident	89.3	Confident	89 Å²	89	50.8 Å²	50.8	42%	0.416	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.7	-5.4	176.5	-56.4	-178.3	13.9	0	0	113.1	Q175 V229 L230	Q175-Q232 HydrophobicContact CG-CB 4.11Å; V229-Q232 PolarHBondContact O-N 2.99Å; L230-Q232 PolarHBondContact O-N 3.4Å; L230-Q232 VanDerWaalsContact O-N 3.12Å
233	F	88.3	Confident	89.4	Confident	9 Å²	9	45.8 Å²	45.8	4%	0.039	23%	0.229	C	C	.	.	S	Bend	trans	-93	153.2	-179.8	-79.3	-108.9	0	0	0	111.2	G171 V174 Q175 Y200 E204 L207 V229 L230 G235 Y236	G171-F233 WeakPolarHBondContact O-CZ 3.01Å; V174-F233 HydrophobicContact CG1-CE1 4.27Å; V174-F233 HydrophobicContact CG1-CZ 3.92Å; Q175-F233 HydrophobicContact CB-CD2 4.5Å; Q175-F233 HydrophobicContact CB-CE2 3.77Å; Q175-F233 HydrophobicContact CB-CZ 3.88Å; Q175-F233 HydrophobicContact CG-CD2 4.32Å; Q175-F233 HydrophobicContact CG-CE2 4.07Å; Q175-F233 HydrophobicContact CG-CZ 4.49Å; Y200-F233 HydrophobicContact CD2-CD1 4.24Å; Y200-F233 AromaticContact CD2-CE1 3.75Å; Y200-F233 HydrophobicContact CD2-CE1 3.75Å; Y200-F233 HydrophobicContact CD2-CZ 4.47Å; Y200-F233 AromaticContact CE1-CD1 3.93Å; Y200-F233 HydrophobicContact CE1-CD1 3.93Å; Y200-F233 HydrophobicContact CE1-CE1 4.31Å; Y200-F233 AromaticContact CE2-CD1 3.51Å; Y200-F233 HydrophobicContact CE2-CD1 3.51Å; Y200-F233 AromaticContact CE2-CE1 3.41Å; Y200-F233 HydrophobicContact CE2-CE1 3.41Å; Y200-F233 VanDerWaalsContact CE2-CE1 3.41Å; Y200-F233 HydrophobicContact CE2-CG 4.31Å; Y200-F233 HydrophobicContact CE2-CZ 4.15Å; Y200-F233 HydrophobicContact CG-CE1 4.33Å; Y200-F233 AromaticContact CZ-CD1 3.32Å; Y200-F233 AromaticContact CZ-CE1 3.73Å; Y200-F233 WeakPolarHBondContact OH-CA 3.24Å; Y200-F233 WeakPolarHBondContact OH-CD1 3.49Å; E204-F233 HydrophobicContact CB-CD1 3.76Å; E204-F233 HydrophobicContact CB-CE1 4.04Å; E204-F233 HydrophobicContact CG-CB 4.45Å; E204-F233 HydrophobicContact CG-CD1 3.82Å; E204-F233 HydrophobicContact CG-CG 4.49Å; E204-F233 WeakPolarHBondContact OE1-CB 3.26Å; L207-F233 HydrophobicContact CD1-CE2 4.42Å; L207-F233 HydrophobicContact CD1-CZ 4.33Å; V229-F233 HydrophobicContact CG1-CE2 3.9Å; V229-F233 WeakPolarHBondContact O-CD2 3.34Å; L230-F233 HydrophobicContact CD2-CB 4.41Å; L230-F233 HydrophobicContact CD2-CG 4.42Å; L230-F233 WeakPolarHBondContact O-CB 3.27Å; L230-F233 PolarHBondContact O-N 2.92Å; F233-G235 VanDerWaalsContact C-N 3.26Å; F233-G235 PolarHBondContact O-N 3.46Å; F233-Y236 PolarHBondContact O-N 3.28Å
234	K	84.7	Confident	89.3	Confident	199 Å²	199	45.9 Å²	45.9	87%	0.865	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.4	-31.5	178.1	-67.6	-178.8	-178.4	174.5	0	111.6	Y200 Y236	Y200-K234 PolarHBondContact OH-N 2.65Å; K234-Y236 VanDerWaalsContact C-N 3.28Å; K234-Y236 PolarHBondContact O-N 3.08Å
235	G	81.1	Confident	89.1	Confident	4 Å²	4	45.6 Å²	45.6	4%	0.041	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.5	7.4	179	0	0	0	0	0	115.6	E204 F233 G237 Q238 C239	E204-G235 WeakPolarHBondContact OE1-CA 3.43Å; E204-G235 PolarHBondContact OE1-N 3.36Å; F233-G235 VanDerWaalsContact C-N 3.26Å; F233-G235 PolarHBondContact O-N 3.46Å; G235-G237 PolarHBondContact O-N 3Å; G235-G237 VanDerWaalsContact O-N 3.1Å; G235-Q238 WeakPolarHBondContact O-CA 2.96Å; G235-Q238 WeakPolarHBondContact O-CB 3.44Å; G235-Q238 PolarHBondContact O-N 2.9Å; G235-C239 PolarHBondContact O-N 3.38Å
236	Y	88.8	Confident	88.9	Confident	23 Å²	23	42.2 Å²	42.2	9%	0.09	22%	0.217	C	C	.	.	H	α-helix	trans	-52.6	-35.8	176.9	-174.9	-122.7	0	0	0	113	L230 F233 K234 Q238 C239 I240 F276 P277	L230-Y236 HydrophobicContact CB-CD2 4.19Å; L230-Y236 WeakPolarHBondContact O-CB 3.01Å; F233-Y236 PolarHBondContact O-N 3.28Å; K234-Y236 VanDerWaalsContact C-N 3.28Å; K234-Y236 PolarHBondContact O-N 3.08Å; Y236-Q238 VanDerWaalsContact C-N 3.3Å; Y236-Q238 PolarHBondContact O-N 2.79Å; Y236-C239 WeakPolarHBondContact O-CB 3.08Å; Y236-C239 PolarHBondContact O-N 3.19Å; Y236-I240 HydrophobicContact CD1-CD1 3.94Å; Y236-I240 HydrophobicContact CE1-CD1 3.6Å; Y236-I240 HydrophobicContact CE1-CG1 4.28Å; Y236-I240 PolarHBondContact O-N 2.9Å; Y236-I240 VanDerWaalsContact O-N 3.12Å; Y236-F276 HydrophobicContact CE2-CD1 4.37Å; Y236-F276 WeakPolarHBondContact OH-CD1 3.41Å; Y236-P277 WeakPolarHBondContact OH-CD 3.41Å
237	G	89	Confident	88.6	Confident	29 Å²	29	42.6 Å²	42.6	30%	0.299	22%	0.22	S	C	.	.	H	α-helix	trans	-59.2	-38.2	174.5	0	0	0	0	0	113.5	G235 I240 D241	G235-G237 PolarHBondContact O-N 3Å; G235-G237 VanDerWaalsContact O-N 3.1Å; G237-I240 PolarHBondContact O-N 3.38Å; G237-D241 PolarHBondContact O-N 3.43Å; G237-D241 VanDerWaalsContact O-OD2 3.09Å
238	Q	90.6	Very high	88.1	Confident	122 Å²	122	44 Å²	44	57%	0.57	23%	0.226	S	C	*	.	H	α-helix	trans	-70	-34	177.5	-58.7	179.7	21.2	0	0	111.7	I208 G235 Y236 D241 A242	I208-Q238 HydrophobicContact CD1-CB 4.07Å; G235-Q238 WeakPolarHBondContact O-CA 2.96Å; G235-Q238 WeakPolarHBondContact O-CB 3.44Å; G235-Q238 PolarHBondContact O-N 2.9Å; Y236-Q238 VanDerWaalsContact C-N 3.3Å; Y236-Q238 PolarHBondContact O-N 2.79Å; Q238-D241 PolarHBondContact O-N 3.22Å; Q238-A242 VanDerWaalsContact O-CB 3.31Å; Q238-A242 WeakPolarHBondContact O-CB 3.44Å; Q238-A242 PolarHBondContact O-N 2.94Å
239	C	91.2	Very high	87.3	Confident	0 Å²	0	47.5 Å²	47.5	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-62.4	-43	171.5	178	0	0	0	0	111.5	I208 L230 G235 Y236 F243	I208-C239 HydrophobicContact CG1-CB 4.33Å; L230-C239 HydrophobicContact CD1-CB 3.93Å; G235-C239 PolarHBondContact O-N 3.38Å; Y236-C239 WeakPolarHBondContact O-CB 3.08Å; Y236-C239 PolarHBondContact O-N 3.19Å; C239-F243 PolarHBondContact O-N 3.48Å
240	I	92	Very high	86.1	Confident	4 Å²	4	55.1 Å²	55.1	2%	0.021	27%	0.27	C	S	.	.	H	α-helix	trans	-63.9	-43.3	174.5	-62.2	171.7	0	0	0	110.7	Y236 G237 F243 I244 F276 V282 K285	Y236-I240 HydrophobicContact CD1-CD1 3.94Å; Y236-I240 HydrophobicContact CE1-CD1 3.6Å; Y236-I240 HydrophobicContact CE1-CG1 4.28Å; Y236-I240 PolarHBondContact O-N 2.9Å; Y236-I240 VanDerWaalsContact O-N 3.12Å; G237-I240 PolarHBondContact O-N 3.38Å; I240-F243 WeakPolarHBondContact O-CB 3.31Å; I240-F243 PolarHBondContact O-N 3.36Å; I240-I244 HydrophobicContact CG2-CD1 3.86Å; I240-I244 HydrophobicContact CG2-CG1 4.4Å; I240-I244 VanDerWaalsContact O-CG1 3.31Å; I240-I244 WeakPolarHBondContact O-CG1 3.35Å; I240-I244 PolarHBondContact O-N 3.25Å; I240-F276 HydrophobicContact CG1-CE1 4.34Å; I240-V282 HydrophobicContact CD1-CG2 4Å; I240-V282 HydrophobicContact CG1-CG2 4.06Å; I240-V282 HydrophobicContact CG2-CG1 4.22Å; I240-V282 HydrophobicContact CG2-CG2 4.31Å; I240-K285 HydrophobicContact CG2-CD 3.89Å
241	D	91.1	Very high	84.7	Confident	62 Å²	62	57 Å²	57	33%	0.332	28%	0.281	S	S	.	.	H	α-helix	trans	-63.7	-45.2	178.1	-71	-33.6	0	0	0	111.7	G237 Q238 F243 I244 D245 K285	G237-D241 PolarHBondContact O-N 3.43Å; G237-D241 VanDerWaalsContact O-OD2 3.09Å; Q238-D241 PolarHBondContact O-N 3.22Å; D241-F243 VanDerWaalsContact C-N 3.28Å; D241-F243 PolarHBondContact O-N 3.11Å; D241-I244 PolarHBondContact O-N 3.05Å; D241-I244 VanDerWaalsContact O-N 3.1Å; D241-D245 WeakPolarHBondContact O-CB 3.12Å; D241-D245 PolarHBondContact O-N 3.12Å; D241-K285 WeakPolarHBondContact OD1-CE 3.19Å; D241-K285 IonicContact OD1-NZ 2.76Å; D241-K285 PolarHBondContact OD1-NZ 3.06Å; D241-K285 IonicContact OD2-NZ 2.84Å; D241-K285 PolarHBondContact OD2-NZ 2.98Å
242	A	88.9	Confident	83.6	Confident	20 Å²	20	57.4 Å²	57.4	17%	0.165	28%	0.276	C	S	.	.	H	α-helix	trans	-59	-38.6	173.1	0	0	0	0	0	111.9	I208 V212 Q238 Q246	I208-A242 HydrophobicContact CG2-CB 4.44Å; V212-A242 HydrophobicContact CG2-CB 3.94Å; Q238-A242 VanDerWaalsContact O-CB 3.31Å; Q238-A242 WeakPolarHBondContact O-CB 3.44Å; Q238-A242 PolarHBondContact O-N 2.94Å; A242-Q246 WeakPolarHBondContact O-CB 3.16Å; A242-Q246 WeakPolarHBondContact O-CG 3.32Å; A242-Q246 PolarHBondContact O-N 3.24Å; A242-Q246 VanDerWaalsContact O-N 3.08Å
243	F	91.5	Very high	82.6	Confident	1 Å²	1	64.9 Å²	64.9	0%	0.004	30%	0.3	C	S	.	.	H	α-helix	trans	-62.2	-47.7	173	177	-101.1	0	0	0	111.9	F211 H215 M223 C239 I240 D241 Q246 C247 I271 I272 F276 V282	F211-F243 HydrophobicContact CE1-CB 4Å; F211-F243 HydrophobicContact CE1-CD2 4.13Å; F211-F243 HydrophobicContact CZ-CD2 4.23Å; H215-F243 AromaticContact CE1-CD2 3.94Å; H215-F243 AromaticContact CE1-CE2 3.98Å; H215-F243 AromaticContact NE2-CE2 3.83Å; M223-F243 HydrophobicContact CE-CD2 4.29Å; M223-F243 HydrophobicContact CE-CE2 4.32Å; C239-F243 PolarHBondContact O-N 3.48Å; I240-F243 WeakPolarHBondContact O-CB 3.31Å; I240-F243 PolarHBondContact O-N 3.36Å; D241-F243 VanDerWaalsContact C-N 3.28Å; D241-F243 PolarHBondContact O-N 3.11Å; F243-Q246 PolarHBondContact O-N 3.31Å; F243-C247 VanDerWaalsContact CE1-SG 3.58Å; F243-C247 WeakPolarHBondContact CZ-SG 3.48Å; F243-C247 PolarHBondContact O-N 2.96Å; F243-C247 PolarHBondContact O-SG 3.12Å; F243-I271 HydrophobicContact CE2-CG2 4.23Å; F243-I271 HydrophobicContact CZ-CG2 4.33Å; F243-I272 HydrophobicContact CE1-CD1 4Å; F243-I272 HydrophobicContact CE1-CG1 3.67Å; F243-I272 HydrophobicContact CZ-CG1 3.88Å; F243-F276 HydrophobicContact CB-CZ 3.93Å; F243-F276 AromaticContact CD1-CE2 3.89Å; F243-F276 HydrophobicContact CD1-CE2 3.89Å; F243-F276 HydrophobicContact CD1-CZ 4.09Å; F243-F276 HydrophobicContact CD2-CE2 4Å; F243-F276 HydrophobicContact CD2-CZ 4.07Å; F243-F276 HydrophobicContact CE1-CE2 4.05Å; F243-F276 HydrophobicContact CE2-CE2 4.15Å; F243-F276 AromaticContact CG-CE2 3.87Å; F243-F276 HydrophobicContact CG-CE2 3.87Å; F243-F276 AromaticContact CG-CZ 3.75Å; F243-F276 HydrophobicContact CG-CZ 3.75Å; F243-F276 HydrophobicContact CZ-CE2 4.18Å; F243-V282 HydrophobicContact CD1-CG1 4.05Å; F243-V282 HydrophobicContact CE1-CG1 4.17Å
244	I	90.6	Very high	81.5	Confident	3 Å²	3	67.3 Å²	67.3	2%	0.015	32%	0.318	C	S	.	.	H	α-helix	trans	-62.3	-45.9	179.8	-66.4	166.9	0	0	0	110.7	I240 D241 Q246 C247 Q248 K285 L286	I240-I244 HydrophobicContact CG2-CD1 3.86Å; I240-I244 HydrophobicContact CG2-CG1 4.4Å; I240-I244 VanDerWaalsContact O-CG1 3.31Å; I240-I244 WeakPolarHBondContact O-CG1 3.35Å; I240-I244 PolarHBondContact O-N 3.25Å; D241-I244 PolarHBondContact O-N 3.05Å; D241-I244 VanDerWaalsContact O-N 3.1Å; I244-Q246 VanDerWaalsContact C-N 3.3Å; I244-Q246 PolarHBondContact O-N 3.25Å; I244-C247 WeakPolarHBondContact O-CB 3.39Å; I244-C247 PolarHBondContact O-N 3.08Å; I244-C247 VanDerWaalsContact O-N 3.14Å; I244-Q248 WeakPolarHBondContact O-CG 3.36Å; I244-Q248 PolarHBondContact O-N 2.76Å; I244-K285 HydrophobicContact CD1-CB 3.96Å; I244-K285 HydrophobicContact CD1-CD 3.98Å; I244-K285 HydrophobicContact CD1-CG 3.76Å; I244-L286 HydrophobicContact CB-CD1 4.33Å; I244-L286 HydrophobicContact CG1-CB 4.25Å; I244-L286 HydrophobicContact CG1-CD1 4.1Å; I244-L286 HydrophobicContact CG2-CD1 3.89Å
245	D	87.4	Confident	80.7	Confident	103 Å²	103	65.6 Å²	65.6	55%	0.551	32%	0.319	S	S	*	.	H	α-helix	trans	-59	-43.7	177.9	-72.4	-16	0	0	0	111.2	D241 Q248 W249	D241-D245 WeakPolarHBondContact O-CB 3.12Å; D241-D245 PolarHBondContact O-N 3.12Å; D245-Q248 PolarHBondContact O-N 3.02Å; D245-W249 PolarHBondContact O-N 3.3Å; D245-W249 VanDerWaalsContact O-N 3.13Å
246	Q	85.7	Confident	80.5	Confident	41 Å²	41	69.1 Å²	69.1	19%	0.192	34%	0.337	C	S	.	.	H	α-helix	trans	-67.1	-36.3	176.8	-68.6	-64.5	-11.7	0	0	112.7	V212 H215 H216 A242 F243 I244 Q248 W249	V212-Q246 HydrophobicContact CG1-CG 4.2Å; H215-Q246 WeakPolarHBondContact ND1-CB 3.44Å; H216-Q246 PolarHBondContact CE1-OE1 3.39Å; H216-Q246 PolarHBondContact NE2-NE2 3.32Å; H216-Q246 PolarHBondContact NE2-OE1 3.5Å; A242-Q246 WeakPolarHBondContact O-CB 3.16Å; A242-Q246 WeakPolarHBondContact O-CG 3.32Å; A242-Q246 PolarHBondContact O-N 3.24Å; A242-Q246 VanDerWaalsContact O-N 3.08Å; F243-Q246 PolarHBondContact O-N 3.31Å; I244-Q246 VanDerWaalsContact C-N 3.3Å; I244-Q246 PolarHBondContact O-N 3.25Å; Q246-Q248 VanDerWaalsContact C-N 3.31Å; Q246-Q248 PolarHBondContact O-N 3.16Å; Q246-W249 VanDerWaalsContact OE1-CE3 3.27Å
247	C	84.7	Confident	80.4	Confident	11 Å²	11	69.6 Å²	69.6	7%	0.074	34%	0.34	C	S	.	.	H	α-helix	trans	-63.6	-37.6	173.3	-71.7	0	0	0	0	111.9	F243 I244 T251 L264 L286	F243-C247 VanDerWaalsContact CE1-SG 3.58Å; F243-C247 WeakPolarHBondContact CZ-SG 3.48Å; F243-C247 PolarHBondContact O-N 2.96Å; F243-C247 PolarHBondContact O-SG 3.12Å; I244-C247 WeakPolarHBondContact O-CB 3.39Å; I244-C247 PolarHBondContact O-N 3.08Å; I244-C247 VanDerWaalsContact O-N 3.14Å; C247-T251 PolarHBondContact O-OG1 3.05Å; C247-L264 VanDerWaalsContact O-CD1 3.26Å; C247-L264 WeakPolarHBondContact O-CD1 3.4Å; C247-L286 HydrophobicContact CB-CD1 4.44Å
248	Q	81.1	Confident	80.3	Confident	30 Å²	30	69.4 Å²	69.4	14%	0.14	33%	0.331	C	S	.	.	H	α-helix	trans	-85.4	-14.8	-174.6	-69	-177.5	1.9	0	0	114.6	I244 D245 Q246 Q250 S289	I244-Q248 WeakPolarHBondContact O-CG 3.36Å; I244-Q248 PolarHBondContact O-N 2.76Å; D245-Q248 PolarHBondContact O-N 3.02Å; Q246-Q248 VanDerWaalsContact C-N 3.31Å; Q246-Q248 PolarHBondContact O-N 3.16Å; Q248-Q250 VanDerWaalsContact C-N 3.26Å; Q248-Q250 PolarHBondContact O-N 2.71Å; Q248-Q250 VanDerWaalsContact O-N 3.13Å; Q248-S289 PolarHBondContact NE2-OG 2.9Å
249	W	73.5	Confident	80.1	Confident	187 Å²	187	67.3 Å²	67.3	71%	0.708	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-28.6	-170.6	-161.5	-14.1	0	0	0	113.7	D245 Q246	D245-W249 PolarHBondContact O-N 3.3Å; D245-W249 VanDerWaalsContact O-N 3.13Å; Q246-W249 VanDerWaalsContact OE1-CE3 3.27Å
250	Q	62	Low	79.8	Confident	175 Å²	175	68.9 Å²	68.9	82%	0.818	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118.7	6.3	-168.7	-69.9	-170.7	-7.7	0	0	117.1	Q248	Q248-Q250 VanDerWaalsContact C-N 3.26Å; Q248-Q250 PolarHBondContact O-N 2.71Å; Q248-Q250 VanDerWaalsContact O-N 3.13Å
251	T	62.7	Low	79.7	Confident	39 Å²	39	68.7 Å²	68.7	24%	0.239	33%	0.33	C	S	.	.			trans	-113.7	12.7	-153.4	-31.1	0	0	0	0	117.9	C247 E260 L264	C247-T251 PolarHBondContact O-OG1 3.05Å; T251-E260 VanDerWaalsContact O-CD 3.29Å; T251-L264 HydrophobicContact CG2-CB 4.13Å; T251-L264 HydrophobicContact CG2-CD1 3.64Å; T251-L264 HydrophobicContact CG2-CG 4.48Å; T251-L264 VanDerWaalsContact OG1-CD1 3.3Å; T251-L264 WeakPolarHBondContact OG1-CD1 3.31Å
252	Y	65	Low	79.6	Confident	55 Å²	55	67.5 Å²	67.5	22%	0.216	32%	0.321	C	S	.	.			trans	-128.3	76.3	-177.3	-52.9	-68.5	0	0	0	113.5	E260 I261 K294	Y252-E260 WeakPolarHBondContact CA-OE2 3.38Å; Y252-I261 HydrophobicContact CE1-CG1 3.87Å; Y252-K294 HydrophobicContact CD2-CD 4.44Å; Y252-K294 HydrophobicContact CD2-CG 4.39Å; Y252-K294 HydrophobicContact CE2-CD 4.29Å; Y252-K294 HydrophobicContact CE2-CG 3.81Å
253	R	65.4	Low	79.5	Confident	246 Å²	246	71.3 Å²	71.3	93%	0.928	34%	0.338	S	S	*	.			trans	-124.9	-12.9	179.4	-73.6	-171.9	179.1	179.7	1.1	114.1	E260	R253-E260 PolarHBondContact N-OE1 2.85Å; R253-E260 PolarHBondContact N-OE2 3.41Å
254	S	63.9	Low	79.4	Confident	59 Å²	59	71.7 Å²	71.7	41%	0.413	34%	0.34	S	S	.	.	S	Bend	trans	-91.3	160.8	179.8	84.1	0	0	0	0	112.6	D256 E260	S254-D256 PolarHBondContact O-N 2.76Å; S254-D256 PolarHBondContact OG-N 2.79Å; S254-E260 WeakPolarHBondContact CA-OE1 3.47Å; S254-E260 WeakPolarHBondContact CB-OE1 3.41Å; S254-E260 PolarHBondContact N-OE1 3.46Å; S254-E260 VanDerWaalsContact OG-CG 3.3Å; S254-E260 WeakPolarHBondContact OG-CG 3.12Å; S254-E260 PolarHBondContact OG-OE1 3.48Å; S254-E260 PolarHBondContact OG-OE2 3Å
255	D	67.6	Low	79.4	Confident	164 Å²	164	71.5 Å²	71.5	88%	0.877	34%	0.339	S	S	*	.	S	Bend	trans	-69	-18.8	176.3	-154.8	29.6	0	0	0	112.4
256	D	78.4	Confident	79.5	Confident	78 Å²	78	72.6 Å²	72.6	42%	0.417	34%	0.339	S	S	.	.			trans	-105.2	71.8	179.9	-169.3	5.6	0	0	0	112.1	S254 F258 N259 E260	S254-D256 PolarHBondContact O-N 2.76Å; S254-D256 PolarHBondContact OG-N 2.79Å; D256-F258 PolarHBondContact O-N 2.82Å; D256-N259 HydrophobicContact CB-CB 4.34Å; D256-N259 PolarHBondContact O-N 3.01Å; D256-N259 PolarHBondContact OD1-N 2.65Å; D256-N259 WeakPolarHBondContact OD2-CB 3.22Å; D256-E260 PolarHBondContact O-N 2.8Å
257	M	85.2	Confident	79.6	Confident	32 Å²	32	77.6 Å²	77.6	16%	0.158	36%	0.36	C	S	.	.	H	α-helix	trans	-52.8	-35.9	177.4	179.3	-178.2	-65	0	0	113.1	N259 E260 I261 L295 E298	M257-N259 VanDerWaalsContact C-N 3.35Å; M257-N259 PolarHBondContact O-N 2.74Å; M257-E260 PolarHBondContact O-N 3.26Å; M257-I261 HydrophobicContact CG-CD1 3.74Å; M257-I261 HydrophobicContact CG-CG1 4.24Å; M257-I261 VanDerWaalsContact O-CG1 3.23Å; M257-I261 WeakPolarHBondContact O-CG1 3.25Å; M257-I261 PolarHBondContact O-N 3.47Å; M257-I261 HydrophobicContact SD-CD1 4.3Å; M257-L295 HydrophobicContact SD-CD1 4.45Å; M257-E298 HydrophobicContact CE-CB 3.51Å; M257-E298 HydrophobicContact CE-CG 3.4Å; M257-E298 VanDerWaalsContact CE-CG 3.4Å; M257-E298 HydrophobicContact SD-CB 3.55Å; M257-E298 VanDerWaalsContact SD-CB 3.55Å; M257-E298 HydrophobicContact SD-CG 3.7Å
258	F	87.3	Confident	79.9	Confident	26 Å²	26	77.5 Å²	77.5	11%	0.114	36%	0.359	C	S	.	.	H	α-helix	trans	-65.1	-40.7	-177.1	-69.9	-87.1	0	0	0	111.6	D256 W262 L295 L319 K322 T323 L326	D256-F258 PolarHBondContact O-N 2.82Å; F258-W262 PolarHBondContact O-N 3.27Å; F258-W262 VanDerWaalsContact O-N 3.08Å; F258-L295 HydrophobicContact CD1-CD1 4.39Å; F258-L295 HydrophobicContact CE1-CD1 3.76Å; F258-L295 HydrophobicContact CZ-CD1 4.02Å; F258-L319 HydrophobicContact CE2-CD2 4.23Å; F258-L319 HydrophobicContact CZ-CD2 4.15Å; F258-K322 HydrophobicContact CD1-CB 4.04Å; F258-K322 HydrophobicContact CD2-CB 4.11Å; F258-K322 HydrophobicContact CD2-CD 4.17Å; F258-K322 HydrophobicContact CE1-CB 3.75Å; F258-K322 HydrophobicContact CE2-CB 3.82Å; F258-K322 HydrophobicContact CE2-CD 3.89Å; F258-K322 HydrophobicContact CE2-CG 4.45Å; F258-K322 HydrophobicContact CG-CB 4.22Å; F258-K322 HydrophobicContact CZ-CB 3.64Å; F258-K322 HydrophobicContact CZ-CD 4.46Å; F258-T323 WeakPolarHBondContact CE1-OG1 3.47Å; F258-L326 HydrophobicContact CD1-CB 4.3Å; F258-L326 HydrophobicContact CD1-CD2 3.99Å
259	N	86.6	Confident	80.4	Confident	77 Å²	77	76.7 Å²	76.7	41%	0.412	36%	0.355	S	S	.	.	H	α-helix	trans	-73.6	-37.2	178.4	-163.9	6.7	0	0	0	111.8	D256 M257 W262 L263	D256-N259 HydrophobicContact CB-CB 4.34Å; D256-N259 PolarHBondContact O-N 3.01Å; D256-N259 PolarHBondContact OD1-N 2.65Å; D256-N259 WeakPolarHBondContact OD2-CB 3.22Å; M257-N259 VanDerWaalsContact C-N 3.35Å; M257-N259 PolarHBondContact O-N 2.74Å; N259-W262 PolarHBondContact O-N 3.18Å; N259-L263 WeakPolarHBondContact O-CB 3.38Å; N259-L263 VanDerWaalsContact O-CG 3.3Å; N259-L263 WeakPolarHBondContact O-CG 3.46Å; N259-L263 PolarHBondContact O-N 3.37Å
260	E	86.1	Confident	81.1	Confident	34 Å²	34	70.7 Å²	70.7	16%	0.159	35%	0.345	C	S	.	.	H	α-helix	trans	-60.3	-44.4	171.4	-78.1	-178.4	156.6	0	0	112.2	T251 Y252 R253 S254 D256 M257 W262 L263 L264	T251-E260 VanDerWaalsContact O-CD 3.29Å; Y252-E260 WeakPolarHBondContact CA-OE2 3.38Å; R253-E260 PolarHBondContact N-OE1 2.85Å; R253-E260 PolarHBondContact N-OE2 3.41Å; S254-E260 WeakPolarHBondContact CA-OE1 3.47Å; S254-E260 WeakPolarHBondContact CB-OE1 3.41Å; S254-E260 PolarHBondContact N-OE1 3.46Å; S254-E260 VanDerWaalsContact OG-CG 3.3Å; S254-E260 WeakPolarHBondContact OG-CG 3.12Å; S254-E260 PolarHBondContact OG-OE1 3.48Å; S254-E260 PolarHBondContact OG-OE2 3Å; D256-E260 PolarHBondContact O-N 2.8Å; M257-E260 PolarHBondContact O-N 3.26Å; E260-W262 VanDerWaalsContact C-N 3.33Å; E260-W262 PolarHBondContact O-N 2.66Å; E260-L263 PolarHBondContact O-N 3.04Å; E260-L264 VanDerWaalsContact O-CB 3.32Å; E260-L264 WeakPolarHBondContact O-CB 3.26Å; E260-L264 PolarHBondContact O-N 3.03Å
261	I	88.8	Confident	82.4	Confident	0 Å²	0	63.1 Å²	63.1	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-59.5	-45.2	175.3	-70.4	167.7	0	0	0	110.7	Y252 M257 L264 L265 I290 L295 L326	Y252-I261 HydrophobicContact CE1-CG1 3.87Å; M257-I261 HydrophobicContact CG-CD1 3.74Å; M257-I261 HydrophobicContact CG-CG1 4.24Å; M257-I261 VanDerWaalsContact O-CG1 3.23Å; M257-I261 WeakPolarHBondContact O-CG1 3.25Å; M257-I261 PolarHBondContact O-N 3.47Å; M257-I261 HydrophobicContact SD-CD1 4.3Å; I261-L264 PolarHBondContact O-N 3.19Å; I261-L265 HydrophobicContact CG2-CD1 3.74Å; I261-L265 WeakPolarHBondContact O-CB 3.32Å; I261-L265 WeakPolarHBondContact O-CG 3.35Å; I261-L265 PolarHBondContact O-N 2.98Å; I261-I290 HydrophobicContact CB-CG2 4.41Å; I261-I290 HydrophobicContact CD1-CG2 3.9Å; I261-I290 HydrophobicContact CG1-CG2 3.83Å; I261-I290 HydrophobicContact CG2-CG2 3.72Å; I261-L295 HydrophobicContact CD1-CB 4.33Å; I261-L295 HydrophobicContact CD1-CD1 4.2Å; I261-L326 HydrophobicContact CB-CD2 4.32Å; I261-L326 HydrophobicContact CG2-CD1 4.42Å; I261-L326 HydrophobicContact CG2-CD2 3.85Å
262	W	88.8	Confident	83.8	Confident	37 Å²	37	61.2 Å²	61.2	14%	0.14	30%	0.299	C	S	.	.	H	α-helix	trans	-60.8	-48.4	177.4	169.4	-116.2	0	0	0	112.3	F258 N259 E260 L264 L265 K266 L326 Q329 L330 T332 L333	F258-W262 PolarHBondContact O-N 3.27Å; F258-W262 VanDerWaalsContact O-N 3.08Å; N259-W262 PolarHBondContact O-N 3.18Å; E260-W262 VanDerWaalsContact C-N 3.33Å; E260-W262 PolarHBondContact O-N 2.66Å; W262-L264 VanDerWaalsContact C-N 3.34Å; W262-L264 PolarHBondContact O-N 3.24Å; W262-L265 PolarHBondContact O-N 3.13Å; W262-K266 HydrophobicContact CZ2-CD 4.19Å; W262-K266 WeakPolarHBondContact O-CB 3.47Å; W262-K266 PolarHBondContact O-N 3.08Å; W262-L326 HydrophobicContact CB-CD1 3.85Å; W262-Q329 HydrophobicContact CD2-CB 4.24Å; W262-Q329 HydrophobicContact CE3-CB 3.83Å; W262-Q329 HydrophobicContact CH2-CB 4.16Å; W262-Q329 WeakPolarHBondContact CH2-O 3.48Å; W262-Q329 HydrophobicContact CZ2-CB 4.5Å; W262-Q329 VanDerWaalsContact CZ3-C 3.41Å; W262-Q329 HydrophobicContact CZ3-CB 3.8Å; W262-Q329 WeakPolarHBondContact CZ3-O 3.49Å; W262-L330 HydrophobicContact CE3-CD2 4.06Å; W262-L330 HydrophobicContact CZ3-CD2 4.25Å; W262-T332 WeakPolarHBondContact CH2-OG1 3.44Å; W262-L333 HydrophobicContact CH2-CD2 3.91Å; W262-L333 HydrophobicContact CH2-CG 4.24Å; W262-L333 HydrophobicContact CZ3-CD1 4.19Å; W262-L333 HydrophobicContact CZ3-CD2 4.01Å; W262-L333 HydrophobicContact CZ3-CG 3.97Å
263	L	87.7	Confident	84.9	Confident	99 Å²	99	62 Å²	62	52%	0.518	31%	0.312	S	S	.	.	H	α-helix	trans	-62.8	-40.3	179.4	-71.8	169.7	0	0	0	112	N259 E260 K267	N259-L263 WeakPolarHBondContact O-CB 3.38Å; N259-L263 VanDerWaalsContact O-CG 3.3Å; N259-L263 WeakPolarHBondContact O-CG 3.46Å; N259-L263 PolarHBondContact O-N 3.37Å; E260-L263 PolarHBondContact O-N 3.04Å; L263-K267 WeakPolarHBondContact O-CB 3.44Å; L263-K267 PolarHBondContact O-N 2.89Å
264	L	88.7	Confident	86.1	Confident	9 Å²	9	53.9 Å²	53.9	5%	0.047	29%	0.285	C	S	.	.	H	α-helix	trans	-59	-51.4	174.2	179.9	97.2	0	0	0	111	C247 T251 E260 I261 W262 K267 N268 I290	C247-L264 VanDerWaalsContact O-CD1 3.26Å; C247-L264 WeakPolarHBondContact O-CD1 3.4Å; T251-L264 HydrophobicContact CG2-CB 4.13Å; T251-L264 HydrophobicContact CG2-CD1 3.64Å; T251-L264 HydrophobicContact CG2-CG 4.48Å; T251-L264 VanDerWaalsContact OG1-CD1 3.3Å; T251-L264 WeakPolarHBondContact OG1-CD1 3.31Å; E260-L264 VanDerWaalsContact O-CB 3.32Å; E260-L264 WeakPolarHBondContact O-CB 3.26Å; E260-L264 PolarHBondContact O-N 3.03Å; I261-L264 PolarHBondContact O-N 3.19Å; W262-L264 VanDerWaalsContact C-N 3.34Å; W262-L264 PolarHBondContact O-N 3.24Å; L264-K267 PolarHBondContact O-N 3.35Å; L264-N268 PolarHBondContact O-N 3.34Å; L264-N268 PolarHBondContact O-ND2 3.17Å; L264-N268 VanDerWaalsContact O-ND2 3.08Å; L264-I290 HydrophobicContact CD2-CD1 3.42Å; L264-I290 VanDerWaalsContact CD2-CD1 3.42Å; L264-I290 HydrophobicContact CD2-CG1 4.26Å
265	L	90.6	Very high	87.4	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-65.9	-41.6	-177.4	-74.1	167.1	0	0	0	111.7	I261 W262 K267 N268 D269 M283 L286 I287 I290 L330 L333	I261-L265 HydrophobicContact CG2-CD1 3.74Å; I261-L265 WeakPolarHBondContact O-CB 3.32Å; I261-L265 WeakPolarHBondContact O-CG 3.35Å; I261-L265 PolarHBondContact O-N 2.98Å; W262-L265 PolarHBondContact O-N 3.13Å; L265-K267 PolarHBondContact O-N 2.9Å; L265-N268 PolarHBondContact O-N 3.26Å; L265-D269 WeakPolarHBondContact O-CB 3.2Å; L265-D269 PolarHBondContact O-N 2.9Å; L265-M283 HydrophobicContact CD2-SD 4.02Å; L265-L286 HydrophobicContact CD2-CD2 3.82Å; L265-L286 HydrophobicContact CD2-CG 3.96Å; L265-I287 HydrophobicContact CD1-CG1 4.24Å; L265-I287 HydrophobicContact CD2-CG1 3.66Å; L265-I290 HydrophobicContact CD1-CD1 4.19Å; L265-I290 HydrophobicContact CD2-CD1 3.72Å; L265-I290 HydrophobicContact CG-CD1 3.95Å; L265-L330 HydrophobicContact CB-CD2 4.18Å; L265-L330 HydrophobicContact CD1-CD1 4.35Å; L265-L330 HydrophobicContact CD1-CD2 3.33Å; L265-L330 HydrophobicContact CD1-CG 4.47Å; L265-L330 HydrophobicContact CG-CD2 4.34Å; L265-L333 HydrophobicContact CB-CD1 4.05Å
266	K	90	Very high	88.6	Confident	125 Å²	125	43.8 Å²	43.8	54%	0.543	23%	0.226	S	C	.	.	H	α-helix	trans	-62.1	-42.1	175.5	-172.8	179.6	-178.8	179.9	0	112.7	W262 L333	W262-K266 HydrophobicContact CZ2-CD 4.19Å; W262-K266 WeakPolarHBondContact O-CB 3.47Å; W262-K266 PolarHBondContact O-N 3.08Å; K266-L333 HydrophobicContact CB-CD2 4.31Å; K266-L333 HydrophobicContact CG-CD2 4.44Å
267	K	88.4	Confident	89	Confident	147 Å²	147	42.8 Å²	42.8	64%	0.639	22%	0.224	S	C	*	.	H	α-helix	trans	-63.6	-45.8	177.1	-180	-175.4	173.8	-171.9	0	111.2	L263 L264 L265	L263-K267 WeakPolarHBondContact O-CB 3.44Å; L263-K267 PolarHBondContact O-N 2.89Å; L264-K267 PolarHBondContact O-N 3.35Å; L265-K267 PolarHBondContact O-N 2.9Å
268	N	90.3	Very high	89.1	Confident	8 Å²	8	45.6 Å²	45.6	4%	0.043	24%	0.24	C	C	.	.	H	α-helix	trans	-78.8	-20.6	-175.1	-69	-42.1	0	0	0	113.3	L264 L265 A270 I271 I272 L286	L264-N268 PolarHBondContact O-N 3.34Å; L264-N268 PolarHBondContact O-ND2 3.17Å; L264-N268 VanDerWaalsContact O-ND2 3.08Å; L265-N268 PolarHBondContact O-N 3.26Å; N268-A270 VanDerWaalsContact C-N 3.32Å; N268-A270 PolarHBondContact O-N 2.86Å; N268-I271 PolarHBondContact O-N 3.48Å; N268-I271 VanDerWaalsContact O-N 3.16Å; N268-I272 HydrophobicContact CB-CD1 4.2Å; N268-I272 WeakPolarHBondContact O-CB 3.3Å; N268-I272 WeakPolarHBondContact O-CD1 3.39Å; N268-I272 WeakPolarHBondContact O-CG1 3.47Å; N268-I272 PolarHBondContact O-N 2.61Å; N268-L286 HydrophobicContact CB-CD2 4.12Å
269	D	90.7	Very high	89.2	Confident	13 Å²	13	45.8 Å²	45.8	7%	0.07	24%	0.243	C	C	.	.	H	α-helix	trans	-55.6	-44.6	174.4	-171.7	52	0	0	0	112.5	L265 S273 M283 L333 N334 N335	L265-D269 WeakPolarHBondContact O-CB 3.2Å; L265-D269 PolarHBondContact O-N 2.9Å; D269-S273 WeakPolarHBondContact O-CB 3.17Å; D269-S273 PolarHBondContact O-N 3.07Å; D269-S273 VanDerWaalsContact O-N 3.16Å; D269-M283 HydrophobicContact CB-CE 3.63Å; D269-M283 WeakPolarHBondContact OD1-CE 3.31Å; D269-L333 HydrophobicContact CB-CD2 4.25Å; D269-N334 PolarHBondContact OD2-N 2.97Å; D269-N335 PolarHBondContact O-ND2 3.39Å; D269-N335 VanDerWaalsContact OD1-CB 3.3Å; D269-N335 WeakPolarHBondContact OD1-CB 3.47Å; D269-N335 PolarHBondContact OD1-N 3.4Å; D269-N335 PolarHBondContact OD1-ND2 3.15Å
270	A	88.2	Confident	89.3	Confident	61 Å²	61	47.7 Å²	47.7	50%	0.504	25%	0.25	S	C	.	.	H	α-helix	trans	-67.4	-39.7	176.9	0	0	0	0	0	112.6	N268 E274	N268-A270 VanDerWaalsContact C-N 3.32Å; N268-A270 PolarHBondContact O-N 2.86Å; A270-E274 PolarHBondContact O-N 3.04Å
271	I	89.6	Confident	89.5	Confident	16 Å²	16	50.9 Å²	50.9	8%	0.082	27%	0.265	C	S	.	.	H	α-helix	trans	-69.1	-45.3	-179.5	-59.5	174.7	0	0	0	110.1	F243 N268 S273 E274 V275	F243-I271 HydrophobicContact CE2-CG2 4.23Å; F243-I271 HydrophobicContact CZ-CG2 4.33Å; N268-I271 PolarHBondContact O-N 3.48Å; N268-I271 VanDerWaalsContact O-N 3.16Å; I271-S273 VanDerWaalsContact C-N 3.31Å; I271-S273 PolarHBondContact O-N 2.83Å; I271-E274 PolarHBondContact O-N 3.27Å; I271-E274 VanDerWaalsContact O-N 3.13Å; I271-V275 HydrophobicContact CG2-CG2 4.1Å; I271-V275 WeakPolarHBondContact O-CB 3.1Å; I271-V275 WeakPolarHBondContact O-CG2 3.43Å; I271-V275 PolarHBondContact O-N 2.95Å
272	I	92.4	Very high	89.6	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-61	-42.8	-179.4	-71.3	164.3	0	0	0	110.6	F243 N268 E274 F276 P279 V282 M283 L286	F243-I272 HydrophobicContact CE1-CD1 4Å; F243-I272 HydrophobicContact CE1-CG1 3.67Å; F243-I272 HydrophobicContact CZ-CG1 3.88Å; N268-I272 HydrophobicContact CB-CD1 4.2Å; N268-I272 WeakPolarHBondContact O-CB 3.3Å; N268-I272 WeakPolarHBondContact O-CD1 3.39Å; N268-I272 WeakPolarHBondContact O-CG1 3.47Å; N268-I272 PolarHBondContact O-N 2.61Å; I272-E274 PolarHBondContact O-N 3.4Å; I272-F276 HydrophobicContact CG1-CD2 4.49Å; I272-F276 HydrophobicContact CG2-CD2 4.38Å; I272-F276 PolarHBondContact O-N 3.06Å; I272-F276 VanDerWaalsContact O-N 3.16Å; I272-P279 HydrophobicContact CG2-CB 3.67Å; I272-P279 VanDerWaalsContact CG2-O 3.29Å; I272-P279 WeakPolarHBondContact CG2-O 3.46Å; I272-V282 HydrophobicContact CD1-CG1 4.04Å; I272-V282 HydrophobicContact CG1-CG1 3.94Å; I272-V282 HydrophobicContact CG2-CB 3.92Å; I272-V282 HydrophobicContact CG2-CG1 4.1Å; I272-M283 HydrophobicContact CD1-CE 3.69Å; I272-M283 HydrophobicContact CD1-SD 4.28Å; I272-L286 HydrophobicContact CD1-CD2 3.95Å
273	S	89.4	Confident	89.8	Confident	71 Å²	71	49.1 Å²	49.1	50%	0.497	26%	0.258	S	S	.	.	H	α-helix	trans	-62.8	-28.6	177.2	-169.6	0	0	0	0	113.8	D269 I271	D269-S273 WeakPolarHBondContact O-CB 3.17Å; D269-S273 PolarHBondContact O-N 3.07Å; D269-S273 VanDerWaalsContact O-N 3.16Å; I271-S273 VanDerWaalsContact C-N 3.31Å; I271-S273 PolarHBondContact O-N 2.83Å
274	E	89.7	Confident	89.8	Confident	75 Å²	75	45.8 Å²	45.8	35%	0.35	24%	0.243	S	C	.	.	H	α-helix	trans	-89.6	-35.6	-175.4	-166.4	-179.9	161.9	0	0	112	K220 K224 A270 I271 I272	K220-E274 VanDerWaalsContact CD-CD 3.47Å; K220-E274 WeakPolarHBondContact CD-OE1 3.26Å; K220-E274 WeakPolarHBondContact CD-OE2 3.3Å; K220-E274 IonicContact NZ-OE2 2.63Å; K220-E274 PolarHBondContact NZ-OE2 3.22Å; K224-E274 VanDerWaalsContact CD-O 3.3Å; K224-E274 WeakPolarHBondContact CD-O 3.22Å; A270-E274 PolarHBondContact O-N 3.04Å; I271-E274 PolarHBondContact O-N 3.27Å; I271-E274 VanDerWaalsContact O-N 3.13Å; I272-E274 PolarHBondContact O-N 3.4Å
275	V	91.5	Very high	89.9	Confident	3 Å²	3	48.9 Å²	48.9	2%	0.018	26%	0.256	C	S	.	.	H	α-helix	trans	-93.4	-44.6	-170	173.4	0	0	0	0	113.4	F211 K220 M223 A227 I271	F211-V275 HydrophobicContact CE2-CG1 3.84Å; F211-V275 HydrophobicContact CZ-CG1 4.14Å; K220-V275 HydrophobicContact CB-CG2 4.47Å; M223-V275 HydrophobicContact CB-CG1 3.77Å; M223-V275 HydrophobicContact CB-CG2 4.12Å; M223-V275 HydrophobicContact CE-CG1 4.32Å; M223-V275 HydrophobicContact CE-CG2 4.46Å; M223-V275 HydrophobicContact SD-CG2 4.49Å; A227-V275 HydrophobicContact CB-CG1 4.2Å; I271-V275 HydrophobicContact CG2-CG2 4.1Å; I271-V275 WeakPolarHBondContact O-CB 3.1Å; I271-V275 WeakPolarHBondContact O-CG2 3.43Å; I271-V275 PolarHBondContact O-N 2.95Å
276	F	92.2	Very high	89.9	Confident	9 Å²	9	48.9 Å²	48.9	4%	0.039	26%	0.256	C	S	.	.			trans	-98.5	143.1	-168.1	-68	-81.3	0	0	0	112.9	F211 A227 Y236 I240 F243 I272 N278 V282	F211-F276 HydrophobicContact CE1-CZ 4.28Å; F211-F276 HydrophobicContact CE2-CE1 4.43Å; F211-F276 HydrophobicContact CE2-CZ 4.34Å; F211-F276 HydrophobicContact CZ-CE1 4.02Å; F211-F276 HydrophobicContact CZ-CE2 4.32Å; F211-F276 AromaticContact CZ-CZ 3.55Å; F211-F276 HydrophobicContact CZ-CZ 3.55Å; A227-F276 HydrophobicContact CB-CD1 4.12Å; A227-F276 HydrophobicContact CB-CE1 4.34Å; Y236-F276 HydrophobicContact CE2-CD1 4.37Å; Y236-F276 WeakPolarHBondContact OH-CD1 3.41Å; I240-F276 HydrophobicContact CG1-CE1 4.34Å; F243-F276 HydrophobicContact CB-CZ 3.93Å; F243-F276 AromaticContact CD1-CE2 3.89Å; F243-F276 HydrophobicContact CD1-CE2 3.89Å; F243-F276 HydrophobicContact CD1-CZ 4.09Å; F243-F276 HydrophobicContact CD2-CE2 4Å; F243-F276 HydrophobicContact CD2-CZ 4.07Å; F243-F276 HydrophobicContact CE1-CE2 4.05Å; F243-F276 HydrophobicContact CE2-CE2 4.15Å; F243-F276 AromaticContact CG-CE2 3.87Å; F243-F276 HydrophobicContact CG-CE2 3.87Å; F243-F276 AromaticContact CG-CZ 3.75Å; F243-F276 HydrophobicContact CG-CZ 3.75Å; F243-F276 HydrophobicContact CZ-CE2 4.18Å; I272-F276 HydrophobicContact CG1-CD2 4.49Å; I272-F276 HydrophobicContact CG2-CD2 4.38Å; I272-F276 PolarHBondContact O-N 3.06Å; I272-F276 VanDerWaalsContact O-N 3.16Å; F276-N278 VanDerWaalsContact C-N 3.34Å; F276-N278 PolarHBondContact O-N 3.36Å; F276-V282 HydrophobicContact CB-CG2 4.01Å; F276-V282 HydrophobicContact CD1-CG2 3.95Å; F276-V282 HydrophobicContact CD2-CB 4.42Å; F276-V282 HydrophobicContact CD2-CG1 4.06Å; F276-V282 HydrophobicContact CD2-CG2 4.05Å; F276-V282 HydrophobicContact CE1-CG2 4.39Å; F276-V282 HydrophobicContact CE2-CG1 3.97Å; F276-V282 HydrophobicContact CE2-CG2 4.49Å; F276-V282 HydrophobicContact CG-CG2 3.75Å; F276-V282 HydrophobicContact CZ-CG1 4.42Å
277	P	87.2	Confident	90	Very high	56 Å²	56	42.9 Å²	42.9	36%	0.364	23%	0.23	S	C	.	.	S	Bend	trans	-65.2	-33.4	175.9	23.3	-32.5	0	0	0	113.4	Y236 P279	Y236-P277 WeakPolarHBondContact OH-CD 3.41Å; P277-P279 WeakPolarHBondContact O-CD 3.49Å
278	N	87.7	Confident	90.1	Very high	92 Å²	92	39.1 Å²	39.1	49%	0.492	22%	0.216	S	C	.	.	S	Bend	trans	-119.5	76.5	-179.9	-67.8	-23	0	0	0	111	F276 Q280 Q281 V282	F276-N278 VanDerWaalsContact C-N 3.34Å; F276-N278 PolarHBondContact O-N 3.36Å; N278-Q280 VanDerWaalsContact C-N 3.35Å; N278-Q280 PolarHBondContact O-N 3.37Å; N278-Q281 HydrophobicContact CB-CB 4.22Å; N278-Q281 PolarHBondContact O-N 3.23Å; N278-V282 PolarHBondContact O-N 3.38Å
279	P	89.6	Confident	90.1	Very high	30 Å²	30	40.8 Å²	40.8	20%	0.195	23%	0.229	C	C	.	.	H	α-helix	trans	-64.2	-34.5	-169.7	25	-35.1	0	0	0	113.9	I272 P277 Q281 V282 M283 N335	I272-P279 HydrophobicContact CG2-CB 3.67Å; I272-P279 VanDerWaalsContact CG2-O 3.29Å; I272-P279 WeakPolarHBondContact CG2-O 3.46Å; P277-P279 WeakPolarHBondContact O-CD 3.49Å; P279-Q281 VanDerWaalsContact C-N 3.35Å; P279-Q281 PolarHBondContact O-N 2.95Å; P279-V282 PolarHBondContact O-N 3.4Å; P279-M283 WeakPolarHBondContact O-CB 3.22Å; P279-M283 PolarHBondContact O-N 2.88Å; P279-N335 HydrophobicContact CB-CB 4.45Å
280	Q	88.8	Confident	90	Very high	117 Å²	117	40.1 Å²	40.1	55%	0.547	23%	0.225	S	C	.	.	H	α-helix	trans	-64.2	-36.7	178	-69.2	179.3	-12.9	0	0	112.8	N278 M283 S284	N278-Q280 VanDerWaalsContact C-N 3.35Å; N278-Q280 PolarHBondContact O-N 3.37Å; Q280-M283 PolarHBondContact O-N 2.74Å; Q280-S284 WeakPolarHBondContact O-CB 3Å; Q280-S284 PolarHBondContact O-N 3.33Å; Q280-S284 PolarHBondContact O-OG 2.99Å
281	Q	89.8	Confident	90.1	Very high	100 Å²	100	37.2 Å²	37.2	47%	0.467	20%	0.201	S	C	.	.	H	α-helix	trans	-64.4	-45.9	177.5	-174.9	-176.7	10.5	0	0	110.6	N278 P279 S284 K285	N278-Q281 HydrophobicContact CB-CB 4.22Å; N278-Q281 PolarHBondContact O-N 3.23Å; P279-Q281 VanDerWaalsContact C-N 3.35Å; P279-Q281 PolarHBondContact O-N 2.95Å; Q281-S284 PolarHBondContact O-N 3.49Å; Q281-S284 PolarHBondContact O-OG 3.1Å; Q281-K285 PolarHBondContact O-N 2.93Å; Q281-K285 VanDerWaalsContact O-N 3.12Å
282	V	91.4	Very high	90	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-65.5	-44.7	178.1	-179.8	0	0	0	0	111	I240 F243 I272 F276 N278 P279 K285 L286	I240-V282 HydrophobicContact CD1-CG2 4Å; I240-V282 HydrophobicContact CG1-CG2 4.06Å; I240-V282 HydrophobicContact CG2-CG1 4.22Å; I240-V282 HydrophobicContact CG2-CG2 4.31Å; F243-V282 HydrophobicContact CD1-CG1 4.05Å; F243-V282 HydrophobicContact CE1-CG1 4.17Å; I272-V282 HydrophobicContact CD1-CG1 4.04Å; I272-V282 HydrophobicContact CG1-CG1 3.94Å; I272-V282 HydrophobicContact CG2-CB 3.92Å; I272-V282 HydrophobicContact CG2-CG1 4.1Å; F276-V282 HydrophobicContact CB-CG2 4.01Å; F276-V282 HydrophobicContact CD1-CG2 3.95Å; F276-V282 HydrophobicContact CD2-CB 4.42Å; F276-V282 HydrophobicContact CD2-CG1 4.06Å; F276-V282 HydrophobicContact CD2-CG2 4.05Å; F276-V282 HydrophobicContact CE1-CG2 4.39Å; F276-V282 HydrophobicContact CE2-CG1 3.97Å; F276-V282 HydrophobicContact CE2-CG2 4.49Å; F276-V282 HydrophobicContact CG-CG2 3.75Å; F276-V282 HydrophobicContact CZ-CG1 4.42Å; N278-V282 PolarHBondContact O-N 3.38Å; P279-V282 PolarHBondContact O-N 3.4Å; V282-K285 PolarHBondContact O-N 2.89Å; V282-L286 WeakPolarHBondContact O-CB 3.31Å; V282-L286 PolarHBondContact O-N 2.88Å
283	M	91	Very high	89.7	Confident	0 Å²	0	39 Å²	39	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-62.5	-44.7	177.8	-175.9	56.7	77.8	0	0	111.9	L265 D269 I272 P279 Q280 K285 L286 I287 N335	L265-M283 HydrophobicContact CD2-SD 4.02Å; D269-M283 HydrophobicContact CB-CE 3.63Å; D269-M283 WeakPolarHBondContact OD1-CE 3.31Å; I272-M283 HydrophobicContact CD1-CE 3.69Å; I272-M283 HydrophobicContact CD1-SD 4.28Å; P279-M283 WeakPolarHBondContact O-CB 3.22Å; P279-M283 PolarHBondContact O-N 2.88Å; Q280-M283 PolarHBondContact O-N 2.74Å; M283-K285 PolarHBondContact O-N 3.31Å; M283-L286 PolarHBondContact O-N 3.42Å; M283-L286 HydrophobicContact SD-CD2 4.45Å; M283-I287 HydrophobicContact CG-CD1 3.8Å; M283-I287 HydrophobicContact CG-CG1 4.36Å; M283-I287 VanDerWaalsContact O-CG1 3.27Å; M283-I287 WeakPolarHBondContact O-CG1 3.49Å; M283-I287 PolarHBondContact O-N 3.41Å; M283-I287 HydrophobicContact SD-CD1 3.93Å; M283-I287 HydrophobicContact SD-CG1 3.99Å; M283-N335 HydrophobicContact CB-CB 4.09Å; M283-N335 HydrophobicContact CG-CB 4.27Å
284	S	89.7	Confident	89.5	Confident	29 Å²	29	40 Å²	40	20%	0.203	22%	0.219	C	C	.	.	H	α-helix	trans	-61	-43	177.3	69.2	0	0	0	0	112.4	Q280 Q281 I287 L288	Q280-S284 WeakPolarHBondContact O-CB 3Å; Q280-S284 PolarHBondContact O-N 3.33Å; Q280-S284 PolarHBondContact O-OG 2.99Å; Q281-S284 PolarHBondContact O-N 3.49Å; Q281-S284 PolarHBondContact O-OG 3.1Å; S284-I287 PolarHBondContact O-N 3.07Å; S284-L288 WeakPolarHBondContact O-CB 3.35Å; S284-L288 VanDerWaalsContact O-CG 3.29Å; S284-L288 WeakPolarHBondContact O-CG 3.25Å; S284-L288 PolarHBondContact O-N 3.46Å
285	K	90.6	Very high	89.4	Confident	74 Å²	74	36.5 Å²	36.5	32%	0.322	20%	0.202	S	C	.	.	H	α-helix	trans	-67	-39	177.3	-161.3	179.2	-172.4	-169.7	0	111.8	I240 D241 I244 Q281 V282 M283 S289	I240-K285 HydrophobicContact CG2-CD 3.89Å; D241-K285 WeakPolarHBondContact OD1-CE 3.19Å; D241-K285 IonicContact OD1-NZ 2.76Å; D241-K285 PolarHBondContact OD1-NZ 3.06Å; D241-K285 IonicContact OD2-NZ 2.84Å; D241-K285 PolarHBondContact OD2-NZ 2.98Å; I244-K285 HydrophobicContact CD1-CB 3.96Å; I244-K285 HydrophobicContact CD1-CD 3.98Å; I244-K285 HydrophobicContact CD1-CG 3.76Å; Q281-K285 PolarHBondContact O-N 2.93Å; Q281-K285 VanDerWaalsContact O-N 3.12Å; V282-K285 PolarHBondContact O-N 2.89Å; M283-K285 PolarHBondContact O-N 3.31Å; K285-S289 VanDerWaalsContact O-CB 3.32Å; K285-S289 WeakPolarHBondContact O-CB 3.19Å; K285-S289 PolarHBondContact O-N 3.47Å
286	L	90.8	Very high	89.4	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-62.5	-49.5	174.5	178.3	63.3	0	0	0	111.6	I244 C247 L265 N268 I272 V282 M283 S289 I290	I244-L286 HydrophobicContact CB-CD1 4.33Å; I244-L286 HydrophobicContact CG1-CB 4.25Å; I244-L286 HydrophobicContact CG1-CD1 4.1Å; I244-L286 HydrophobicContact CG2-CD1 3.89Å; C247-L286 HydrophobicContact CB-CD1 4.44Å; L265-L286 HydrophobicContact CD2-CD2 3.82Å; L265-L286 HydrophobicContact CD2-CG 3.96Å; N268-L286 HydrophobicContact CB-CD2 4.12Å; I272-L286 HydrophobicContact CD1-CD2 3.95Å; V282-L286 WeakPolarHBondContact O-CB 3.31Å; V282-L286 PolarHBondContact O-N 2.88Å; M283-L286 PolarHBondContact O-N 3.42Å; M283-L286 HydrophobicContact SD-CD2 4.45Å; L286-S289 PolarHBondContact O-N 3.45Å; L286-I290 HydrophobicContact CD1-CD1 3.99Å; L286-I290 HydrophobicContact CD1-CG1 4.47Å; L286-I290 HydrophobicContact CG-CD1 3.99Å; L286-I290 WeakPolarHBondContact O-CD1 3.36Å; L286-I290 VanDerWaalsContact O-CG1 3.31Å; L286-I290 WeakPolarHBondContact O-CG1 3.5Å; L286-I290 PolarHBondContact O-N 3.19Å
287	I	91.7	Very high	89.2	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-63.3	-45.4	179.5	-61.6	167.3	0	0	0	110.2	L265 M283 S284 S289 I290 F291 L330 F341 L345	L265-I287 HydrophobicContact CD1-CG1 4.24Å; L265-I287 HydrophobicContact CD2-CG1 3.66Å; M283-I287 HydrophobicContact CG-CD1 3.8Å; M283-I287 HydrophobicContact CG-CG1 4.36Å; M283-I287 VanDerWaalsContact O-CG1 3.27Å; M283-I287 WeakPolarHBondContact O-CG1 3.49Å; M283-I287 PolarHBondContact O-N 3.41Å; M283-I287 HydrophobicContact SD-CD1 3.93Å; M283-I287 HydrophobicContact SD-CG1 3.99Å; S284-I287 PolarHBondContact O-N 3.07Å; I287-S289 VanDerWaalsContact C-N 3.32Å; I287-S289 PolarHBondContact O-N 3.19Å; I287-I290 PolarHBondContact O-N 2.97Å; I287-F291 HydrophobicContact CG2-CD2 3.64Å; I287-F291 HydrophobicContact CG2-CE2 3.76Å; I287-F291 HydrophobicContact CG2-CG 4.48Å; I287-F291 WeakPolarHBondContact O-CB 3.46Å; I287-F291 WeakPolarHBondContact O-CD2 3.43Å; I287-F291 PolarHBondContact O-N 3.43Å; I287-L330 HydrophobicContact CG2-CD1 4.08Å; I287-F341 HydrophobicContact CB-CE1 4.18Å; I287-F341 HydrophobicContact CB-CZ 4.25Å; I287-F341 HydrophobicContact CD1-CE1 4.12Å; I287-F341 HydrophobicContact CG2-CE1 3.95Å; I287-F341 HydrophobicContact CG2-CZ 4.28Å; I287-L345 HydrophobicContact CG2-CD1 3.92Å; I287-L345 HydrophobicContact CG2-CD2 3.51Å; I287-L345 HydrophobicContact CG2-CG 4.37Å
288	L	90.4	Very high	89.1	Confident	67 Å²	67	45 Å²	45	35%	0.351	24%	0.236	S	C	.	.	H	α-helix	trans	-61.6	-38.4	177.3	-74.5	171.9	0	0	0	112.5	S284 G292 F341 V344 L345	S284-L288 WeakPolarHBondContact O-CB 3.35Å; S284-L288 VanDerWaalsContact O-CG 3.29Å; S284-L288 WeakPolarHBondContact O-CG 3.25Å; S284-L288 PolarHBondContact O-N 3.46Å; L288-G292 WeakPolarHBondContact O-CA 3.2Å; L288-G292 PolarHBondContact O-N 2.93Å; L288-F341 HydrophobicContact CD1-CE2 4.12Å; L288-F341 HydrophobicContact CD2-CE2 3.95Å; L288-F341 HydrophobicContact CD2-CZ 4.18Å; L288-F341 HydrophobicContact CG-CE2 3.88Å; L288-F341 HydrophobicContact CG-CZ 3.92Å; L288-V344 HydrophobicContact CD2-CG1 4.33Å; L288-L345 HydrophobicContact CD2-CD2 4.23Å
289	S	89	Confident	89.2	Confident	43 Å²	43	40.7 Å²	40.7	30%	0.301	21%	0.213	S	C	.	.	H	α-helix	trans	-63.8	-41.1	175.2	177.3	0	0	0	0	111.9	Q248 K285 L286 I287 G293	Q248-S289 PolarHBondContact NE2-OG 2.9Å; K285-S289 VanDerWaalsContact O-CB 3.32Å; K285-S289 WeakPolarHBondContact O-CB 3.19Å; K285-S289 PolarHBondContact O-N 3.47Å; L286-S289 PolarHBondContact O-N 3.45Å; I287-S289 VanDerWaalsContact C-N 3.32Å; I287-S289 PolarHBondContact O-N 3.19Å; S289-G293 WeakPolarHBondContact O-CA 3.42Å; S289-G293 PolarHBondContact O-N 3.18Å
290	I	90.1	Very high	89.2	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	21%	0.214	C	C	.	.	I	π-helix	trans	-69.6	-45.9	177.9	-64	161	0	0	0	111.4	I261 L264 L265 L286 I287 K294 L295	I261-I290 HydrophobicContact CB-CG2 4.41Å; I261-I290 HydrophobicContact CD1-CG2 3.9Å; I261-I290 HydrophobicContact CG1-CG2 3.83Å; I261-I290 HydrophobicContact CG2-CG2 3.72Å; L264-I290 HydrophobicContact CD2-CD1 3.42Å; L264-I290 VanDerWaalsContact CD2-CD1 3.42Å; L264-I290 HydrophobicContact CD2-CG1 4.26Å; L265-I290 HydrophobicContact CD1-CD1 4.19Å; L265-I290 HydrophobicContact CD2-CD1 3.72Å; L265-I290 HydrophobicContact CG-CD1 3.95Å; L286-I290 HydrophobicContact CD1-CD1 3.99Å; L286-I290 HydrophobicContact CD1-CG1 4.47Å; L286-I290 HydrophobicContact CG-CD1 3.99Å; L286-I290 WeakPolarHBondContact O-CD1 3.36Å; L286-I290 VanDerWaalsContact O-CG1 3.31Å; L286-I290 WeakPolarHBondContact O-CG1 3.5Å; L286-I290 PolarHBondContact O-N 3.19Å; I287-I290 PolarHBondContact O-N 2.97Å; I290-K294 PolarHBondContact O-N 3.49Å; I290-L295 PolarHBondContact O-N 3.41Å
291	F	90.6	Very high	89.1	Confident	0 Å²	0	42 Å²	42	0%	0	22%	0.215	C	C	.	.	I	π-helix	trans	-70.3	-46.6	-178.3	-86.1	-113.9	0	0	0	111.8	I287 L295 R296 T323 L326 V327 L330 L345 V349	I287-F291 HydrophobicContact CG2-CD2 3.64Å; I287-F291 HydrophobicContact CG2-CE2 3.76Å; I287-F291 HydrophobicContact CG2-CG 4.48Å; I287-F291 WeakPolarHBondContact O-CB 3.46Å; I287-F291 WeakPolarHBondContact O-CD2 3.43Å; I287-F291 PolarHBondContact O-N 3.43Å; F291-L295 HydrophobicContact CD1-CD2 3.79Å; F291-L295 HydrophobicContact CE1-CD2 3.85Å; F291-L295 HydrophobicContact CG-CD2 4.14Å; F291-L295 HydrophobicContact CZ-CD2 4.24Å; F291-R296 WeakPolarHBondContact O-CB 3.14Å; F291-R296 PolarHBondContact O-N 3.3Å; F291-T323 HydrophobicContact CE1-CG2 3.96Å; F291-L326 HydrophobicContact CE2-CD2 4.33Å; F291-L326 HydrophobicContact CZ-CD2 3.98Å; F291-L326 HydrophobicContact CZ-CG 4.33Å; F291-V327 HydrophobicContact CE1-CG2 3.72Å; F291-V327 HydrophobicContact CZ-CG2 3.93Å; F291-L330 HydrophobicContact CE2-CD1 3.54Å; F291-L330 HydrophobicContact CZ-CD1 3.53Å; F291-L345 HydrophobicContact CB-CD2 4.19Å; F291-L345 HydrophobicContact CD1-CB 3.87Å; F291-L345 HydrophobicContact CD1-CD2 4Å; F291-L345 HydrophobicContact CD1-CG 4.4Å; F291-L345 HydrophobicContact CD2-CD2 4.18Å; F291-L345 HydrophobicContact CE1-CB 3.94Å; F291-L345 HydrophobicContact CE1-CD1 4.35Å; F291-L345 HydrophobicContact CE1-CD2 4.46Å; F291-L345 HydrophobicContact CE1-CG 4.49Å; F291-L345 HydrophobicContact CG-CD2 3.86Å; F291-L345 HydrophobicContact CZ-CD1 4.33Å; F291-V349 HydrophobicContact CB-CG2 4.27Å; F291-V349 HydrophobicContact CD1-CG2 3.94Å
292	G	87.4	Confident	89	Confident	27 Å²	27	41.3 Å²	41.3	28%	0.278	21%	0.211	S	C	.	.	I	π-helix	trans	-78	-20.6	-178.1	0	0	0	0	0	114.9	L288	L288-G292 WeakPolarHBondContact O-CA 3.2Å; L288-G292 PolarHBondContact O-N 2.93Å
293	G	86	Confident	88.9	Confident	25 Å²	25	41.7 Å²	41.7	26%	0.258	21%	0.213	S	C	.	.	I	π-helix	trans	-100.2	-92.8	173.8	0	0	0	0	0	111.7	S289 L295 R296 D297	S289-G293 WeakPolarHBondContact O-CA 3.42Å; S289-G293 PolarHBondContact O-N 3.18Å; G293-L295 PolarHBondContact O-N 3.39Å; G293-R296 PolarHBondContact O-N 2.71Å; G293-D297 VanDerWaalsContact O-CG 3.25Å; G293-D297 PolarHBondContact O-N 3.35Å
294	K	84.1	Confident	88.6	Confident	93 Å²	93	46.3 Å²	46.3	40%	0.404	25%	0.245	S	C	.	.	I	π-helix	trans	-60	-46.1	-167.4	-62.7	-62.9	-178.1	-170.8	0	114.6	Y252 I290 D297 E298	Y252-K294 HydrophobicContact CD2-CD 4.44Å; Y252-K294 HydrophobicContact CD2-CG 4.39Å; Y252-K294 HydrophobicContact CE2-CD 4.29Å; Y252-K294 HydrophobicContact CE2-CG 3.81Å; I290-K294 PolarHBondContact O-N 3.49Å; K294-D297 PolarHBondContact O-N 3.41Å; K294-E298 PolarHBondContact O-N 3.25Å; K294-E298 VanDerWaalsContact O-N 3.07Å
295	L	88.5	Confident	88	Confident	1 Å²	1	48.9 Å²	48.9	1%	0.005	27%	0.268	C	S	.	.	I	π-helix	trans	-68.4	-41.8	-177.6	-176.9	61	0	0	0	111.2	M257 F258 I261 I290 F291 G293 E298 V299 T323 V349	M257-L295 HydrophobicContact SD-CD1 4.45Å; F258-L295 HydrophobicContact CD1-CD1 4.39Å; F258-L295 HydrophobicContact CE1-CD1 3.76Å; F258-L295 HydrophobicContact CZ-CD1 4.02Å; I261-L295 HydrophobicContact CD1-CB 4.33Å; I261-L295 HydrophobicContact CD1-CD1 4.2Å; I290-L295 PolarHBondContact O-N 3.41Å; F291-L295 HydrophobicContact CD1-CD2 3.79Å; F291-L295 HydrophobicContact CE1-CD2 3.85Å; F291-L295 HydrophobicContact CG-CD2 4.14Å; F291-L295 HydrophobicContact CZ-CD2 4.24Å; G293-L295 PolarHBondContact O-N 3.39Å; L295-E298 PolarHBondContact O-N 2.92Å; L295-V299 VanDerWaalsContact O-CG2 3.29Å; L295-V299 WeakPolarHBondContact O-CG2 3.49Å; L295-V299 PolarHBondContact O-N 2.89Å; L295-T323 HydrophobicContact CD2-CG2 4.04Å; L295-V349 HydrophobicContact CD2-CG2 4.13Å; L295-V349 HydrophobicContact CG-CG2 4.41Å
296	R	90.6	Very high	87.3	Confident	107 Å²	107	46.8 Å²	46.8	40%	0.404	26%	0.261	S	S	.	.	H	α-helix	trans	-61.5	-45.9	174.5	-178.1	-178.9	174.5	-178	1.4	111.8	F291 G293 E298 V299 D300	F291-R296 WeakPolarHBondContact O-CB 3.14Å; F291-R296 PolarHBondContact O-N 3.3Å; G293-R296 PolarHBondContact O-N 2.71Å; R296-E298 VanDerWaalsContact C-N 3.3Å; R296-E298 PolarHBondContact O-N 3.35Å; R296-V299 PolarHBondContact O-N 3.36Å; R296-D300 WeakPolarHBondContact O-CB 3.3Å; R296-D300 PolarHBondContact O-N 3.45Å
297	D	87.7	Confident	86.6	Confident	96 Å²	96	52 Å²	52	51%	0.513	31%	0.305	S	S	.	.	H	α-helix	trans	-60.4	-39.8	178.2	-70	-20	0	0	0	111.9	G293 K294 D300 K301	G293-D297 VanDerWaalsContact O-CG 3.25Å; G293-D297 PolarHBondContact O-N 3.35Å; K294-D297 PolarHBondContact O-N 3.41Å; D297-D300 PolarHBondContact O-N 3.17Å; D297-K301 VanDerWaalsContact O-CB 3.29Å; D297-K301 WeakPolarHBondContact O-CB 3.38Å; D297-K301 PolarHBondContact O-N 3.05Å
298	E	85.4	Confident	86.3	Confident	45 Å²	45	55.5 Å²	55.5	21%	0.21	32%	0.323	C	S	.	.	H	α-helix	trans	-69.7	-40.7	177.2	-171.9	62	-158	0	0	112.4	M257 K294 L295 R296 D300 K301 K302	M257-E298 HydrophobicContact CE-CB 3.51Å; M257-E298 HydrophobicContact CE-CG 3.4Å; M257-E298 VanDerWaalsContact CE-CG 3.4Å; M257-E298 HydrophobicContact SD-CB 3.55Å; M257-E298 VanDerWaalsContact SD-CB 3.55Å; M257-E298 HydrophobicContact SD-CG 3.7Å; K294-E298 PolarHBondContact O-N 3.25Å; K294-E298 VanDerWaalsContact O-N 3.07Å; L295-E298 PolarHBondContact O-N 2.92Å; R296-E298 VanDerWaalsContact C-N 3.3Å; R296-E298 PolarHBondContact O-N 3.35Å; E298-D300 VanDerWaalsContact C-N 3.34Å; E298-K301 PolarHBondContact O-N 3.36Å; E298-K302 WeakPolarHBondContact O-CB 3.25Å; E298-K302 PolarHBondContact O-N 3.49Å; E298-K302 WeakPolarHBondContact OE1-CE 3.39Å
299	V	89.7	Confident	86.3	Confident	1 Å²	1	55.2 Å²	55.2	1%	0.006	32%	0.321	C	S	.	.	H	α-helix	trans	-61.9	-44.6	173.4	169.9	0	0	0	0	110.1	L295 R296 K301 K302 L303 L319 V349 F350 Y353	L295-V299 VanDerWaalsContact O-CG2 3.29Å; L295-V299 WeakPolarHBondContact O-CG2 3.49Å; L295-V299 PolarHBondContact O-N 2.89Å; R296-V299 PolarHBondContact O-N 3.36Å; V299-K301 PolarHBondContact O-N 3.43Å; V299-K302 PolarHBondContact O-N 3.35Å; V299-L303 HydrophobicContact CG1-CD1 3.61Å; V299-L303 HydrophobicContact CG1-CG 4.24Å; V299-L303 VanDerWaalsContact O-CB 3.29Å; V299-L303 WeakPolarHBondContact O-CB 3.25Å; V299-L303 VanDerWaalsContact O-CG 3.29Å; V299-L303 WeakPolarHBondContact O-CG 3.26Å; V299-L303 PolarHBondContact O-N 3.38Å; V299-L319 HydrophobicContact CG1-CD1 4.41Å; V299-L319 HydrophobicContact CG2-CD1 4.4Å; V299-V349 HydrophobicContact CB-CG1 4.22Å; V299-V349 HydrophobicContact CG1-CG1 4.33Å; V299-V349 HydrophobicContact CG2-CG1 3.86Å; V299-F350 HydrophobicContact CG1-CD1 4.5Å; V299-F350 HydrophobicContact CG1-CE1 3.91Å; V299-F350 HydrophobicContact CG1-CZ 4.38Å; V299-F350 HydrophobicContact CG2-CZ 4.19Å; V299-Y353 HydrophobicContact CG1-CD2 4.39Å; V299-Y353 HydrophobicContact CG1-CE2 4Å
300	D	89.8	Confident	86.3	Confident	41 Å²	41	56.9 Å²	56.9	22%	0.219	32%	0.324	C	S	.	.	H	α-helix	trans	-62.3	-42.2	176.7	-76.4	1.1	0	0	0	111.2	R296 D297 E298 S304 Y353	R296-D300 WeakPolarHBondContact O-CB 3.3Å; R296-D300 PolarHBondContact O-N 3.45Å; D297-D300 PolarHBondContact O-N 3.17Å; E298-D300 VanDerWaalsContact C-N 3.34Å; D300-S304 WeakPolarHBondContact O-CB 3.39Å; D300-S304 PolarHBondContact O-N 3.5Å; D300-S304 PolarHBondContact O-OG 2.79Å; D300-Y353 VanDerWaalsContact CG-OH 3.32Å; D300-Y353 WeakPolarHBondContact OD1-CE2 3.23Å; D300-Y353 VanDerWaalsContact OD1-CZ 3.3Å; D300-Y353 PolarHBondContact OD1-OH 3.33Å
301	K	87.4	Confident	86.2	Confident	134 Å²	134	60.1 Å²	60.1	58%	0.583	34%	0.344	S	S	*	.	H	α-helix	trans	-63.8	-46.6	176	-176.8	-175.5	173.9	-167.4	0	112.2	D297 E298 V299 S304 A305	D297-K301 VanDerWaalsContact O-CB 3.29Å; D297-K301 WeakPolarHBondContact O-CB 3.38Å; D297-K301 PolarHBondContact O-N 3.05Å; E298-K301 PolarHBondContact O-N 3.36Å; V299-K301 PolarHBondContact O-N 3.43Å; K301-S304 PolarHBondContact O-OG 3.42Å; K301-A305 WeakPolarHBondContact O-CB 3.41Å; K301-A305 PolarHBondContact O-N 3.41Å
302	K	86.6	Confident	86.4	Confident	84 Å²	84	60.8 Å²	60.8	37%	0.365	35%	0.347	S	S	.	.	H	α-helix	trans	-68.8	-39.7	180	-75.4	-172.2	176.5	-175.9	0	112.4	E298 V299 L319	E298-K302 WeakPolarHBondContact O-CB 3.25Å; E298-K302 PolarHBondContact O-N 3.49Å; E298-K302 WeakPolarHBondContact OE1-CE 3.39Å; V299-K302 PolarHBondContact O-N 3.35Å; K302-L319 HydrophobicContact CB-CD1 3.99Å; K302-L319 HydrophobicContact CD-CD1 4.44Å; K302-L319 HydrophobicContact CD-CD2 4.01Å
303	L	89.3	Confident	86.6	Confident	8 Å²	8	59.5 Å²	59.5	4%	0.042	33%	0.333	C	S	.	.	H	α-helix	trans	-79.6	-23.6	-179.6	-67.3	-179.8	0	0	0	113.9	V299 T306 Y312 L316 L319 Y353	V299-L303 HydrophobicContact CG1-CD1 3.61Å; V299-L303 HydrophobicContact CG1-CG 4.24Å; V299-L303 VanDerWaalsContact O-CB 3.29Å; V299-L303 WeakPolarHBondContact O-CB 3.25Å; V299-L303 VanDerWaalsContact O-CG 3.29Å; V299-L303 WeakPolarHBondContact O-CG 3.26Å; V299-L303 PolarHBondContact O-N 3.38Å; L303-T306 PolarHBondContact O-OG1 3.09Å; L303-Y312 HydrophobicContact CB-CD2 4.43Å; L303-Y312 HydrophobicContact CB-CE2 4.03Å; L303-Y312 HydrophobicContact CD2-CD2 4.18Å; L303-Y312 HydrophobicContact CD2-CE2 4.1Å; L303-Y312 HydrophobicContact CG-CE2 4.49Å; L303-L316 HydrophobicContact CD1-CD1 3.87Å; L303-L316 HydrophobicContact CD2-CB 3.98Å; L303-L319 HydrophobicContact CD2-CD1 4.14Å; L303-L319 HydrophobicContact CG-CD1 4.11Å; L303-Y353 HydrophobicContact CB-CE1 4.41Å; L303-Y353 HydrophobicContact CD1-CD1 3.91Å; L303-Y353 HydrophobicContact CD1-CD2 3.84Å; L303-Y353 HydrophobicContact CD1-CE1 3.86Å; L303-Y353 HydrophobicContact CD1-CE2 3.81Å; L303-Y353 HydrophobicContact CD1-CG 3.9Å
304	S	85.1	Confident	86.9	Confident	97 Å²	97	61.7 Å²	61.7	68%	0.678	34%	0.342	S	S	*	.	H	α-helix	trans	-82.4	-25.2	173.4	58.8	0	0	0	0	113.3	D300 K301 T306	D300-S304 WeakPolarHBondContact O-CB 3.39Å; D300-S304 PolarHBondContact O-N 3.5Å; D300-S304 PolarHBondContact O-OG 2.79Å; K301-S304 PolarHBondContact O-OG 3.42Å; S304-T306 VanDerWaalsContact C-N 3.33Å
305	A	76.7	Confident	87.2	Confident	83 Å²	83	58.8 Å²	58.8	69%	0.686	33%	0.333	S	S	*	.	H	α-helix	trans	-75.2	-19.4	178	0	0	0	0	0	113.8	K301 A307	K301-A305 WeakPolarHBondContact O-CB 3.41Å; K301-A305 PolarHBondContact O-N 3.41Å; A305-A307 PolarHBondContact O-N 2.94Å
306	T	76.9	Confident	87.4	Confident	30 Å²	30	58.8 Å²	58.8	18%	0.184	33%	0.333	C	S	.	.			trans	-79.8	110.1	-179.6	48.4	0	0	0	0	111.3	L303 S304 T311	L303-T306 PolarHBondContact O-OG1 3.09Å; S304-T306 VanDerWaalsContact C-N 3.33Å; T306-T311 HydrophobicContact CG2-CG2 3.69Å
307	A	75.4	Confident	87.5	Confident	111 Å²	111	54.1 Å²	54.1	92%	0.917	32%	0.317	S	S	*	.			trans	-77.4	-30.2	176	0	0	0	0	0	113.2	A305	A305-A307 PolarHBondContact O-N 2.94Å
308	D	86.7	Confident	87.6	Confident	72 Å²	72	52.6 Å²	52.6	39%	0.385	31%	0.309	S	S	.	.	S	Bend	trans	-95.3	138.1	-177.6	166.1	47.7	0	0	0	111.6	E310 T311 Y312	D308-E310 PolarHBondContact OD1-N 3.44Å; D308-E310 WeakPolarHBondContact OD2-CB 3.47Å; D308-T311 PolarHBondContact O-N 3.03Å; D308-T311 PolarHBondContact OD2-N 3.33Å; D308-T311 VanDerWaalsContact OD2-N 3.13Å; D308-T311 PolarHBondContact OD2-OG1 3.36Å; D308-Y312 WeakPolarHBondContact O-CB 3.38Å; D308-Y312 PolarHBondContact O-N 3.47Å
309	M	89.2	Confident	87.9	Confident	62 Å²	62	50.7 Å²	50.7	31%	0.305	30%	0.3	S	S	.	.	H	α-helix	trans	-69.7	-33.2	-174.9	-71.8	-68.6	-73.7	0	0	112.5	Y312 L313 K360 Y364	M309-Y312 PolarHBondContact O-N 3.24Å; M309-L313 VanDerWaalsContact O-CG 3.31Å; M309-L313 WeakPolarHBondContact O-CG 3.45Å; M309-L313 PolarHBondContact O-N 3.27Å; M309-K360 HydrophobicContact CE-CB 3.65Å; M309-K360 HydrophobicContact CE-CD 4.13Å; M309-K360 HydrophobicContact CE-CG 3.87Å; M309-Y364 HydrophobicContact CB-CD2 3.99Å
310	E	88.2	Confident	88.1	Confident	78 Å²	78	52.4 Å²	52.4	36%	0.364	31%	0.307	S	S	.	.	H	α-helix	trans	-65.6	-49.1	175.2	-177.2	179.3	158.8	0	0	110.7	D308 Y312 L313 T314 Y364	D308-E310 PolarHBondContact OD1-N 3.44Å; D308-E310 WeakPolarHBondContact OD2-CB 3.47Å; E310-Y312 VanDerWaalsContact C-N 3.27Å; E310-Y312 PolarHBondContact O-N 2.89Å; E310-L313 PolarHBondContact O-N 3.24Å; E310-T314 WeakPolarHBondContact O-CB 3.38Å; E310-T314 PolarHBondContact O-N 2.87Å; E310-T314 PolarHBondContact O-OG1 3.34Å; E310-Y364 HydrophobicContact CB-CE2 3.65Å; E310-Y364 WeakPolarHBondContact CB-OH 3.41Å; E310-Y364 HydrophobicContact CG-CE2 4.39Å; E310-Y364 VanDerWaalsContact CG-OH 3.29Å; E310-Y364 WeakPolarHBondContact CG-OH 3.43Å; E310-Y364 PolarHBondContact OE2-OH 2.97Å
311	T	89.7	Confident	88.2	Confident	68 Å²	68	52.7 Å²	52.7	42%	0.417	31%	0.307	S	S	.	.	H	α-helix	trans	-60.6	-39.9	176.4	-51.8	0	0	0	0	110.9	T306 D308 S315	T306-T311 HydrophobicContact CG2-CG2 3.69Å; D308-T311 PolarHBondContact O-N 3.03Å; D308-T311 PolarHBondContact OD2-N 3.33Å; D308-T311 VanDerWaalsContact OD2-N 3.13Å; D308-T311 PolarHBondContact OD2-OG1 3.36Å; T311-S315 WeakPolarHBondContact O-CB 3.14Å; T311-S315 PolarHBondContact O-N 2.97Å; T311-S315 PolarHBondContact O-OG 3.29Å
312	Y	93.2	Very high	88.4	Confident	13 Å²	13	50.2 Å²	50.2	5%	0.051	30%	0.296	C	S	.	.	H	α-helix	trans	-60.3	-51.5	174.9	173.6	-93.7	0	0	0	112.4	L303 D308 M309 E310 T314 S315 L316 Y353 K360	L303-Y312 HydrophobicContact CB-CD2 4.43Å; L303-Y312 HydrophobicContact CB-CE2 4.03Å; L303-Y312 HydrophobicContact CD2-CD2 4.18Å; L303-Y312 HydrophobicContact CD2-CE2 4.1Å; L303-Y312 HydrophobicContact CG-CE2 4.49Å; D308-Y312 WeakPolarHBondContact O-CB 3.38Å; D308-Y312 PolarHBondContact O-N 3.47Å; M309-Y312 PolarHBondContact O-N 3.24Å; E310-Y312 VanDerWaalsContact C-N 3.27Å; E310-Y312 PolarHBondContact O-N 2.89Å; Y312-T314 PolarHBondContact O-N 3.49Å; Y312-S315 PolarHBondContact O-N 2.68Å; Y312-L316 HydrophobicContact CE1-CD2 4.4Å; Y312-L316 VanDerWaalsContact O-CB 3.32Å; Y312-L316 WeakPolarHBondContact O-CB 3.35Å; Y312-L316 PolarHBondContact O-N 2.96Å; Y312-Y353 WeakPolarHBondContact OH-CD1 3.27Å; Y312-K360 HydrophobicContact CD1-CD 4.18Å; Y312-K360 HydrophobicContact CE1-CD 3.46Å; Y312-K360 VanDerWaalsContact CE1-CD 3.46Å; Y312-K360 PolarHBondContact OH-NZ 3.44Å
313	L	92.6	Very high	88.6	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-65.4	-39.5	-178.6	-69.8	169.4	0	0	0	111.9	M309 E310 C317 Y357 K360 E361 Y364	M309-L313 VanDerWaalsContact O-CG 3.31Å; M309-L313 WeakPolarHBondContact O-CG 3.45Å; M309-L313 PolarHBondContact O-N 3.27Å; E310-L313 PolarHBondContact O-N 3.24Å; L313-C317 WeakPolarHBondContact O-CB 3.12Å; L313-C317 PolarHBondContact O-N 2.92Å; L313-Y357 HydrophobicContact CD2-CD2 4Å; L313-Y357 HydrophobicContact CD2-CE2 3.95Å; L313-K360 HydrophobicContact CD2-CB 4.48Å; L313-E361 HydrophobicContact CD2-CB 4.5Å; L313-Y364 HydrophobicContact CD1-CD1 3.87Å; L313-Y364 HydrophobicContact CD1-CG 3.99Å
314	T	91.3	Very high	88.7	Confident	71 Å²	71	51 Å²	51	44%	0.436	30%	0.299	S	S	.	.	H	α-helix	trans	-67.3	-44.3	177.1	-56	0	0	0	0	111.3	E310 Y312 C317 D318	E310-T314 WeakPolarHBondContact O-CB 3.38Å; E310-T314 PolarHBondContact O-N 2.87Å; E310-T314 PolarHBondContact O-OG1 3.34Å; Y312-T314 PolarHBondContact O-N 3.49Å; T314-C317 PolarHBondContact O-N 3.45Å; T314-D318 PolarHBondContact O-N 3.4Å
315	S	91	Very high	89	Confident	33 Å²	33	52.8 Å²	52.8	23%	0.231	30%	0.295	C	S	.	.	H	α-helix	trans	-64.7	-41.1	176.5	-60.3	0	0	0	0	112	T311 Y312 C317 D318 L319	T311-S315 WeakPolarHBondContact O-CB 3.14Å; T311-S315 PolarHBondContact O-N 2.97Å; T311-S315 PolarHBondContact O-OG 3.29Å; Y312-S315 PolarHBondContact O-N 2.68Å; S315-C317 VanDerWaalsContact C-N 3.33Å; S315-C317 PolarHBondContact O-N 2.95Å; S315-D318 PolarHBondContact O-N 2.9Å; S315-L319 WeakPolarHBondContact O-CB 3.47Å; S315-L319 VanDerWaalsContact O-CG 3.22Å; S315-L319 WeakPolarHBondContact O-CG 3.29Å; S315-L319 PolarHBondContact O-N 3.09Å
316	L	92.8	Very high	89.6	Confident	0 Å²	0	49 Å²	49	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-59.2	-45.5	174.7	177.2	62.9	0	0	0	111.3	L303 Y312 Y320 F350 Y353 Y357 L428	L303-L316 HydrophobicContact CD1-CD1 3.87Å; L303-L316 HydrophobicContact CD2-CB 3.98Å; Y312-L316 HydrophobicContact CE1-CD2 4.4Å; Y312-L316 VanDerWaalsContact O-CB 3.32Å; Y312-L316 WeakPolarHBondContact O-CB 3.35Å; Y312-L316 PolarHBondContact O-N 2.96Å; L316-Y320 VanDerWaalsContact O-CB 3.25Å; L316-Y320 WeakPolarHBondContact O-CB 3.47Å; L316-Y320 PolarHBondContact O-N 3.45Å; L316-F350 HydrophobicContact CD1-CD1 3.91Å; L316-F350 HydrophobicContact CD1-CE1 4.05Å; L316-Y353 HydrophobicContact CD1-CG 4.38Å; L316-Y357 HydrophobicContact CD2-CD2 4.23Å; L316-L428 HydrophobicContact CD2-CD1 4.19Å; L316-L428 HydrophobicContact CG-CD1 4.33Å; L316-L428 HydrophobicContact CG-CD2 4.31Å
317	C	92	Very high	90.3	Very high	9 Å²	9	47.8 Å²	47.8	6%	0.061	26%	0.256	C	S	.	.	H	α-helix	trans	-63.6	-46.4	178.2	-172.6	0	0	0	0	112.2	L313 T314 S315 Y320 Q321 R424 L427	L313-C317 WeakPolarHBondContact O-CB 3.12Å; L313-C317 PolarHBondContact O-N 2.92Å; T314-C317 PolarHBondContact O-N 3.45Å; S315-C317 VanDerWaalsContact C-N 3.33Å; S315-C317 PolarHBondContact O-N 2.95Å; C317-Y320 PolarHBondContact O-N 3.42Å; C317-Q321 WeakPolarHBondContact O-CG 3.3Å; C317-Q321 PolarHBondContact O-N 3.17Å; C317-R424 HydrophobicContact CB-CG 4.37Å; C317-L427 VanDerWaalsContact SG-CD1 3.53Å
318	D	90.9	Very high	90.9	Very high	65 Å²	65	46.2 Å²	46.2	35%	0.348	23%	0.232	S	C	.	.	H	α-helix	trans	-62.9	-47.2	178.5	179.9	44.8	0	0	0	111.8	T314 S315 Y320 Q321 K322	T314-D318 PolarHBondContact O-N 3.4Å; S315-D318 PolarHBondContact O-N 2.9Å; D318-Y320 VanDerWaalsContact C-N 3.33Å; D318-Y320 PolarHBondContact O-N 3.47Å; D318-Q321 PolarHBondContact O-N 3.26Å; D318-K322 WeakPolarHBondContact O-CB 3.49Å; D318-K322 WeakPolarHBondContact O-CG 3.25Å; D318-K322 PolarHBondContact O-N 3.35Å; D318-K322 WeakPolarHBondContact OD1-CE 3.41Å; D318-K322 IonicContact OD1-NZ 3.79Å; D318-K322 PolarHBondContact OD1-NZ 3.48Å; D318-K322 WeakPolarHBondContact OD2-CE 3.43Å; D318-K322 IonicContact OD2-NZ 3.31Å; D318-K322 PolarHBondContact OD2-NZ 3.27Å
319	L	92.1	Very high	91	Very high	5 Å²	5	47 Å²	47	3%	0.026	23%	0.233	C	C	.	.	H	α-helix	trans	-62.3	-40.1	177.6	-70.1	170.8	0	0	0	112.1	F258 V299 K302 L303 S315 T323 F350	F258-L319 HydrophobicContact CE2-CD2 4.23Å; F258-L319 HydrophobicContact CZ-CD2 4.15Å; V299-L319 HydrophobicContact CG1-CD1 4.41Å; V299-L319 HydrophobicContact CG2-CD1 4.4Å; K302-L319 HydrophobicContact CB-CD1 3.99Å; K302-L319 HydrophobicContact CD-CD1 4.44Å; K302-L319 HydrophobicContact CD-CD2 4.01Å; L303-L319 HydrophobicContact CD2-CD1 4.14Å; L303-L319 HydrophobicContact CG-CD1 4.11Å; S315-L319 WeakPolarHBondContact O-CB 3.47Å; S315-L319 VanDerWaalsContact O-CG 3.22Å; S315-L319 WeakPolarHBondContact O-CG 3.29Å; S315-L319 PolarHBondContact O-N 3.09Å; L319-T323 WeakPolarHBondContact O-CB 3.34Å; L319-T323 PolarHBondContact O-N 3.12Å; L319-T323 PolarHBondContact O-OG1 2.96Å; L319-F350 HydrophobicContact CB-CE1 4.27Å; L319-F350 HydrophobicContact CB-CZ 4.13Å
320	Y	93.1	Very high	91	Very high	36 Å²	36	44 Å²	44	14%	0.141	22%	0.218	C	C	.	.	H	α-helix	trans	-64.9	-45.2	176.2	-175.4	-95.5	0	0	0	111.8	L316 C317 D318 T323 K324 V346 F350 L354 L427 L428	L316-Y320 VanDerWaalsContact O-CB 3.25Å; L316-Y320 WeakPolarHBondContact O-CB 3.47Å; L316-Y320 PolarHBondContact O-N 3.45Å; C317-Y320 PolarHBondContact O-N 3.42Å; D318-Y320 VanDerWaalsContact C-N 3.33Å; D318-Y320 PolarHBondContact O-N 3.47Å; Y320-T323 PolarHBondContact O-N 3.38Å; Y320-K324 WeakPolarHBondContact O-CB 3.38Å; Y320-K324 PolarHBondContact O-N 3.35Å; Y320-V346 HydrophobicContact CD2-CG1 4.32Å; Y320-V346 HydrophobicContact CE2-CG1 3.45Å; Y320-V346 VanDerWaalsContact CE2-CG1 3.45Å; Y320-F350 HydrophobicContact CD2-CB 4.36Å; Y320-F350 HydrophobicContact CD2-CD1 4.26Å; Y320-F350 AromaticContact CD2-CD2 3.8Å; Y320-F350 HydrophobicContact CD2-CD2 3.8Å; Y320-F350 HydrophobicContact CD2-CE2 4.12Å; Y320-F350 AromaticContact CD2-CG 3.88Å; Y320-F350 HydrophobicContact CD2-CG 3.88Å; Y320-F350 HydrophobicContact CD2-CZ 4.5Å; Y320-F350 HydrophobicContact CE2-CD2 4.4Å; Y320-L354 HydrophobicContact CE2-CD1 4Å; Y320-L354 HydrophobicContact CE2-CD2 4.49Å; Y320-L427 WeakPolarHBondContact CE1-O 3.41Å; Y320-L428 HydrophobicContact CD1-CD2 3.97Å; Y320-L428 HydrophobicContact CD2-CD2 4.21Å; Y320-L428 HydrophobicContact CG-CD2 3.74Å
321	Q	91.8	Very high	90.9	Very high	48 Å²	48	42.4 Å²	42.4	22%	0.224	21%	0.21	C	C	.	.	H	α-helix	trans	-62.3	-44.5	176.2	-76	-174.7	-9.2	0	0	112.5	C317 D318 T323 K324 K325 Y423 L427	C317-Q321 WeakPolarHBondContact O-CG 3.3Å; C317-Q321 PolarHBondContact O-N 3.17Å; D318-Q321 PolarHBondContact O-N 3.26Å; Q321-T323 VanDerWaalsContact C-N 3.35Å; Q321-K324 PolarHBondContact O-N 3.24Å; Q321-K325 WeakPolarHBondContact O-CG 3.1Å; Q321-K325 PolarHBondContact O-N 3.07Å; Q321-Y423 PolarHBondContact NE2-OH 3.26Å; Q321-L427 HydrophobicContact CG-CD1 4.35Å; Q321-L427 HydrophobicContact CG-CD2 4.49Å
322	K	91.5	Very high	90.8	Very high	82 Å²	82	44 Å²	44	36%	0.357	22%	0.22	S	C	.	.	H	α-helix	trans	-61.2	-43	175.6	-75.5	172.4	175.7	165.7	0	111.6	F258 D318 K325 L326	F258-K322 HydrophobicContact CD1-CB 4.04Å; F258-K322 HydrophobicContact CD2-CB 4.11Å; F258-K322 HydrophobicContact CD2-CD 4.17Å; F258-K322 HydrophobicContact CE1-CB 3.75Å; F258-K322 HydrophobicContact CE2-CB 3.82Å; F258-K322 HydrophobicContact CE2-CD 3.89Å; F258-K322 HydrophobicContact CE2-CG 4.45Å; F258-K322 HydrophobicContact CG-CB 4.22Å; F258-K322 HydrophobicContact CZ-CB 3.64Å; F258-K322 HydrophobicContact CZ-CD 4.46Å; D318-K322 WeakPolarHBondContact O-CB 3.49Å; D318-K322 WeakPolarHBondContact O-CG 3.25Å; D318-K322 PolarHBondContact O-N 3.35Å; D318-K322 WeakPolarHBondContact OD1-CE 3.41Å; D318-K322 IonicContact OD1-NZ 3.79Å; D318-K322 PolarHBondContact OD1-NZ 3.48Å; D318-K322 WeakPolarHBondContact OD2-CE 3.43Å; D318-K322 IonicContact OD2-NZ 3.31Å; D318-K322 PolarHBondContact OD2-NZ 3.27Å; K322-K325 PolarHBondContact O-N 3.47Å; K322-L326 PolarHBondContact O-N 3.12Å
323	T	92.2	Very high	90.5	Very high	1 Å²	1	44.2 Å²	44.2	1%	0.006	22%	0.222	C	C	.	.	H	α-helix	trans	-65	-42.6	176.7	-54	0	0	0	0	111.8	F258 F291 L295 L319 Y320 Q321 K325 L326 V327 F350	F258-T323 WeakPolarHBondContact CE1-OG1 3.47Å; F291-T323 HydrophobicContact CE1-CG2 3.96Å; L295-T323 HydrophobicContact CD2-CG2 4.04Å; L319-T323 WeakPolarHBondContact O-CB 3.34Å; L319-T323 PolarHBondContact O-N 3.12Å; L319-T323 PolarHBondContact O-OG1 2.96Å; Y320-T323 PolarHBondContact O-N 3.38Å; Q321-T323 VanDerWaalsContact C-N 3.35Å; T323-K325 PolarHBondContact O-N 3.22Å; T323-L326 WeakPolarHBondContact O-CB 3.39Å; T323-L326 PolarHBondContact O-N 2.93Å; T323-V327 HydrophobicContact CG2-CG2 4.46Å; T323-V327 WeakPolarHBondContact O-CG2 3.43Å; T323-V327 PolarHBondContact O-N 3.43Å; T323-F350 HydrophobicContact CG2-CE2 3.89Å; T323-F350 WeakPolarHBondContact OG1-CE2 3.48Å
324	K	90.4	Very high	90	Very high	107 Å²	107	51 Å²	51	47%	0.465	26%	0.258	S	S	.	.	H	α-helix	trans	-62.6	-43	176.6	-172.1	176.2	179.1	178.2	0	111.9	Y320 Q321 L326 V327 D328	Y320-K324 WeakPolarHBondContact O-CB 3.38Å; Y320-K324 PolarHBondContact O-N 3.35Å; Q321-K324 PolarHBondContact O-N 3.24Å; K324-L326 VanDerWaalsContact C-N 3.34Å; K324-L326 PolarHBondContact O-N 2.82Å; K324-V327 PolarHBondContact O-N 3.38Å; K324-D328 PolarHBondContact O-N 2.84Å
325	K	90.9	Very high	89.6	Confident	135 Å²	135	48.2 Å²	48.2	59%	0.587	24%	0.24	S	C	*	.	H	α-helix	trans	-59.4	-43.4	173.3	-75.7	176.8	179.4	176.6	0	111.8	Q321 K322 T323 D328 Q329	Q321-K325 WeakPolarHBondContact O-CG 3.1Å; Q321-K325 PolarHBondContact O-N 3.07Å; K322-K325 PolarHBondContact O-N 3.47Å; T323-K325 PolarHBondContact O-N 3.22Å; K325-D328 PolarHBondContact O-N 2.96Å; K325-Q329 WeakPolarHBondContact O-CG 3.34Å; K325-Q329 PolarHBondContact O-N 2.97Å; K325-Q329 VanDerWaalsContact O-N 3.07Å
326	L	90.8	Very high	89.1	Confident	3 Å²	3	47.4 Å²	47.4	2%	0.016	24%	0.235	C	C	.	.	H	α-helix	trans	-61.2	-48.9	174.8	177.5	63.2	0	0	0	110.8	F258 I261 W262 F291 K322 T323 K324 D328 Q329 L330	F258-L326 HydrophobicContact CD1-CB 4.3Å; F258-L326 HydrophobicContact CD1-CD2 3.99Å; I261-L326 HydrophobicContact CB-CD2 4.32Å; I261-L326 HydrophobicContact CG2-CD1 4.42Å; I261-L326 HydrophobicContact CG2-CD2 3.85Å; W262-L326 HydrophobicContact CB-CD1 3.85Å; F291-L326 HydrophobicContact CE2-CD2 4.33Å; F291-L326 HydrophobicContact CZ-CD2 3.98Å; F291-L326 HydrophobicContact CZ-CG 4.33Å; K322-L326 PolarHBondContact O-N 3.12Å; T323-L326 WeakPolarHBondContact O-CB 3.39Å; T323-L326 PolarHBondContact O-N 2.93Å; K324-L326 VanDerWaalsContact C-N 3.34Å; K324-L326 PolarHBondContact O-N 2.82Å; L326-D328 VanDerWaalsContact C-N 3.3Å; L326-D328 PolarHBondContact O-N 3.29Å; L326-Q329 WeakPolarHBondContact O-CA 3.18Å; L326-Q329 WeakPolarHBondContact O-CB 3.47Å; L326-Q329 PolarHBondContact O-N 3.33Å; L326-L330 WeakPolarHBondContact O-CG 3.45Å; L326-L330 PolarHBondContact O-N 3.16Å
327	V	90.5	Very high	88.4	Confident	5 Å²	5	48.7 Å²	48.7	3%	0.03	24%	0.243	C	C	.	.	H	α-helix	trans	-57.6	-42.2	176.6	172.4	0	0	0	0	111.3	F291 T323 K324 Q329 L330 F331 R342 L345 V346	F291-V327 HydrophobicContact CE1-CG2 3.72Å; F291-V327 HydrophobicContact CZ-CG2 3.93Å; T323-V327 HydrophobicContact CG2-CG2 4.46Å; T323-V327 WeakPolarHBondContact O-CG2 3.43Å; T323-V327 PolarHBondContact O-N 3.43Å; K324-V327 PolarHBondContact O-N 3.38Å; V327-Q329 VanDerWaalsContact C-N 3.31Å; V327-Q329 PolarHBondContact O-N 3.37Å; V327-L330 WeakPolarHBondContact O-CB 3.27Å; V327-L330 PolarHBondContact O-N 2.9Å; V327-F331 HydrophobicContact CG1-CD2 4.22Å; V327-F331 HydrophobicContact CG1-CE2 4.11Å; V327-F331 VanDerWaalsContact O-CD2 3.31Å; V327-F331 WeakPolarHBondContact O-CD2 3.25Å; V327-F331 PolarHBondContact O-N 3.39Å; V327-R342 HydrophobicContact CG1-CB 4.18Å; V327-R342 HydrophobicContact CG1-CG 4.02Å; V327-L345 HydrophobicContact CG1-CD1 4.5Å; V327-L345 HydrophobicContact CG2-CB 4.23Å; V327-L345 HydrophobicContact CG2-CD1 4.23Å; V327-V346 HydrophobicContact CG2-CG2 4.33Å
328	D	88.1	Confident	87.7	Confident	77 Å²	77	55 Å²	55	41%	0.412	28%	0.277	S	S	.	.	H	α-helix	trans	-60.9	-39.3	175.9	-75	-32.8	0	0	0	112.5	K324 K325 L326 R342	K324-D328 PolarHBondContact O-N 2.84Å; K325-D328 PolarHBondContact O-N 2.96Å; L326-D328 VanDerWaalsContact C-N 3.3Å; L326-D328 PolarHBondContact O-N 3.29Å; D328-R342 IonicContact OD1-CZ 2.85Å; D328-R342 IonicContact OD1-NH1 2.77Å; D328-R342 PolarHBondContact OD1-NH1 2.69Å
329	Q	89	Confident	86.8	Confident	89 Å²	89	60 Å²	60	42%	0.416	30%	0.295	S	S	.	.	H	α-helix	trans	-66.3	-40.3	173.3	-68.3	173.2	-16.8	0	0	112	W262 K325 L326 V327 F331 T332	W262-Q329 HydrophobicContact CD2-CB 4.24Å; W262-Q329 HydrophobicContact CE3-CB 3.83Å; W262-Q329 HydrophobicContact CH2-CB 4.16Å; W262-Q329 WeakPolarHBondContact CH2-O 3.48Å; W262-Q329 HydrophobicContact CZ2-CB 4.5Å; W262-Q329 VanDerWaalsContact CZ3-C 3.41Å; W262-Q329 HydrophobicContact CZ3-CB 3.8Å; W262-Q329 WeakPolarHBondContact CZ3-O 3.49Å; K325-Q329 WeakPolarHBondContact O-CG 3.34Å; K325-Q329 PolarHBondContact O-N 2.97Å; K325-Q329 VanDerWaalsContact O-N 3.07Å; L326-Q329 WeakPolarHBondContact O-CA 3.18Å; L326-Q329 WeakPolarHBondContact O-CB 3.47Å; L326-Q329 PolarHBondContact O-N 3.33Å; V327-Q329 VanDerWaalsContact C-N 3.31Å; V327-Q329 PolarHBondContact O-N 3.37Å; Q329-F331 VanDerWaalsContact C-N 3.26Å; Q329-F331 PolarHBondContact O-N 3.43Å; Q329-T332 WeakPolarHBondContact O-CB 3.35Å; Q329-T332 WeakPolarHBondContact O-CG2 3.49Å; Q329-T332 PolarHBondContact O-N 2.98Å; Q329-T332 PolarHBondContact O-OG1 3.28Å
330	L	88.9	Confident	86.2	Confident	0 Å²	0	66 Å²	66	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-57.5	-36.7	-179.4	-68.4	-179.3	0	0	0	113.8	W262 L265 I287 F291 L326 V327 T332 L333 L345	W262-L330 HydrophobicContact CE3-CD2 4.06Å; W262-L330 HydrophobicContact CZ3-CD2 4.25Å; L265-L330 HydrophobicContact CB-CD2 4.18Å; L265-L330 HydrophobicContact CD1-CD1 4.35Å; L265-L330 HydrophobicContact CD1-CD2 3.33Å; L265-L330 HydrophobicContact CD1-CG 4.47Å; L265-L330 HydrophobicContact CG-CD2 4.34Å; I287-L330 HydrophobicContact CG2-CD1 4.08Å; F291-L330 HydrophobicContact CE2-CD1 3.54Å; F291-L330 HydrophobicContact CZ-CD1 3.53Å; L326-L330 WeakPolarHBondContact O-CG 3.45Å; L326-L330 PolarHBondContact O-N 3.16Å; V327-L330 WeakPolarHBondContact O-CB 3.27Å; V327-L330 PolarHBondContact O-N 2.9Å; L330-T332 PolarHBondContact O-N 2.75Å; L330-T332 VanDerWaalsContact O-N 3.13Å; L330-L333 HydrophobicContact CD2-CD1 4.11Å; L330-L333 VanDerWaalsContact O-CB 3.3Å; L330-L333 WeakPolarHBondContact O-CB 3.34Å; L330-L333 WeakPolarHBondContact O-CG 3.37Å; L330-L333 PolarHBondContact O-N 3.09Å; L330-L345 HydrophobicContact CD1-CD1 4.17Å
331	F	86.3	Confident	85.8	Confident	44 Å²	44	65.5 Å²	65.5	19%	0.193	33%	0.326	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.2	2.9	178.7	-84.2	-98.1	0	0	0	114.1	V327 Q329 P337 D338 F341 R342	V327-F331 HydrophobicContact CG1-CD2 4.22Å; V327-F331 HydrophobicContact CG1-CE2 4.11Å; V327-F331 VanDerWaalsContact O-CD2 3.31Å; V327-F331 WeakPolarHBondContact O-CD2 3.25Å; V327-F331 PolarHBondContact O-N 3.39Å; Q329-F331 VanDerWaalsContact C-N 3.26Å; Q329-F331 PolarHBondContact O-N 3.43Å; F331-P337 WeakPolarHBondContact CE1-O 3.04Å; F331-D338 WeakPolarHBondContact CE1-O 3.47Å; F331-F341 HydrophobicContact CZ-CB 4.17Å; F331-F341 HydrophobicContact CZ-CD1 4.44Å; F331-R342 HydrophobicContact CD1-CG 4.35Å; F331-R342 HydrophobicContact CD2-CG 3.7Å; F331-R342 HydrophobicContact CE1-CG 3.82Å; F331-R342 HydrophobicContact CE2-CB 4.19Å; F331-R342 HydrophobicContact CE2-CG 3.11Å; F331-R342 HydrophobicContact CG-CG 4.3Å; F331-R342 VanDerWaalsContact CG-NE 3.34Å; F331-R342 HydrophobicContact CZ-CB 4.25Å; F331-R342 HydrophobicContact CZ-CG 3.18Å
332	T	87	Confident	85.5	Confident	100 Å²	100	66.9 Å²	66.9	61%	0.613	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.7	-7.8	166.8	70.8	0	0	0	0	112.9	W262 Q329 L330	W262-T332 WeakPolarHBondContact CH2-OG1 3.44Å; Q329-T332 WeakPolarHBondContact O-CB 3.35Å; Q329-T332 WeakPolarHBondContact O-CG2 3.49Å; Q329-T332 PolarHBondContact O-N 2.98Å; Q329-T332 PolarHBondContact O-OG1 3.28Å; L330-T332 PolarHBondContact O-N 2.75Å; L330-T332 VanDerWaalsContact O-N 3.13Å
333	L	86.9	Confident	85.1	Confident	18 Å²	18	67 Å²	67	9%	0.094	34%	0.337	C	S	.	.	S	Bend	trans	-78.9	148.6	176.8	-60.1	174.8	0	0	0	111.7	W262 L265 K266 D269 L330 N335 C336	W262-L333 HydrophobicContact CH2-CD2 3.91Å; W262-L333 HydrophobicContact CH2-CG 4.24Å; W262-L333 HydrophobicContact CZ3-CD1 4.19Å; W262-L333 HydrophobicContact CZ3-CD2 4.01Å; W262-L333 HydrophobicContact CZ3-CG 3.97Å; L265-L333 HydrophobicContact CB-CD1 4.05Å; K266-L333 HydrophobicContact CB-CD2 4.31Å; K266-L333 HydrophobicContact CG-CD2 4.44Å; D269-L333 HydrophobicContact CB-CD2 4.25Å; L330-L333 HydrophobicContact CD2-CD1 4.11Å; L330-L333 VanDerWaalsContact O-CB 3.3Å; L330-L333 WeakPolarHBondContact O-CB 3.34Å; L330-L333 WeakPolarHBondContact O-CG 3.37Å; L330-L333 PolarHBondContact O-N 3.09Å; L333-N335 PolarHBondContact O-N 2.9Å; L333-C336 HydrophobicContact CB-CB 4.4Å
334	N	83.3	Confident	84.9	Confident	142 Å²	142	70.3 Å²	70.3	76%	0.759	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.7	-35.1	-173.1	-71.1	-30.9	0	0	0	113	D269	D269-N334 PolarHBondContact OD2-N 2.97Å
335	N	82.5	Confident	84.8	Confident	13 Å²	13	65.2 Å²	65.2	7%	0.07	33%	0.334	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.2	13.9	-175.6	-57.5	-64	0	0	0	113.6	D269 P279 M283 L333	D269-N335 PolarHBondContact O-ND2 3.39Å; D269-N335 VanDerWaalsContact OD1-CB 3.3Å; D269-N335 WeakPolarHBondContact OD1-CB 3.47Å; D269-N335 PolarHBondContact OD1-N 3.4Å; D269-N335 PolarHBondContact OD1-ND2 3.15Å; P279-N335 HydrophobicContact CB-CB 4.45Å; M283-N335 HydrophobicContact CB-CB 4.09Å; M283-N335 HydrophobicContact CG-CB 4.27Å; L333-N335 PolarHBondContact O-N 2.9Å
336	C	80.9	Confident	84.7	Confident	17 Å²	17	59.7 Å²	59.7	12%	0.115	31%	0.312	C	S	.	.	P	Polyproline II helix	trans	-72.6	135.3	178.5	-157.7	0	0	0	0	110.6	L333	L333-C336 HydrophobicContact CB-CB 4.4Å
337	P	77	Confident	84.5	Confident	27 Å²	27	63.4 Å²	63.4	18%	0.175	33%	0.332	C	S	.	.	P	Polyproline II helix	trans	-68.2	169.1	176.4	28.6	-37.1	0	0	0	113.4	F331 F341	F331-P337 WeakPolarHBondContact CE1-O 3.04Å; P337-F341 HydrophobicContact CB-CB 4.27Å; P337-F341 HydrophobicContact CB-CG 4.28Å; P337-F341 HydrophobicContact CG-CB 3.83Å; P337-F341 HydrophobicContact CG-CD1 3.3Å; P337-F341 HydrophobicContact CG-CD2 3.82Å; P337-F341 HydrophobicContact CG-CE1 3.6Å; P337-F341 HydrophobicContact CG-CE2 4.11Å; P337-F341 HydrophobicContact CG-CG 3.4Å; P337-F341 HydrophobicContact CG-CZ 4Å
338	D	77	Confident	84.5	Confident	142 Å²	142	65.3 Å²	65.3	76%	0.759	34%	0.343	S	S	*	.	P	Polyproline II helix	trans	-58.4	170.3	-172.6	-76.9	-36.7	0	0	0	115.7	F331 D340 F341	F331-D338 WeakPolarHBondContact CE1-O 3.47Å; D338-D340 PolarHBondContact O-N 3.42Å; D338-F341 VanDerWaalsContact O-CB 3.24Å; D338-F341 WeakPolarHBondContact O-CB 3.31Å; D338-F341 PolarHBondContact O-N 3.08Å
339	K	73.3	Confident	84.6	Confident	168 Å²	168	61.8 Å²	61.8	73%	0.73	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.8	-31.8	-172.9	-68.3	-177.2	-179.3	179	0	115.2	F341 R342	K339-F341 PolarHBondContact O-N 2.93Å; K339-R342 WeakPolarHBondContact O-CB 3.27Å; K339-R342 WeakPolarHBondContact O-CG 3.5Å; K339-R342 PolarHBondContact O-N 2.96Å; K339-R342 VanDerWaalsContact O-N 3.12Å
340	D	79	Confident	84.8	Confident	133 Å²	133	57.6 Å²	57.6	71%	0.711	31%	0.305	S	S	*	.	H	α-helix	trans	-63.8	-25.2	179.7	-63.6	-27.1	0	0	0	112.2	D338 R342 T343	D338-D340 PolarHBondContact O-N 3.42Å; D340-R342 PolarHBondContact O-N 2.91Å; D340-T343 PolarHBondContact O-N 2.85Å
341	F	85.2	Confident	84.8	Confident	24 Å²	24	60.8 Å²	60.8	11%	0.105	33%	0.327	C	S	.	.	H	α-helix	trans	-66.3	-24.7	176.5	-167.9	-112.9	0	0	0	112.8	I287 L288 F331 P337 D338 K339 T343 V344 L345	I287-F341 HydrophobicContact CB-CE1 4.18Å; I287-F341 HydrophobicContact CB-CZ 4.25Å; I287-F341 HydrophobicContact CD1-CE1 4.12Å; I287-F341 HydrophobicContact CG2-CE1 3.95Å; I287-F341 HydrophobicContact CG2-CZ 4.28Å; L288-F341 HydrophobicContact CD1-CE2 4.12Å; L288-F341 HydrophobicContact CD2-CE2 3.95Å; L288-F341 HydrophobicContact CD2-CZ 4.18Å; L288-F341 HydrophobicContact CG-CE2 3.88Å; L288-F341 HydrophobicContact CG-CZ 3.92Å; F331-F341 HydrophobicContact CZ-CB 4.17Å; F331-F341 HydrophobicContact CZ-CD1 4.44Å; P337-F341 HydrophobicContact CB-CB 4.27Å; P337-F341 HydrophobicContact CB-CG 4.28Å; P337-F341 HydrophobicContact CG-CB 3.83Å; P337-F341 HydrophobicContact CG-CD1 3.3Å; P337-F341 HydrophobicContact CG-CD2 3.82Å; P337-F341 HydrophobicContact CG-CE1 3.6Å; P337-F341 HydrophobicContact CG-CE2 4.11Å; P337-F341 HydrophobicContact CG-CG 3.4Å; P337-F341 HydrophobicContact CG-CZ 4Å; D338-F341 VanDerWaalsContact O-CB 3.24Å; D338-F341 WeakPolarHBondContact O-CB 3.31Å; D338-F341 PolarHBondContact O-N 3.08Å; K339-F341 PolarHBondContact O-N 2.93Å; F341-T343 VanDerWaalsContact C-N 3.32Å; F341-T343 PolarHBondContact O-N 2.88Å; F341-V344 PolarHBondContact O-N 3.13Å; F341-L345 HydrophobicContact CD1-CD1 3.69Å; F341-L345 HydrophobicContact CD1-CD2 4.26Å; F341-L345 HydrophobicContact CD1-CG 3.83Å; F341-L345 HydrophobicContact CE1-CD1 3.64Å; F341-L345 HydrophobicContact CE1-CD2 3.66Å; F341-L345 HydrophobicContact CE1-CG 3.73Å; F341-L345 HydrophobicContact CE2-CD2 4.4Å; F341-L345 HydrophobicContact CG-CG 4.42Å; F341-L345 HydrophobicContact CZ-CD2 3.74Å; F341-L345 HydrophobicContact CZ-CG 4.2Å; F341-L345 WeakPolarHBondContact O-CG 3.46Å; F341-L345 PolarHBondContact O-N 2.95Å
342	R	85.7	Confident	84.9	Confident	78 Å²	78	65.1 Å²	65.1	29%	0.294	35%	0.346	S	S	.	.	H	α-helix	trans	-56.3	-48	175.7	-68.9	177.8	172.3	-106.4	10.9	111.5	V327 D328 F331 K339 D340 L345 V346	V327-R342 HydrophobicContact CG1-CB 4.18Å; V327-R342 HydrophobicContact CG1-CG 4.02Å; D328-R342 IonicContact OD1-CZ 2.85Å; D328-R342 IonicContact OD1-NH1 2.77Å; D328-R342 PolarHBondContact OD1-NH1 2.69Å; F331-R342 HydrophobicContact CD1-CG 4.35Å; F331-R342 HydrophobicContact CD2-CG 3.7Å; F331-R342 HydrophobicContact CE1-CG 3.82Å; F331-R342 HydrophobicContact CE2-CB 4.19Å; F331-R342 HydrophobicContact CE2-CG 3.11Å; F331-R342 HydrophobicContact CG-CG 4.3Å; F331-R342 VanDerWaalsContact CG-NE 3.34Å; F331-R342 HydrophobicContact CZ-CB 4.25Å; F331-R342 HydrophobicContact CZ-CG 3.18Å; K339-R342 WeakPolarHBondContact O-CB 3.27Å; K339-R342 WeakPolarHBondContact O-CG 3.5Å; K339-R342 PolarHBondContact O-N 2.96Å; K339-R342 VanDerWaalsContact O-N 3.12Å; D340-R342 PolarHBondContact O-N 2.91Å; R342-L345 PolarHBondContact O-N 3.08Å; R342-V346 WeakPolarHBondContact O-CG2 3.3Å; R342-V346 PolarHBondContact O-N 3.44Å
343	T	83.3	Confident	85.1	Confident	85 Å²	85	61.6 Å²	61.6	52%	0.521	32%	0.322	S	S	.	.	H	α-helix	trans	-67.1	-43	-177.5	-33.6	0	0	0	0	110.1	D340 F341 L345 V346 D347	D340-T343 PolarHBondContact O-N 2.85Å; F341-T343 VanDerWaalsContact C-N 3.32Å; F341-T343 PolarHBondContact O-N 2.88Å; T343-L345 VanDerWaalsContact C-N 3.34Å; T343-L345 PolarHBondContact O-N 3.3Å; T343-V346 PolarHBondContact O-N 3.34Å; T343-D347 WeakPolarHBondContact O-CB 3.4Å; T343-D347 PolarHBondContact O-N 3.19Å
344	V	87.2	Confident	85.3	Confident	69 Å²	69	62.6 Å²	62.6	42%	0.418	33%	0.327	S	S	.	.	H	α-helix	trans	-58.5	-43.9	177.3	178.9	0	0	0	0	111.7	L288 F341 D347 T348	L288-V344 HydrophobicContact CD2-CG1 4.33Å; F341-V344 PolarHBondContact O-N 3.13Å; V344-D347 PolarHBondContact O-N 3.32Å; V344-T348 WeakPolarHBondContact O-CB 3.47Å; V344-T348 PolarHBondContact O-N 3.3Å; V344-T348 PolarHBondContact O-OG1 3.12Å
345	L	88.8	Confident	85.5	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-63.3	-44.9	179.6	-70.6	179.2	0	0	0	112.7	I287 L288 F291 V327 L330 F341 R342 T343	I287-L345 HydrophobicContact CG2-CD1 3.92Å; I287-L345 HydrophobicContact CG2-CD2 3.51Å; I287-L345 HydrophobicContact CG2-CG 4.37Å; L288-L345 HydrophobicContact CD2-CD2 4.23Å; F291-L345 HydrophobicContact CB-CD2 4.19Å; F291-L345 HydrophobicContact CD1-CB 3.87Å; F291-L345 HydrophobicContact CD1-CD2 4Å; F291-L345 HydrophobicContact CD1-CG 4.4Å; F291-L345 HydrophobicContact CD2-CD2 4.18Å; F291-L345 HydrophobicContact CE1-CB 3.94Å; F291-L345 HydrophobicContact CE1-CD1 4.35Å; F291-L345 HydrophobicContact CE1-CD2 4.46Å; F291-L345 HydrophobicContact CE1-CG 4.49Å; F291-L345 HydrophobicContact CG-CD2 3.86Å; F291-L345 HydrophobicContact CZ-CD1 4.33Å; V327-L345 HydrophobicContact CG1-CD1 4.5Å; V327-L345 HydrophobicContact CG2-CB 4.23Å; V327-L345 HydrophobicContact CG2-CD1 4.23Å; L330-L345 HydrophobicContact CD1-CD1 4.17Å; F341-L345 HydrophobicContact CD1-CD1 3.69Å; F341-L345 HydrophobicContact CD1-CD2 4.26Å; F341-L345 HydrophobicContact CD1-CG 3.83Å; F341-L345 HydrophobicContact CE1-CD1 3.64Å; F341-L345 HydrophobicContact CE1-CD2 3.66Å; F341-L345 HydrophobicContact CE1-CG 3.73Å; F341-L345 HydrophobicContact CE2-CD2 4.4Å; F341-L345 HydrophobicContact CG-CG 4.42Å; F341-L345 HydrophobicContact CZ-CD2 3.74Å; F341-L345 HydrophobicContact CZ-CG 4.2Å; F341-L345 WeakPolarHBondContact O-CG 3.46Å; F341-L345 PolarHBondContact O-N 2.95Å; R342-L345 PolarHBondContact O-N 3.08Å; T343-L345 VanDerWaalsContact C-N 3.34Å; T343-L345 PolarHBondContact O-N 3.3Å
346	V	88	Confident	85.7	Confident	19 Å²	19	62.2 Å²	62.2	12%	0.115	34%	0.335	C	S	.	.	H	α-helix	trans	-68.1	-43.3	179.7	176.9	0	0	0	0	110.6	Y320 V327 R342 T343 T348 V349 F350	Y320-V346 HydrophobicContact CD2-CG1 4.32Å; Y320-V346 HydrophobicContact CE2-CG1 3.45Å; Y320-V346 VanDerWaalsContact CE2-CG1 3.45Å; V327-V346 HydrophobicContact CG2-CG2 4.33Å; R342-V346 WeakPolarHBondContact O-CG2 3.3Å; R342-V346 PolarHBondContact O-N 3.44Å; T343-V346 PolarHBondContact O-N 3.34Å; V346-T348 VanDerWaalsContact C-N 3.32Å; V346-T348 PolarHBondContact O-N 3.35Å; V346-V349 PolarHBondContact O-N 3.33Å; V346-F350 HydrophobicContact CG1-CD2 4.37Å; V346-F350 PolarHBondContact O-N 3.13Å
347	D	87.7	Confident	86.3	Confident	81 Å²	81	61.5 Å²	61.5	43%	0.433	33%	0.33	S	S	.	.	H	α-helix	trans	-65.7	-35	179.4	-74.4	-15.3	0	0	0	112.3	T343 V344 V349 S351	T343-D347 WeakPolarHBondContact O-CB 3.4Å; T343-D347 PolarHBondContact O-N 3.19Å; V344-D347 PolarHBondContact O-N 3.32Å; D347-V349 PolarHBondContact O-N 3.46Å; D347-S351 WeakPolarHBondContact O-CB 3.43Å; D347-S351 PolarHBondContact O-N 3.41Å; D347-S351 PolarHBondContact O-OG 3.49Å
348	T	89.3	Confident	87.1	Confident	45 Å²	45	61.2 Å²	61.2	28%	0.276	33%	0.327	S	S	.	.	H	α-helix	trans	-59.6	-32.7	177.1	-60.5	0	0	0	0	112.1	V344 V346	V344-T348 WeakPolarHBondContact O-CB 3.47Å; V344-T348 PolarHBondContact O-N 3.3Å; V344-T348 PolarHBondContact O-OG1 3.12Å; V346-T348 VanDerWaalsContact C-N 3.32Å; V346-T348 PolarHBondContact O-N 3.35Å
349	V	90.7	Very high	87.9	Confident	4 Å²	4	60.5 Å²	60.5	2%	0.024	32%	0.317	C	S	.	.	H	α-helix	trans	-94	-44.3	-178.6	-177.7	0	0	0	0	111.8	F291 L295 V299 V346 D347	F291-V349 HydrophobicContact CB-CG2 4.27Å; F291-V349 HydrophobicContact CD1-CG2 3.94Å; L295-V349 HydrophobicContact CD2-CG2 4.13Å; L295-V349 HydrophobicContact CG-CG2 4.41Å; V299-V349 HydrophobicContact CB-CG1 4.22Å; V299-V349 HydrophobicContact CG1-CG1 4.33Å; V299-V349 HydrophobicContact CG2-CG1 3.86Å; V346-V349 PolarHBondContact O-N 3.33Å; D347-V349 PolarHBondContact O-N 3.46Å
350	F	92.7	Very high	88.8	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-110.1	-7.2	-165.1	-69.5	-78.1	0	0	0	116.1	V299 L316 L319 Y320 T323 V346 K352 Y353 L354	V299-F350 HydrophobicContact CG1-CD1 4.5Å; V299-F350 HydrophobicContact CG1-CE1 3.91Å; V299-F350 HydrophobicContact CG1-CZ 4.38Å; V299-F350 HydrophobicContact CG2-CZ 4.19Å; L316-F350 HydrophobicContact CD1-CD1 3.91Å; L316-F350 HydrophobicContact CD1-CE1 4.05Å; L319-F350 HydrophobicContact CB-CE1 4.27Å; L319-F350 HydrophobicContact CB-CZ 4.13Å; Y320-F350 HydrophobicContact CD2-CB 4.36Å; Y320-F350 HydrophobicContact CD2-CD1 4.26Å; Y320-F350 AromaticContact CD2-CD2 3.8Å; Y320-F350 HydrophobicContact CD2-CD2 3.8Å; Y320-F350 HydrophobicContact CD2-CE2 4.12Å; Y320-F350 AromaticContact CD2-CG 3.88Å; Y320-F350 HydrophobicContact CD2-CG 3.88Å; Y320-F350 HydrophobicContact CD2-CZ 4.5Å; Y320-F350 HydrophobicContact CE2-CD2 4.4Å; T323-F350 HydrophobicContact CG2-CE2 3.89Å; T323-F350 WeakPolarHBondContact OG1-CE2 3.48Å; V346-F350 HydrophobicContact CG1-CD2 4.37Å; V346-F350 PolarHBondContact O-N 3.13Å; F350-K352 VanDerWaalsContact C-N 3.27Å; F350-K352 PolarHBondContact O-N 2.91Å; F350-K352 VanDerWaalsContact O-N 3.14Å; F350-Y353 HydrophobicContact CD1-CD2 4.44Å; F350-Y353 PolarHBondContact O-N 2.8Å; F350-L354 HydrophobicContact CB-CD1 3.92Å; F350-L354 HydrophobicContact CB-CG 3.95Å; F350-L354 WeakPolarHBondContact O-CG 3.15Å; F350-L354 PolarHBondContact O-N 3.5Å
351	S	88.9	Confident	89.5	Confident	67 Å²	67	49.5 Å²	49.5	47%	0.469	26%	0.263	S	S	.	.	H	α-helix	trans	-50.6	-42.9	-176.1	50.8	0	0	0	0	114	D347 Y353 A355	D347-S351 WeakPolarHBondContact O-CB 3.43Å; D347-S351 PolarHBondContact O-N 3.41Å; D347-S351 PolarHBondContact O-OG 3.49Å; S351-Y353 VanDerWaalsContact C-N 3.31Å; S351-Y353 PolarHBondContact O-N 3.08Å; S351-A355 PolarHBondContact O-N 3.08Å
352	K	89.4	Confident	90	Very high	135 Å²	135	48.6 Å²	48.6	59%	0.587	26%	0.259	S	S	*	.	H	α-helix	trans	-61.6	-35.4	176.5	-176.5	-176.6	174.5	-169.7	0	113	F350	F350-K352 VanDerWaalsContact C-N 3.27Å; F350-K352 PolarHBondContact O-N 2.91Å; F350-K352 VanDerWaalsContact O-N 3.14Å
353	Y	90.9	Very high	90.4	Very high	26 Å²	26	48 Å²	48	10%	0.102	26%	0.264	C	S	.	.	H	α-helix	trans	-88.2	-37.6	-173.8	-61.8	-63.5	0	0	0	112.9	V299 D300 L303 Y312 L316 F350 S351 A355 Y357	V299-Y353 HydrophobicContact CG1-CD2 4.39Å; V299-Y353 HydrophobicContact CG1-CE2 4Å; D300-Y353 VanDerWaalsContact CG-OH 3.32Å; D300-Y353 WeakPolarHBondContact OD1-CE2 3.23Å; D300-Y353 VanDerWaalsContact OD1-CZ 3.3Å; D300-Y353 PolarHBondContact OD1-OH 3.33Å; L303-Y353 HydrophobicContact CB-CE1 4.41Å; L303-Y353 HydrophobicContact CD1-CD1 3.91Å; L303-Y353 HydrophobicContact CD1-CD2 3.84Å; L303-Y353 HydrophobicContact CD1-CE1 3.86Å; L303-Y353 HydrophobicContact CD1-CE2 3.81Å; L303-Y353 HydrophobicContact CD1-CG 3.9Å; Y312-Y353 WeakPolarHBondContact OH-CD1 3.27Å; L316-Y353 HydrophobicContact CD1-CG 4.38Å; F350-Y353 HydrophobicContact CD1-CD2 4.44Å; F350-Y353 PolarHBondContact O-N 2.8Å; S351-Y353 VanDerWaalsContact C-N 3.31Å; S351-Y353 PolarHBondContact O-N 3.08Å; Y353-A355 VanDerWaalsContact C-N 3.32Å; Y353-A355 PolarHBondContact O-N 3.45Å; Y353-Y357 PolarHBondContact O-N 3.27Å; Y353-Y357 VanDerWaalsContact O-N 3.16Å
354	L	90.4	Very high	90.9	Very high	40 Å²	40	44.1 Å²	44.1	21%	0.209	24%	0.24	C	C	.	.	H	α-helix	trans	-70.4	-28.5	-179.4	-60.9	178.5	0	0	0	112.5	Y320 F350 D356 L428	Y320-L354 HydrophobicContact CE2-CD1 4Å; Y320-L354 HydrophobicContact CE2-CD2 4.49Å; F350-L354 HydrophobicContact CB-CD1 3.92Å; F350-L354 HydrophobicContact CB-CG 3.95Å; F350-L354 WeakPolarHBondContact O-CG 3.15Å; F350-L354 PolarHBondContact O-N 3.5Å; L354-D356 PolarHBondContact O-N 3.33Å; L354-L428 HydrophobicContact CD2-CB 4.04Å; L354-L428 HydrophobicContact CD2-CD2 3.8Å
355	A	87	Confident	91.3	Very high	71 Å²	71	40.8 Å²	40.8	59%	0.587	22%	0.22	S	C	*	.	H	α-helix	trans	-64.1	-39	178.8	0	0	0	0	0	113.3	S351 Y353	S351-A355 PolarHBondContact O-N 3.08Å; Y353-A355 VanDerWaalsContact C-N 3.32Å; Y353-A355 PolarHBondContact O-N 3.45Å
356	D	87.8	Confident	91.6	Very high	76 Å²	76	45.6 Å²	45.6	41%	0.406	24%	0.238	S	C	.	.	H	α-helix	trans	-101	-2	-179.1	-75.3	-36.7	0	0	0	113.7	L354 I358 K359 K360	L354-D356 PolarHBondContact O-N 3.33Å; D356-I358 PolarHBondContact O-N 3.31Å; D356-K359 PolarHBondContact O-N 2.98Å; D356-K359 IonicContact OD1-NZ 3.17Å; D356-K359 PolarHBondContact OD1-NZ 3.25Å; D356-K360 PolarHBondContact O-N 3.47Å
357	Y	93.1	Very high	91.9	Very high	2 Å²	2	50.3 Å²	50.3	1%	0.008	26%	0.259	C	S	.	.	H	α-helix	trans	-50.1	-54.3	-177.8	159.8	-109.8	0	0	0	112.7	L313 L316 Y353 K359 K360 E361 R424 C425 L428	L313-Y357 HydrophobicContact CD2-CD2 4Å; L313-Y357 HydrophobicContact CD2-CE2 3.95Å; L316-Y357 HydrophobicContact CD2-CD2 4.23Å; Y353-Y357 PolarHBondContact O-N 3.27Å; Y353-Y357 VanDerWaalsContact O-N 3.16Å; Y357-K359 VanDerWaalsContact C-N 3.27Å; Y357-K359 PolarHBondContact O-N 3.33Å; Y357-K360 PolarHBondContact O-N 2.86Å; Y357-K360 VanDerWaalsContact O-N 3.1Å; Y357-E361 HydrophobicContact CE2-CB 4.02Å; Y357-E361 HydrophobicContact CE2-CG 4.35Å; Y357-E361 WeakPolarHBondContact CE2-OE2 3.27Å; Y357-E361 PolarHBondContact O-N 3.41Å; Y357-E361 PolarHBondContact OH-OE2 3.28Å; Y357-R424 HydrophobicContact CE2-CB 4.42Å; Y357-R424 VanDerWaalsContact OH-CB 3.3Å; Y357-R424 WeakPolarHBondContact OH-CB 3.31Å; Y357-C425 WeakPolarHBondContact OH-CA 3.3Å; Y357-C425 PolarHBondContact OH-N 2.85Å; Y357-C425 VanDerWaalsContact OH-N 3.12Å; Y357-L428 HydrophobicContact CD1-CB 3.99Å; Y357-L428 HydrophobicContact CD2-CB 4.47Å; Y357-L428 HydrophobicContact CD2-CD1 3.65Å; Y357-L428 HydrophobicContact CE1-CB 3.94Å; Y357-L428 HydrophobicContact CE1-CD1 4.41Å; Y357-L428 HydrophobicContact CE2-CB 4.42Å; Y357-L428 HydrophobicContact CE2-CD1 3.41Å; Y357-L428 VanDerWaalsContact CE2-CD1 3.41Å; Y357-L428 HydrophobicContact CG-CB 4.28Å; Y357-L428 HydrophobicContact CG-CD1 4.26Å
358	I	93.7	Very high	92.2	Very high	21 Å²	21	49.2 Å²	49.2	11%	0.108	25%	0.251	C	S	.	.	H	α-helix	trans	-65.5	-31.4	-173.9	-168.8	61.1	0	0	0	112.3	D356 T362 N437 I441	D356-I358 PolarHBondContact O-N 3.31Å; I358-T362 HydrophobicContact CD1-CG2 4.2Å; I358-T362 HydrophobicContact CG1-CG2 4.26Å; I358-T362 WeakPolarHBondContact O-CB 3.27Å; I358-T362 WeakPolarHBondContact O-CG2 3.17Å; I358-T362 PolarHBondContact O-N 3.49Å; I358-T362 PolarHBondContact O-OG1 3.44Å; I358-N437 HydrophobicContact CD1-CB 3.75Å; I358-N437 HydrophobicContact CG1-CB 4.04Å; I358-I441 HydrophobicContact CD1-CD1 4.31Å; I358-I441 HydrophobicContact CD1-CG1 4.3Å
359	K	93.2	Very high	92.4	Very high	127 Å²	127	47.1 Å²	47.1	55%	0.552	24%	0.238	S	C	*	.	H	α-helix	trans	-66.3	-44.4	174.8	-64.6	176.8	-170.9	158	0	110.7	D356 Y357 T362 V363	D356-K359 PolarHBondContact O-N 2.98Å; D356-K359 IonicContact OD1-NZ 3.17Å; D356-K359 PolarHBondContact OD1-NZ 3.25Å; Y357-K359 VanDerWaalsContact C-N 3.27Å; Y357-K359 PolarHBondContact O-N 3.33Å; K359-T362 PolarHBondContact O-OG1 3.19Å; K359-V363 VanDerWaalsContact O-CG2 3.26Å; K359-V363 WeakPolarHBondContact O-CG2 3.18Å; K359-V363 PolarHBondContact O-N 3.39Å; K359-V363 VanDerWaalsContact O-N 3.07Å
360	K	92.4	Very high	92.5	Very high	70 Å²	70	52.8 Å²	52.8	30%	0.304	26%	0.263	S	S	.	.	H	α-helix	trans	-65.3	-44.8	177.4	-70.2	-171.7	175.9	-172.1	0	112.1	M309 Y312 L313 D356 Y357 V363 Y364	M309-K360 HydrophobicContact CE-CB 3.65Å; M309-K360 HydrophobicContact CE-CD 4.13Å; M309-K360 HydrophobicContact CE-CG 3.87Å; Y312-K360 HydrophobicContact CD1-CD 4.18Å; Y312-K360 HydrophobicContact CE1-CD 3.46Å; Y312-K360 VanDerWaalsContact CE1-CD 3.46Å; Y312-K360 PolarHBondContact OH-NZ 3.44Å; L313-K360 HydrophobicContact CD2-CB 4.48Å; D356-K360 PolarHBondContact O-N 3.47Å; Y357-K360 PolarHBondContact O-N 2.86Å; Y357-K360 VanDerWaalsContact O-N 3.1Å; K360-V363 PolarHBondContact O-N 3.25Å; K360-Y364 WeakPolarHBondContact O-CB 3.24Å; K360-Y364 PolarHBondContact O-N 3.1Å
361	E	94.8	Very high	92.4	Very high	0 Å²	0	58.9 Å²	58.9	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-60.6	-47.3	177.1	-173.7	81	-130.3	0	0	111.2	L313 Y357 V363 Y364 L365 A421 R424	L313-E361 HydrophobicContact CD2-CB 4.5Å; Y357-E361 HydrophobicContact CE2-CB 4.02Å; Y357-E361 HydrophobicContact CE2-CG 4.35Å; Y357-E361 WeakPolarHBondContact CE2-OE2 3.27Å; Y357-E361 PolarHBondContact O-N 3.41Å; Y357-E361 PolarHBondContact OH-OE2 3.28Å; E361-V363 PolarHBondContact O-N 3.32Å; E361-Y364 PolarHBondContact O-N 3.43Å; E361-L365 VanDerWaalsContact O-CB 3.25Å; E361-L365 WeakPolarHBondContact O-CB 3.46Å; E361-L365 PolarHBondContact O-N 3.45Å; E361-A421 HydrophobicContact CG-CB 4.16Å; E361-A421 WeakPolarHBondContact OE1-CA 3.47Å; E361-A421 VanDerWaalsContact OE1-CB 3.26Å; E361-A421 WeakPolarHBondContact OE1-CB 3.47Å; E361-R424 IonicContact OE1-CZ 3.62Å; E361-R424 IonicContact OE1-NE 2.75Å; E361-R424 PolarHBondContact OE1-NE 3.07Å; E361-R424 VanDerWaalsContact OE1-NE 3.09Å; E361-R424 IonicContact OE1-NH2 3.48Å; E361-R424 PolarHBondContact OE1-NH2 3.03Å; E361-R424 IonicContact OE2-CZ 3.84Å; E361-R424 IonicContact OE2-NE 3.62Å; E361-R424 PolarHBondContact OE2-NE 2.94Å
362	T	94.2	Very high	92.5	Very high	4 Å²	4	56.2 Å²	56.2	3%	0.025	27%	0.271	C	S	.	.	H	α-helix	trans	-67.3	-34.3	179.8	54	0	0	0	0	113.1	I358 K359 R366 Q440 I444	I358-T362 HydrophobicContact CD1-CG2 4.2Å; I358-T362 HydrophobicContact CG1-CG2 4.26Å; I358-T362 WeakPolarHBondContact O-CB 3.27Å; I358-T362 WeakPolarHBondContact O-CG2 3.17Å; I358-T362 PolarHBondContact O-N 3.49Å; I358-T362 PolarHBondContact O-OG1 3.44Å; K359-T362 PolarHBondContact O-OG1 3.19Å; T362-R366 VanDerWaalsContact O-CG 3.25Å; T362-R366 WeakPolarHBondContact O-CG 3.44Å; T362-R366 PolarHBondContact O-N 3.41Å; T362-R366 VanDerWaalsContact O-N 3.16Å; T362-Q440 HydrophobicContact CG2-CB 4.09Å; T362-I444 HydrophobicContact CG2-CD1 3.8Å
363	V	94.3	Very high	92.6	Very high	66 Å²	66	50 Å²	50	40%	0.4	24%	0.244	S	C	.	.	H	α-helix	trans	-66.7	-51.4	173.8	170.6	0	0	0	0	110.7	K359 K360 E361 L365 R366 E367	K359-V363 VanDerWaalsContact O-CG2 3.26Å; K359-V363 WeakPolarHBondContact O-CG2 3.18Å; K359-V363 PolarHBondContact O-N 3.39Å; K359-V363 VanDerWaalsContact O-N 3.07Å; K360-V363 PolarHBondContact O-N 3.25Å; E361-V363 PolarHBondContact O-N 3.32Å; V363-L365 VanDerWaalsContact C-N 3.34Å; V363-L365 PolarHBondContact O-N 2.82Å; V363-R366 PolarHBondContact O-N 3.26Å; V363-E367 PolarHBondContact O-N 3.03Å; V363-E367 VanDerWaalsContact O-N 3.08Å
364	Y	94.6	Very high	92.5	Very high	3 Å²	3	53.5 Å²	53.5	1%	0.012	26%	0.262	C	S	.	.	H	α-helix	trans	-54.4	-50.2	177	169.6	-102.5	0	0	0	111.5	M309 E310 L313 K360 E361 R366 E367 Q368 E417	M309-Y364 HydrophobicContact CB-CD2 3.99Å; E310-Y364 HydrophobicContact CB-CE2 3.65Å; E310-Y364 WeakPolarHBondContact CB-OH 3.41Å; E310-Y364 HydrophobicContact CG-CE2 4.39Å; E310-Y364 VanDerWaalsContact CG-OH 3.29Å; E310-Y364 WeakPolarHBondContact CG-OH 3.43Å; E310-Y364 PolarHBondContact OE2-OH 2.97Å; L313-Y364 HydrophobicContact CD1-CD1 3.87Å; L313-Y364 HydrophobicContact CD1-CG 3.99Å; K360-Y364 WeakPolarHBondContact O-CB 3.24Å; K360-Y364 PolarHBondContact O-N 3.1Å; E361-Y364 PolarHBondContact O-N 3.43Å; Y364-R366 VanDerWaalsContact C-N 3.35Å; Y364-R366 PolarHBondContact O-N 3.38Å; Y364-E367 PolarHBondContact O-N 3.16Å; Y364-E367 VanDerWaalsContact O-N 3.15Å; Y364-Q368 HydrophobicContact CD1-CG 4.43Å; Y364-Q368 HydrophobicContact CD2-CG 4.07Å; Y364-Q368 HydrophobicContact CE1-CG 3.99Å; Y364-Q368 HydrophobicContact CE2-CG 3.61Å; Y364-Q368 HydrophobicContact CG-CG 4.47Å; Y364-Q368 WeakPolarHBondContact O-CG 3.41Å; Y364-Q368 PolarHBondContact O-N 3.41Å; Y364-E417 PolarHBondContact OH-OE2 2.95Å
365	L	95.2	Very high	92.5	Very high	0 Å²	0	58.3 Å²	58.3	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-63.2	-39.2	-177.1	-170.3	65.3	0	0	0	112.5	E361 V363 C369 E417 T418 A421 I441 I444	E361-L365 VanDerWaalsContact O-CB 3.25Å; E361-L365 WeakPolarHBondContact O-CB 3.46Å; E361-L365 PolarHBondContact O-N 3.45Å; V363-L365 VanDerWaalsContact C-N 3.34Å; V363-L365 PolarHBondContact O-N 2.82Å; L365-C369 VanDerWaalsContact O-CB 3.3Å; L365-C369 WeakPolarHBondContact O-CB 3.41Å; L365-C369 PolarHBondContact O-N 3.17Å; L365-C369 PolarHBondContact O-SG 3.04Å; L365-E417 HydrophobicContact CD1-CB 3.84Å; L365-T418 HydrophobicContact CD1-CG2 3.93Å; L365-T418 HydrophobicContact CD2-CG2 4.05Å; L365-T418 HydrophobicContact CG-CG2 4.35Å; L365-A421 HydrophobicContact CD1-CB 4.48Å; L365-A421 HydrophobicContact CD2-CB 4.22Å; L365-I441 HydrophobicContact CD2-CG2 3.89Å; L365-I444 HydrophobicContact CB-CG2 4.47Å; L365-I444 HydrophobicContact CD2-CB 4.13Å; L365-I444 HydrophobicContact CD2-CD1 4.15Å; L365-I444 HydrophobicContact CD2-CG2 3.83Å; L365-I444 HydrophobicContact CG-CG2 3.84Å
366	R	95.8	Very high	92.6	Very high	101 Å²	101	55.8 Å²	55.8	38%	0.381	26%	0.257	S	S	.	.	H	α-helix	trans	-63.2	-43.1	174.3	-74.5	-174.7	-164.4	109.7	1.6	111.8	T362 V363 Y364 K370 I444 Y448	T362-R366 VanDerWaalsContact O-CG 3.25Å; T362-R366 WeakPolarHBondContact O-CG 3.44Å; T362-R366 PolarHBondContact O-N 3.41Å; T362-R366 VanDerWaalsContact O-N 3.16Å; V363-R366 PolarHBondContact O-N 3.26Å; Y364-R366 VanDerWaalsContact C-N 3.35Å; Y364-R366 PolarHBondContact O-N 3.38Å; R366-K370 WeakPolarHBondContact O-CB 3.22Å; R366-K370 PolarHBondContact O-N 3.36Å; R366-I444 HydrophobicContact CG-CD1 3.99Å; R366-I444 HydrophobicContact CG-CG1 4.11Å; R366-I444 HydrophobicContact CG-CG2 4.25Å; R366-Y448 HydrophobicContact CB-CE2 4.28Å; R366-Y448 HydrophobicContact CG-CE2 4.04Å
367	E	93.6	Very high	92.5	Very high	117 Å²	117	52.6 Å²	52.6	55%	0.547	24%	0.239	S	C	.	.	H	α-helix	trans	-64.6	-45	179.2	-72.2	-178.5	165.8	0	0	111.5	V363 Y364 K370 F371	V363-E367 PolarHBondContact O-N 3.03Å; V363-E367 VanDerWaalsContact O-N 3.08Å; Y364-E367 PolarHBondContact O-N 3.16Å; Y364-E367 VanDerWaalsContact O-N 3.15Å; E367-K370 PolarHBondContact O-N 3.05Å; E367-F371 VanDerWaalsContact O-CB 3.25Å; E367-F371 WeakPolarHBondContact O-CB 3.41Å; E367-F371 PolarHBondContact O-N 3.35Å
368	Q	93.3	Very high	92.2	Very high	58 Å²	58	57.4 Å²	57.4	27%	0.271	27%	0.265	S	S	.	.	H	α-helix	trans	-64.5	-47.3	177.1	-65.4	-53.9	-27.7	0	0	112.4	Y364 K370 F371 A372 E417	Y364-Q368 HydrophobicContact CD1-CG 4.43Å; Y364-Q368 HydrophobicContact CD2-CG 4.07Å; Y364-Q368 HydrophobicContact CE1-CG 3.99Å; Y364-Q368 HydrophobicContact CE2-CG 3.61Å; Y364-Q368 HydrophobicContact CG-CG 4.47Å; Y364-Q368 WeakPolarHBondContact O-CG 3.41Å; Y364-Q368 PolarHBondContact O-N 3.41Å; Q368-K370 VanDerWaalsContact C-N 3.34Å; Q368-K370 PolarHBondContact O-N 3.09Å; Q368-F371 PolarHBondContact O-N 3.29Å; Q368-A372 WeakPolarHBondContact O-CB 3.36Å; Q368-A372 PolarHBondContact O-N 3.26Å; Q368-E417 HydrophobicContact CB-CG 4.41Å
369	C	93.7	Very high	91.8	Very high	1 Å²	1	60.8 Å²	60.8	1%	0.007	29%	0.29	C	S	.	.	H	α-helix	trans	-62	-42.6	178	-68.3	0	0	0	0	111.6	L365 L373 Y448	L365-C369 VanDerWaalsContact O-CB 3.3Å; L365-C369 WeakPolarHBondContact O-CB 3.41Å; L365-C369 PolarHBondContact O-N 3.17Å; L365-C369 PolarHBondContact O-SG 3.04Å; C369-L373 WeakPolarHBondContact O-CG 3.32Å; C369-L373 PolarHBondContact O-N 3.03Å; C369-L373 VanDerWaalsContact O-N 3.13Å; C369-Y448 HydrophobicContact CB-CD1 4.16Å; C369-Y448 HydrophobicContact CB-CD2 3.56Å; C369-Y448 HydrophobicContact CB-CE2 4.12Å; C369-Y448 HydrophobicContact CB-CG 3.59Å
370	K	92.8	Very high	91.2	Very high	124 Å²	124	57.8 Å²	57.8	54%	0.539	28%	0.277	S	S	.	.	H	α-helix	trans	-64.5	-44.8	176.5	-176.3	-176.6	177.5	-173.6	0	111.7	R366 E367 Q368 L373 Q374 Y448	R366-K370 WeakPolarHBondContact O-CB 3.22Å; R366-K370 PolarHBondContact O-N 3.36Å; E367-K370 PolarHBondContact O-N 3.05Å; Q368-K370 VanDerWaalsContact C-N 3.34Å; Q368-K370 PolarHBondContact O-N 3.09Å; K370-L373 PolarHBondContact O-N 3.36Å; K370-Q374 VanDerWaalsContact O-CB 3.27Å; K370-Q374 WeakPolarHBondContact O-CB 3.42Å; K370-Q374 PolarHBondContact O-N 3.42Å; K370-Y448 HydrophobicContact CB-CE1 4.19Å
371	F	91.9	Very high	90.3	Very high	127 Å²	127	56.6 Å²	56.6	56%	0.557	29%	0.285	S	S	*	.	H	α-helix	trans	-63	-44.4	178.9	179.1	-102.2	0	0	0	111.6	E367 Q368 L373 Q374 K375	E367-F371 VanDerWaalsContact O-CB 3.25Å; E367-F371 WeakPolarHBondContact O-CB 3.41Å; E367-F371 PolarHBondContact O-N 3.35Å; Q368-F371 PolarHBondContact O-N 3.29Å; F371-L373 PolarHBondContact O-N 3.44Å; F371-Q374 PolarHBondContact O-N 2.88Å; F371-K375 HydrophobicContact CE1-CD 4.33Å; F371-K375 VanDerWaalsContact O-CB 3.23Å; F371-K375 WeakPolarHBondContact O-CB 3.23Å; F371-K375 PolarHBondContact O-N 3.3Å
372	A	91	Very high	89.5	Confident	11 Å²	11	58.6 Å²	58.6	9%	0.091	29%	0.294	C	S	.	.	H	α-helix	trans	-58.6	-45.5	176.4	0	0	0	0	0	112	Q368 F376	Q368-A372 WeakPolarHBondContact O-CB 3.36Å; Q368-A372 PolarHBondContact O-N 3.26Å; A372-F376 PolarHBondContact O-N 2.64Å
373	L	90.2	Very high	88.5	Confident	4 Å²	4	63.1 Å²	63.1	2%	0.021	32%	0.322	C	S	.	.	H	α-helix	trans	-69	-43.9	177.4	-73.7	168.5	0	0	0	112.8	C369 K370 F371 F376 Y377 V410 I414 Y448 E452 H453	C369-L373 WeakPolarHBondContact O-CG 3.32Å; C369-L373 PolarHBondContact O-N 3.03Å; C369-L373 VanDerWaalsContact O-N 3.13Å; K370-L373 PolarHBondContact O-N 3.36Å; F371-L373 PolarHBondContact O-N 3.44Å; L373-F376 WeakPolarHBondContact O-CB 3.38Å; L373-F376 PolarHBondContact O-N 3.32Å; L373-Y377 HydrophobicContact CB-CD2 4.43Å; L373-Y377 HydrophobicContact CB-CE2 4.26Å; L373-Y377 HydrophobicContact CD2-CE2 4.19Å; L373-Y377 WeakPolarHBondContact O-CD2 3.35Å; L373-Y377 PolarHBondContact O-N 3.1Å; L373-V410 HydrophobicContact CD2-CG1 3.8Å; L373-V410 HydrophobicContact CG-CG1 4.43Å; L373-I414 HydrophobicContact CD1-CD1 4.4Å; L373-I414 HydrophobicContact CD2-CD1 4.22Å; L373-I414 HydrophobicContact CG-CD1 4.12Å; L373-Y448 HydrophobicContact CD1-CD1 3.63Å; L373-Y448 HydrophobicContact CD1-CG 4.23Å; L373-E452 HydrophobicContact CD1-CB 4.27Å; L373-H453 HydrophobicContact CD2-CB 3.68Å
374	Q	89.1	Confident	87.3	Confident	101 Å²	101	64.1 Å²	64.1	47%	0.472	32%	0.321	S	S	.	.	H	α-helix	trans	-62.7	-47	179.8	-177.3	171.6	-7.6	0	0	110.9	K370 F371 F376 Y377 D378	K370-Q374 VanDerWaalsContact O-CB 3.27Å; K370-Q374 WeakPolarHBondContact O-CB 3.42Å; K370-Q374 PolarHBondContact O-N 3.42Å; F371-Q374 PolarHBondContact O-N 2.88Å; Q374-F376 PolarHBondContact O-N 3.04Å; Q374-Y377 PolarHBondContact O-N 2.77Å; Q374-D378 WeakPolarHBondContact CG-OD2 3.44Å; Q374-D378 VanDerWaalsContact O-CB 3.31Å; Q374-D378 WeakPolarHBondContact O-CB 3.49Å; Q374-D378 PolarHBondContact O-N 3.14Å
375	K	90.2	Very high	85.8	Confident	141 Å²	141	70.4 Å²	70.4	61%	0.613	35%	0.348	S	S	*	.	H	α-helix	trans	-55.2	-40.6	174.7	-175.9	-178.7	177.5	-173	0	111.8	F371 S379	F371-K375 HydrophobicContact CE1-CD 4.33Å; F371-K375 VanDerWaalsContact O-CB 3.23Å; F371-K375 WeakPolarHBondContact O-CB 3.23Å; F371-K375 PolarHBondContact O-N 3.3Å; K375-S379 WeakPolarHBondContact O-CB 3.19Å; K375-S379 PolarHBondContact O-N 3.38Å
376	F	89.3	Confident	83.8	Confident	17 Å²	17	77.5 Å²	77.5	8%	0.075	39%	0.392	C	S	.	.	H	α-helix	trans	-65.8	-51.9	175.8	172	-107.6	0	0	0	112.6	A372 L373 Q374 D378 S379 K380 L405 V410 H453	A372-F376 PolarHBondContact O-N 2.64Å; L373-F376 WeakPolarHBondContact O-CB 3.38Å; L373-F376 PolarHBondContact O-N 3.32Å; Q374-F376 PolarHBondContact O-N 3.04Å; F376-D378 VanDerWaalsContact C-N 3.32Å; F376-D378 PolarHBondContact O-N 2.95Å; F376-S379 PolarHBondContact O-N 3.47Å; F376-S379 PolarHBondContact O-OG 3.3Å; F376-K380 HydrophobicContact CE2-CG 4.05Å; F376-K380 HydrophobicContact CZ-CG 4.16Å; F376-K380 PolarHBondContact O-N 2.91Å; F376-K380 VanDerWaalsContact O-N 3.12Å; F376-L405 WeakPolarHBondContact CE1-O 3.38Å; F376-V410 HydrophobicContact CB-CG2 3.64Å; F376-V410 HydrophobicContact CD1-CG2 4.45Å; F376-V410 HydrophobicContact CD2-CG2 3.78Å; F376-V410 HydrophobicContact CG-CG2 3.7Å; F376-H453 AromaticContact CE1-CE1 3.75Å
377	Y	86.9	Confident	81.4	Confident	9 Å²	9	76 Å²	76	4%	0.035	41%	0.408	C	S	.	.	H	α-helix	trans	-65.1	-36	-179.5	-70.7	-58.6	0	0	0	112.8	L373 Q374 K380 G381 H382 K384 E452 Y456	L373-Y377 HydrophobicContact CB-CD2 4.43Å; L373-Y377 HydrophobicContact CB-CE2 4.26Å; L373-Y377 HydrophobicContact CD2-CE2 4.19Å; L373-Y377 WeakPolarHBondContact O-CD2 3.35Å; L373-Y377 PolarHBondContact O-N 3.1Å; Q374-Y377 PolarHBondContact O-N 2.77Å; Y377-K380 CarbonylContact O-C 3.56Å; Y377-K380 PolarHBondContact O-N 3.42Å; Y377-G381 PolarHBondContact O-N 3.03Å; Y377-H382 HydrophobicContact CD1-CB 4.24Å; Y377-H382 AromaticContact CD1-CD2 3.7Å; Y377-H382 AromaticContact CE1-CD2 3.99Å; Y377-H382 PolarHBondContact O-N 3.47Å; Y377-K384 HydrophobicContact CE2-CD 4.45Å; Y377-E452 PolarHBondContact OH-O 3.19Å; Y377-E452 VanDerWaalsContact OH-O 3.05Å; Y377-Y456 HydrophobicContact CE1-CD1 4.29Å; Y377-Y456 HydrophobicContact CE1-CE1 4.18Å
378	D	85	Confident	79.4	Confident	104 Å²	104	74.4 Å²	74.4	56%	0.556	40%	0.399	S	S	*	.	H	α-helix	trans	-64.5	-42	173.9	-69.3	-16.2	0	0	0	110.8	Q374 F376 K380 G381	Q374-D378 WeakPolarHBondContact CG-OD2 3.44Å; Q374-D378 VanDerWaalsContact O-CB 3.31Å; Q374-D378 WeakPolarHBondContact O-CB 3.49Å; Q374-D378 PolarHBondContact O-N 3.14Å; F376-D378 VanDerWaalsContact C-N 3.32Å; F376-D378 PolarHBondContact O-N 2.95Å; D378-K380 PolarHBondContact O-N 2.9Å; D378-G381 PolarHBondContact O-N 3.39Å
379	S	85.4	Confident	77.1	Confident	91 Å²	91	75.4 Å²	75.4	64%	0.636	41%	0.413	S	S	*	.	H	α-helix	trans	-62.1	-30.3	175.8	78.3	0	0	0	0	113.1	K375 F376	K375-S379 WeakPolarHBondContact O-CB 3.19Å; K375-S379 PolarHBondContact O-N 3.38Å; F376-S379 PolarHBondContact O-N 3.47Å; F376-S379 PolarHBondContact O-OG 3.3Å
380	K	81.2	Confident	74.8	Confident	64 Å²	64	77.5 Å²	77.5	28%	0.278	44%	0.435	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.1	-4.6	175.3	-64.5	-70.2	171.1	178.5	0	113	F376 Y377 D378 H382 R400 E403	F376-K380 HydrophobicContact CE2-CG 4.05Å; F376-K380 HydrophobicContact CZ-CG 4.16Å; F376-K380 PolarHBondContact O-N 2.91Å; F376-K380 VanDerWaalsContact O-N 3.12Å; Y377-K380 CarbonylContact O-C 3.56Å; Y377-K380 PolarHBondContact O-N 3.42Å; D378-K380 PolarHBondContact O-N 2.9Å; K380-H382 HydrophobicContact CB-CB 4.46Å; K380-H382 PolarHBondContact O-N 3.25Å; K380-R400 PolarHBondContact O-NH1 2.85Å; K380-E403 VanDerWaalsContact CD-OE2 3.22Å; K380-E403 WeakPolarHBondContact CD-OE2 3.23Å; K380-E403 IonicContact NZ-OE1 3.34Å; K380-E403 IonicContact NZ-OE2 3.75Å; K380-E403 PolarHBondContact NZ-OE2 3.38Å
381	G	74	Confident	72.5	Confident	45 Å²	45	77.7 Å²	77.7	46%	0.464	44%	0.441	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.1	35.4	-173.7	0	0	0	0	0	112.8	Y377 D378 R400	Y377-G381 PolarHBondContact O-N 3.03Å; D378-G381 PolarHBondContact O-N 3.39Å; G381-R400 PolarHBondContact O-NH1 3.4Å
382	H	77.7	Confident	70.2	Confident	42 Å²	42	78 Å²	78	19%	0.194	44%	0.444	C	S	.	.			trans	-101.2	132.6	-179.1	-174.4	54.4	0	0	0	110.7	Y377 K380 L405 Y456	Y377-H382 HydrophobicContact CD1-CB 4.24Å; Y377-H382 AromaticContact CD1-CD2 3.7Å; Y377-H382 AromaticContact CE1-CD2 3.99Å; Y377-H382 PolarHBondContact O-N 3.47Å; K380-H382 HydrophobicContact CB-CB 4.46Å; K380-H382 PolarHBondContact O-N 3.25Å; H382-L405 HydrophobicContact CB-CD2 3.99Å; H382-Y456 AromaticContact CD2-CE1 3.77Å; H382-Y456 AromaticContact NE2-CE1 3.3Å; H382-Y456 VanDerWaalsContact NE2-CE1 3.3Å; H382-Y456 WeakPolarHBondContact NE2-CE1 3.26Å; H382-Y456 AromaticContact NE2-CZ 3.45Å; H382-Y456 PolarHBondContact NE2-OH 3.02Å
383	T	74.2	Confident	68.1	Low	100 Å²	100	77.5 Å²	77.5	61%	0.613	44%	0.44	S	S	*	.			trans	-109.4	124.2	174.4	49.6	0	0	0	0	109.3	K385	T383-K385 PolarHBondContact O-N 3.02Å; T383-K385 VanDerWaalsContact O-N 3.15Å
384	K	69.1	Low	66	Low	86 Å²	86	82 Å²	82	37%	0.374	46%	0.456	S	S	.	.			trans	-63.4	116.6	178	-68.9	-169.9	178.5	-171.8	0	109.7	Y377 E452 Y456	Y377-K384 HydrophobicContact CE2-CD 4.45Å; K384-E452 PolarHBondContact NZ-O 2.98Å; K384-E452 IonicContact NZ-OE2 3.47Å; K384-E452 PolarHBondContact NZ-OE2 3.29Å; K384-Y456 WeakPolarHBondContact CA-OH 3.26Å; K384-Y456 HydrophobicContact CG-CE1 4.05Å
385	K	62.8	Low	63.8	Low	135 Å²	135	82.6 Å²	82.6	59%	0.587	46%	0.462	S	S	*	.			trans	-110.4	125.9	173.9	-71.4	-175.1	-180	177.7	0	109.9	T383	T383-K385 PolarHBondContact O-N 3.02Å; T383-K385 VanDerWaalsContact O-N 3.15Å
386	T	51.9	Low	61.6	Low	150 Å²	150	79.1 Å²	79.1	92%	0.92	46%	0.455	S	S	*	.	S	Bend	trans	-80.5	112.7	171.8	47.6	0	0	0	0	109.5
387	G	47.2	Very low	59.6	Low	70 Å²	70	80.4 Å²	80.4	72%	0.722	46%	0.463	S	S	*	.			trans	99.9	102.6	173.6	0	0	0	0	0	113.7
388	F	49.8	Very low	57.6	Low	82 Å²	82	86.3 Å²	86.3	36%	0.36	49%	0.491	S	S	.	.			trans	-92.5	116.1	174.7	-90.5	-75.4	0	0	0	111.1	A393 V460	F388-A393 HydrophobicContact CD1-CB 3.23Å; F388-A393 HydrophobicContact CE1-CB 3.39Å; F388-A393 HydrophobicContact CG-CB 4.22Å; F388-A393 HydrophobicContact CZ-CB 4.48Å; F388-V460 HydrophobicContact CE2-CG2 3.85Å; F388-V460 HydrophobicContact CZ-CG2 4.27Å
389	S	45.9	Very low	55.5	Low	79 Å²	79	85.9 Å²	85.9	55%	0.552	50%	0.496	S	S	*	.			trans	-83.6	125.1	153	-174.7	0	0	0	0	107.6	I391 Q392	S389-I391 PolarHBondContact O-N 2.9Å; S389-Q392 PolarHBondContact O-N 3.04Å
390	G	45.1	Very low	53.7	Low	46 Å²	46	89.4 Å²	89.4	47%	0.474	50%	0.495	S	S	.	.	H	α-helix	trans	-58.1	-13.3	-164.1	0	0	0	0	0	116.9
391	I	45	Very low	51.7	Low	128 Å²	128	88.3 Å²	88.3	66%	0.656	50%	0.495	S	S	*	.	H	α-helix	trans	-85.8	-36.9	178.7	-60.4	168.8	0	0	0	111.2	S389 R394 L395	S389-I391 PolarHBondContact O-N 2.9Å; I391-R394 PolarHBondContact O-N 3.34Å; I391-L395 HydrophobicContact CG2-CD1 3.96Å; I391-L395 WeakPolarHBondContact O-CD1 3.13Å; I391-L395 PolarHBondContact O-N 3.46Å
392	Q	43.4	Very low	50.6	Low	134 Å²	134	93.8 Å²	93.8	63%	0.626	51%	0.514	S	S	*	.	H	α-helix	trans	-73.2	-27.5	179.1	-103.3	172.8	-19.9	0	0	112.8	S389 S396	S389-Q392 PolarHBondContact O-N 3.04Å; Q392-S396 PolarHBondContact O-N 3.11Å; Q392-S396 PolarHBondContact O-OG 3.03Å
393	A	47	Very low	49.8	Very low	0 Å²	0	98.1 Å²	98.1	0%	0	53%	0.534	C	S	.	.	H	α-helix	trans	-65.4	-46.3	172.9	0	0	0	0	0	112.1	F388 S396 L397	F388-A393 HydrophobicContact CD1-CB 3.23Å; F388-A393 HydrophobicContact CE1-CB 3.39Å; F388-A393 HydrophobicContact CG-CB 4.22Å; F388-A393 HydrophobicContact CZ-CB 4.48Å; A393-S396 PolarHBondContact O-N 3.13Å; A393-S396 PolarHBondContact O-OG 2.96Å; A393-L397 PolarHBondContact O-N 2.91Å; A393-L397 VanDerWaalsContact O-N 3.09Å
394	R	45.9	Very low	49.5	Very low	99 Å²	99	94.8 Å²	94.8	37%	0.374	52%	0.515	S	S	.	.	H	α-helix	trans	-62.7	-46.3	178.6	-76.1	173.8	104.1	164.9	1.7	111.4	I391 S396 L397 E398	I391-R394 PolarHBondContact O-N 3.34Å; R394-S396 PolarHBondContact O-N 3.47Å; R394-L397 PolarHBondContact O-N 3.17Å; R394-E398 WeakPolarHBondContact O-CB 3.11Å; R394-E398 VanDerWaalsContact O-CG 3.27Å; R394-E398 WeakPolarHBondContact O-CG 3.37Å; R394-E398 PolarHBondContact O-N 3.43Å
395	L	42.9	Very low	50.1	Low	113 Å²	113	92.1 Å²	92.1	59%	0.592	51%	0.505	S	S	*	.	H	α-helix	trans	-65	-22.3	179.4	-77.5	157.7	0	0	0	114.6	I391	I391-L395 HydrophobicContact CG2-CD1 3.96Å; I391-L395 WeakPolarHBondContact O-CD1 3.13Å; I391-L395 PolarHBondContact O-N 3.46Å
396	S	43	Very low	51.2	Low	67 Å²	67	85.8 Å²	85.8	47%	0.469	48%	0.477	S	S	.	.	H	α-helix	trans	-95.1	-21.8	177.4	41.1	0	0	0	0	113.6	Q392 A393 R394	Q392-S396 PolarHBondContact O-N 3.11Å; Q392-S396 PolarHBondContact O-OG 3.03Å; A393-S396 PolarHBondContact O-N 3.13Å; A393-S396 PolarHBondContact O-OG 2.96Å; R394-S396 PolarHBondContact O-N 3.47Å
397	L	49.1	Very low	52.8	Low	44 Å²	44	79.6 Å²	79.6	23%	0.23	44%	0.44	C	S	.	.	H	α-helix	trans	-83.5	-35.4	170.3	-105.3	93.2	0	0	0	113.1	A393 R394 S399 R400 C401 V460 A464	A393-L397 PolarHBondContact O-N 2.91Å; A393-L397 VanDerWaalsContact O-N 3.09Å; R394-L397 PolarHBondContact O-N 3.17Å; L397-S399 PolarHBondContact O-N 3.16Å; L397-R400 PolarHBondContact O-N 3.3Å; L397-C401 PolarHBondContact O-N 3.49Å; L397-C401 PolarHBondContact O-SG 3.44Å; L397-C401 VanDerWaalsContact O-SG 3.33Å; L397-V460 HydrophobicContact CD1-CG1 3.96Å; L397-A464 HydrophobicContact CD2-CB 3.57Å
398	E	43.1	Very low	54.8	Low	134 Å²	134	79.1 Å²	79.1	63%	0.626	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-16.6	-176.5	-84.1	172.6	-179	0	0	114	R394	R394-E398 WeakPolarHBondContact O-CB 3.11Å; R394-E398 VanDerWaalsContact O-CG 3.27Å; R394-E398 WeakPolarHBondContact O-CG 3.37Å; R394-E398 PolarHBondContact O-N 3.43Å
399	S	41.5	Very low	56.6	Low	95 Å²	95	82.7 Å²	82.7	66%	0.664	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.9	0.2	177.6	68	0	0	0	0	115.8	L397	L397-S399 PolarHBondContact O-N 3.16Å
400	R	47.2	Very low	58.8	Low	164 Å²	164	79.6 Å²	79.6	62%	0.619	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-141.5	19.9	-177.9	-75	-175.2	173.3	171.8	-1	114.2	K380 G381 L397 N402	K380-R400 PolarHBondContact O-NH1 2.85Å; G381-R400 PolarHBondContact O-NH1 3.4Å; L397-R400 PolarHBondContact O-N 3.3Å; R400-N402 VanDerWaalsContact C-N 3.26Å; R400-N402 PolarHBondContact O-N 2.89Å
401	C	40.7	Very low	61	Low	42 Å²	42	77.4 Å²	77.4	28%	0.284	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.8	11.2	-155.6	-122.3	0	0	0	0	120.6	L397	L397-C401 PolarHBondContact O-N 3.49Å; L397-C401 PolarHBondContact O-SG 3.44Å; L397-C401 VanDerWaalsContact O-SG 3.33Å
402	N	51.1	Low	63.3	Low	160 Å²	160	75.3 Å²	75.3	86%	0.856	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118.5	-4.7	-178.3	-82.3	-7.6	0	0	0	116.3	R400	R400-N402 VanDerWaalsContact C-N 3.26Å; R400-N402 PolarHBondContact O-N 2.89Å
403	E	59.7	Low	65.6	Low	132 Å²	132	72.4 Å²	72.4	62%	0.617	37%	0.37	S	S	*	.			trans	-106.1	123.6	-178	-62.5	-164.5	160	0	0	112.5	K380	K380-E403 VanDerWaalsContact CD-OE2 3.22Å; K380-E403 WeakPolarHBondContact CD-OE2 3.23Å; K380-E403 IonicContact NZ-OE1 3.34Å; K380-E403 IonicContact NZ-OE2 3.75Å; K380-E403 PolarHBondContact NZ-OE2 3.38Å
404	S	68.5	Low	67.9	Low	31 Å²	31	72.5 Å²	72.5	22%	0.217	37%	0.371	C	S	.	.			trans	-67.9	136.6	172.8	57.6	0	0	0	0	110.6	L406 Q484	S404-L406 PolarHBondContact O-N 3.49Å; S404-L406 PolarHBondContact OG-O 3.1Å; S404-Q484 VanDerWaalsContact OG-CD 3.28Å; S404-Q484 PolarHBondContact OG-NE2 3.2Å; S404-Q484 VanDerWaalsContact OG-NE2 3.14Å; S404-Q484 PolarHBondContact OG-OE1 3.03Å
405	L	81.4	Confident	70.2	Confident	29 Å²	29	68.4 Å²	68.4	15%	0.152	36%	0.356	C	S	.	.	S	Bend	trans	-75.9	19.7	170.4	-70.5	172.9	0	0	0	112.5	F376 H382 A457 V460	F376-L405 WeakPolarHBondContact CE1-O 3.38Å; H382-L405 HydrophobicContact CB-CD2 3.99Å; L405-A457 HydrophobicContact CB-CB 4.17Å; L405-V460 HydrophobicContact CD1-CB 4.15Å; L405-V460 HydrophobicContact CD1-CG1 3.78Å; L405-V460 HydrophobicContact CD1-CG2 4.26Å
406	L	85.3	Confident	72.6	Confident	3 Å²	3	68.3 Å²	68.3	2%	0.016	35%	0.353	C	S	.	.			trans	-125.2	129.9	-176.6	-167.5	66.3	0	0	0	108.6	S404 V454 A457 L481 Q484 A485 I488	S404-L406 PolarHBondContact O-N 3.49Å; S404-L406 PolarHBondContact OG-O 3.1Å; L406-V454 HydrophobicContact CD1-CB 4.47Å; L406-V454 HydrophobicContact CD1-CG2 4.03Å; L406-A457 HydrophobicContact CB-CB 4.12Å; L406-A457 HydrophobicContact CD1-CB 4.15Å; L406-L481 HydrophobicContact CD2-CG 4.24Å; L406-Q484 HydrophobicContact CD2-CB 3.65Å; L406-Q484 HydrophobicContact CG-CB 4.2Å; L406-Q484 PolarHBondContact O-OE1 3.23Å; L406-Q484 VanDerWaalsContact O-OE1 3.05Å; L406-A485 HydrophobicContact CD2-CB 3.81Å; L406-I488 HydrophobicContact CD1-CD1 3.61Å; L406-I488 HydrophobicContact CD2-CD1 3.99Å; L406-I488 HydrophobicContact CG-CD1 3.63Å
407	S	86.9	Confident	75	Confident	20 Å²	20	66.3 Å²	66.3	14%	0.14	34%	0.336	C	S	.	.			trans	-130.1	124.9	-180	171.2	0	0	0	0	110.3	E409 V410 A411 H453	S407-E409 VanDerWaalsContact C-N 3.32Å; S407-E409 PolarHBondContact OG-N 3.33Å; S407-V410 PolarHBondContact OG-N 2.91Å; S407-A411 PolarHBondContact O-N 2.81Å; S407-H453 PolarHBondContact N-NE2 3.02Å; S407-H453 PolarHBondContact O-NE2 3.26Å; S407-H453 VanDerWaalsContact O-NE2 3.14Å
408	E	87.6	Confident	77.2	Confident	60 Å²	60	64.2 Å²	64.2	28%	0.28	33%	0.325	S	S	.	.	H	α-helix	trans	-66.7	-33.8	173.5	-65.7	175.5	-148.7	0	0	111	A411 I412 R483 A487 I488	E408-A411 WeakPolarHBondContact O-CB 3.1Å; E408-A411 PolarHBondContact O-N 3.47Å; E408-I412 VanDerWaalsContact O-CG1 3.28Å; E408-I412 WeakPolarHBondContact O-CG1 3.04Å; E408-I412 PolarHBondContact O-N 3.34Å; E408-R483 IonicContact OE1-NH1 3.7Å; E408-A487 HydrophobicContact CG-CB 4.47Å; E408-I488 HydrophobicContact CG-CG1 4.34Å
409	E	88.5	Confident	79.7	Confident	157 Å²	157	63.9 Å²	63.9	73%	0.734	32%	0.321	S	S	*	.	H	α-helix	trans	-63.2	-44.7	177.7	-173.5	-173.4	174.2	0	0	111.8	S407 A411 I412 N413	S407-E409 VanDerWaalsContact C-N 3.32Å; S407-E409 PolarHBondContact OG-N 3.33Å; E409-A411 VanDerWaalsContact C-N 3.3Å; E409-A411 PolarHBondContact O-N 3.32Å; E409-I412 PolarHBondContact O-N 2.92Å; E409-N413 WeakPolarHBondContact O-CB 3.09Å; E409-N413 PolarHBondContact O-N 3.27Å
410	V	91.4	Very high	82.1	Confident	13 Å²	13	62.6 Å²	62.6	8%	0.079	31%	0.305	C	S	.	.	H	α-helix	trans	-63.8	-40	176.4	178	0	0	0	0	110.6	L373 F376 S407 N413 I414	L373-V410 HydrophobicContact CD2-CG1 3.8Å; L373-V410 HydrophobicContact CG-CG1 4.43Å; F376-V410 HydrophobicContact CB-CG2 3.64Å; F376-V410 HydrophobicContact CD1-CG2 4.45Å; F376-V410 HydrophobicContact CD2-CG2 3.78Å; F376-V410 HydrophobicContact CG-CG2 3.7Å; S407-V410 PolarHBondContact OG-N 2.91Å; V410-N413 PolarHBondContact O-N 3.43Å; V410-I414 HydrophobicContact CG1-CD1 3.98Å; V410-I414 WeakPolarHBondContact O-CG1 3.04Å; V410-I414 PolarHBondContact O-N 3.09Å
411	A	92.4	Very high	84.4	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-63.1	-47.9	176	0	0	0	0	0	111.6	S407 E408 E409 N413 I414 L415 L449 I488	S407-A411 PolarHBondContact O-N 2.81Å; E408-A411 WeakPolarHBondContact O-CB 3.1Å; E408-A411 PolarHBondContact O-N 3.47Å; E409-A411 VanDerWaalsContact C-N 3.3Å; E409-A411 PolarHBondContact O-N 3.32Å; A411-N413 VanDerWaalsContact C-N 3.3Å; A411-N413 PolarHBondContact O-N 3.45Å; A411-I414 PolarHBondContact O-N 3.22Å; A411-L415 VanDerWaalsContact O-CB 3.32Å; A411-L415 WeakPolarHBondContact O-CB 3.38Å; A411-L415 WeakPolarHBondContact O-CG 3.46Å; A411-L415 PolarHBondContact O-N 3.13Å; A411-L449 HydrophobicContact CB-CD1 3.62Å; A411-I488 HydrophobicContact CB-CB 4.39Å; A411-I488 HydrophobicContact CB-CD1 3.89Å; A411-I488 HydrophobicContact CB-CG1 3.68Å; A411-I488 HydrophobicContact CB-CG2 3.9Å
412	I	92.3	Very high	87	Confident	84 Å²	84	53 Å²	53	43%	0.431	26%	0.263	S	S	.	.	H	α-helix	trans	-59.1	-42.2	176.9	-69.2	164.4	0	0	0	110.8	E408 E409 L415 Q416 L491	E408-I412 VanDerWaalsContact O-CG1 3.28Å; E408-I412 WeakPolarHBondContact O-CG1 3.04Å; E408-I412 PolarHBondContact O-N 3.34Å; E409-I412 PolarHBondContact O-N 2.92Å; I412-L415 PolarHBondContact O-N 3.46Å; I412-Q416 VanDerWaalsContact O-CB 3.29Å; I412-Q416 WeakPolarHBondContact O-CB 3.31Å; I412-Q416 PolarHBondContact O-N 3.44Å; I412-L491 HydrophobicContact CD1-CD1 4.43Å; I412-L491 HydrophobicContact CG1-CD1 3.86Å
413	N	93	Very high	89	Confident	74 Å²	74	51.5 Å²	51.5	40%	0.396	25%	0.246	S	C	.	.	H	α-helix	trans	-62.1	-49.5	177.8	-167	9.9	0	0	0	111.8	E409 V410 A411 L415 Q416 E417	E409-N413 WeakPolarHBondContact O-CB 3.09Å; E409-N413 PolarHBondContact O-N 3.27Å; V410-N413 PolarHBondContact O-N 3.43Å; A411-N413 VanDerWaalsContact C-N 3.3Å; A411-N413 PolarHBondContact O-N 3.45Å; N413-L415 VanDerWaalsContact C-N 3.33Å; N413-L415 PolarHBondContact O-N 2.68Å; N413-Q416 PolarHBondContact O-N 3.26Å; N413-E417 WeakPolarHBondContact O-CG 2.94Å; N413-E417 PolarHBondContact O-N 2.71Å
414	I	94.4	Very high	90.6	Very high	2 Å²	2	45.6 Å²	45.6	1%	0.01	22%	0.218	C	C	.	.	H	α-helix	trans	-60.5	-42.1	176.3	-67.2	168.8	0	0	0	111.5	L373 V410 A411 Q416 T418 L445 L449	L373-I414 HydrophobicContact CD1-CD1 4.4Å; L373-I414 HydrophobicContact CD2-CD1 4.22Å; L373-I414 HydrophobicContact CG-CD1 4.12Å; V410-I414 HydrophobicContact CG1-CD1 3.98Å; V410-I414 WeakPolarHBondContact O-CG1 3.04Å; V410-I414 PolarHBondContact O-N 3.09Å; A411-I414 PolarHBondContact O-N 3.22Å; I414-Q416 VanDerWaalsContact C-N 3.34Å; I414-T418 HydrophobicContact CG2-CG2 4.46Å; I414-T418 WeakPolarHBondContact O-CB 3.35Å; I414-T418 VanDerWaalsContact O-CG2 3.27Å; I414-T418 WeakPolarHBondContact O-CG2 3.25Å; I414-T418 PolarHBondContact O-N 3.02Å; I414-T418 PolarHBondContact O-OG1 2.89Å; I414-L445 HydrophobicContact CG2-CD1 3.87Å; I414-L449 HydrophobicContact CG2-CB 4.21Å
415	L	94.4	Very high	91.8	Very high	13 Å²	13	44.1 Å²	44.1	7%	0.068	21%	0.208	C	C	.	.	H	α-helix	trans	-64.3	-38.7	177.1	-70.8	171.4	0	0	0	111.3	A411 I412 N413 T418 K419 L445 L449 L491 Q495	A411-L415 VanDerWaalsContact O-CB 3.32Å; A411-L415 WeakPolarHBondContact O-CB 3.38Å; A411-L415 WeakPolarHBondContact O-CG 3.46Å; A411-L415 PolarHBondContact O-N 3.13Å; I412-L415 PolarHBondContact O-N 3.46Å; N413-L415 VanDerWaalsContact C-N 3.33Å; N413-L415 PolarHBondContact O-N 2.68Å; L415-T418 WeakPolarHBondContact CA-OG1 3.27Å; L415-T418 PolarHBondContact O-OG1 2.97Å; L415-K419 WeakPolarHBondContact O-CB 3.41Å; L415-K419 PolarHBondContact O-N 3.37Å; L415-L445 HydrophobicContact CD2-CD1 3.91Å; L415-L449 HydrophobicContact CD1-CD2 4.44Å; L415-L449 HydrophobicContact CD2-CD2 3.61Å; L415-L449 HydrophobicContact CG-CD2 3.97Å; L415-L491 HydrophobicContact CD1-CB 3.53Å; L415-L491 HydrophobicContact CD1-CD1 4.44Å; L415-Q495 HydrophobicContact CD2-CB 4.36Å; L415-Q495 PolarHBondContact O-NE2 3.46Å; L415-Q495 PolarHBondContact O-OE1 2.82Å; L415-Q495 VanDerWaalsContact O-OE1 3.08Å
416	Q	93.7	Very high	92.2	Very high	111 Å²	111	44.9 Å²	44.9	52%	0.519	22%	0.215	S	C	.	.	H	α-helix	trans	-67.1	-45.9	177.3	-174.8	138.1	-25.1	0	0	112.4	I412 N413 I414 T418 K419 Q420	I412-Q416 VanDerWaalsContact O-CB 3.29Å; I412-Q416 WeakPolarHBondContact O-CB 3.31Å; I412-Q416 PolarHBondContact O-N 3.44Å; N413-Q416 PolarHBondContact O-N 3.26Å; I414-Q416 VanDerWaalsContact C-N 3.34Å; Q416-T418 PolarHBondContact O-N 3.34Å; Q416-K419 WeakPolarHBondContact O-CB 3.29Å; Q416-K419 PolarHBondContact O-N 3.09Å; Q416-Q420 WeakPolarHBondContact O-CG 3.4Å; Q416-Q420 PolarHBondContact O-N 2.9Å; Q416-Q420 VanDerWaalsContact O-N 3.07Å
417	E	93.7	Very high	92.5	Very high	25 Å²	25	46.7 Å²	46.7	12%	0.117	23%	0.225	C	C	.	.	H	α-helix	trans	-59.5	-46.6	175.6	-71.6	-55.6	145.2	0	0	111.8	Y364 L365 Q368 N413 K419 Q420 A421	Y364-E417 PolarHBondContact OH-OE2 2.95Å; L365-E417 HydrophobicContact CD1-CB 3.84Å; Q368-E417 HydrophobicContact CB-CG 4.41Å; N413-E417 WeakPolarHBondContact O-CG 2.94Å; N413-E417 PolarHBondContact O-N 2.71Å; E417-K419 PolarHBondContact O-N 3.28Å; E417-Q420 PolarHBondContact O-N 3.26Å; E417-A421 PolarHBondContact O-N 3.39Å
418	T	94.7	Very high	92.7	Very high	0 Å²	0	46 Å²	46	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-68.8	-33.1	178.8	52.5	0	0	0	0	112.2	L365 I414 L415 Q416 A421 F422 L445 Q495	L365-T418 HydrophobicContact CD1-CG2 3.93Å; L365-T418 HydrophobicContact CD2-CG2 4.05Å; L365-T418 HydrophobicContact CG-CG2 4.35Å; I414-T418 HydrophobicContact CG2-CG2 4.46Å; I414-T418 WeakPolarHBondContact O-CB 3.35Å; I414-T418 VanDerWaalsContact O-CG2 3.27Å; I414-T418 WeakPolarHBondContact O-CG2 3.25Å; I414-T418 PolarHBondContact O-N 3.02Å; I414-T418 PolarHBondContact O-OG1 2.89Å; L415-T418 WeakPolarHBondContact CA-OG1 3.27Å; L415-T418 PolarHBondContact O-OG1 2.97Å; Q416-T418 PolarHBondContact O-N 3.34Å; T418-A421 PolarHBondContact O-N 3.2Å; T418-F422 WeakPolarHBondContact O-CD2 3.11Å; T418-F422 WeakPolarHBondContact O-CG 3.24Å; T418-F422 PolarHBondContact O-N 2.97Å; T418-L445 HydrophobicContact CG2-CB 3.83Å; T418-L445 HydrophobicContact CG2-CD1 3.96Å; T418-L445 HydrophobicContact CG2-CG 4.34Å; T418-Q495 PolarHBondContact OG1-NE2 2.71Å
419	K	94.6	Very high	92.8	Very high	127 Å²	127	43.8 Å²	43.8	55%	0.552	21%	0.211	S	C	*	.	H	α-helix	trans	-62.9	-44	173.5	-179.8	178.8	179.9	177.6	0	111.5	L415 Q416 E417 A421 F422 Y423	L415-K419 WeakPolarHBondContact O-CB 3.41Å; L415-K419 PolarHBondContact O-N 3.37Å; Q416-K419 WeakPolarHBondContact O-CB 3.29Å; Q416-K419 PolarHBondContact O-N 3.09Å; E417-K419 PolarHBondContact O-N 3.28Å; K419-A421 VanDerWaalsContact C-N 3.34Å; K419-F422 PolarHBondContact O-N 3.14Å; K419-Y423 PolarHBondContact O-N 3.24Å
420	Q	93.4	Very high	92.6	Very high	68 Å²	68	39.3 Å²	39.3	32%	0.318	20%	0.197	S	C	.	.	H	α-helix	trans	-63.7	-40.7	174.4	-66.7	-174.7	14.1	0	0	111.8	Q416 E417 Y423 R424	Q416-Q420 WeakPolarHBondContact O-CG 3.4Å; Q416-Q420 PolarHBondContact O-N 2.9Å; Q416-Q420 VanDerWaalsContact O-N 3.07Å; E417-Q420 PolarHBondContact O-N 3.26Å; Q420-Y423 WeakPolarHBondContact O-CB 3.42Å; Q420-Y423 PolarHBondContact O-N 3Å; Q420-R424 WeakPolarHBondContact O-CG 3.3Å; Q420-R424 PolarHBondContact O-N 2.63Å
421	A	94.9	Very high	92	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-61.7	-43.7	175.5	0	0	0	0	0	112.2	E361 L365 E417 T418 K419 Y423 R424 C425 I441	E361-A421 HydrophobicContact CG-CB 4.16Å; E361-A421 WeakPolarHBondContact OE1-CA 3.47Å; E361-A421 VanDerWaalsContact OE1-CB 3.26Å; E361-A421 WeakPolarHBondContact OE1-CB 3.47Å; L365-A421 HydrophobicContact CD1-CB 4.48Å; L365-A421 HydrophobicContact CD2-CB 4.22Å; E417-A421 PolarHBondContact O-N 3.39Å; T418-A421 PolarHBondContact O-N 3.2Å; K419-A421 VanDerWaalsContact C-N 3.34Å; A421-Y423 VanDerWaalsContact C-N 3.34Å; A421-Y423 PolarHBondContact O-N 3.07Å; A421-R424 PolarHBondContact O-N 3.45Å; A421-C425 WeakPolarHBondContact O-CB 3.37Å; A421-C425 PolarHBondContact O-N 2.66Å; A421-I441 HydrophobicContact CB-CD1 4.16Å; A421-I441 HydrophobicContact CB-CG2 4.03Å
422	F	94.7	Very high	91.4	Very high	3 Å²	3	53.4 Å²	53.4	1%	0.013	27%	0.273	C	S	.	.	H	α-helix	trans	-62.5	-40.1	174.3	-71.7	-54.5	0	0	0	112.2	T418 K419 C425 S426 V438 I441 L442 L445 V500 L503	T418-F422 WeakPolarHBondContact O-CD2 3.11Å; T418-F422 WeakPolarHBondContact O-CG 3.24Å; T418-F422 PolarHBondContact O-N 2.97Å; K419-F422 PolarHBondContact O-N 3.14Å; F422-C425 PolarHBondContact O-N 3.17Å; F422-S426 PolarHBondContact O-N 3.46Å; F422-V438 HydrophobicContact CD1-CG1 4.49Å; F422-V438 HydrophobicContact CE1-CG1 4.05Å; F422-I441 HydrophobicContact CD1-CB 4.25Å; F422-I441 HydrophobicContact CD1-CD1 4.4Å; F422-I441 HydrophobicContact CD1-CG2 3.86Å; F422-I441 HydrophobicContact CD2-CG2 4.42Å; F422-I441 HydrophobicContact CE1-CB 3.72Å; F422-I441 HydrophobicContact CE1-CG2 3.46Å; F422-I441 VanDerWaalsContact CE1-CG2 3.46Å; F422-I441 HydrophobicContact CE2-CG2 4.08Å; F422-I441 HydrophobicContact CG-CG2 4.31Å; F422-I441 HydrophobicContact CZ-CB 4.2Å; F422-I441 HydrophobicContact CZ-CG2 3.58Å; F422-L442 HydrophobicContact CZ-CB 4.3Å; F422-L442 HydrophobicContact CZ-CD1 4.32Å; F422-L445 HydrophobicContact CE2-CD2 4.43Å; F422-V500 HydrophobicContact CD1-CG2 4.32Å; F422-V500 HydrophobicContact CD2-CG2 4.13Å; F422-V500 HydrophobicContact CE1-CG2 3.9Å; F422-V500 HydrophobicContact CE2-CG2 3.69Å; F422-V500 HydrophobicContact CG-CG2 4.44Å; F422-V500 HydrophobicContact CZ-CG2 3.57Å; F422-L503 HydrophobicContact CB-CD1 4.37Å; F422-L503 HydrophobicContact CD1-CD1 4.49Å
423	Y	93.1	Very high	91.1	Very high	129 Å²	129	51.4 Å²	51.4	51%	0.506	27%	0.267	S	S	.	.	H	α-helix	trans	-61.1	-49.7	174.3	176.6	-101.7	0	0	0	112	Q321 K419 Q420 A421 C425 S426 L427	Q321-Y423 PolarHBondContact NE2-OH 3.26Å; K419-Y423 PolarHBondContact O-N 3.24Å; Q420-Y423 WeakPolarHBondContact O-CB 3.42Å; Q420-Y423 PolarHBondContact O-N 3Å; A421-Y423 VanDerWaalsContact C-N 3.34Å; A421-Y423 PolarHBondContact O-N 3.07Å; Y423-C425 VanDerWaalsContact C-N 3.33Å; Y423-C425 PolarHBondContact O-N 2.66Å; Y423-S426 WeakPolarHBondContact O-CB 3.47Å; Y423-S426 PolarHBondContact O-N 2.59Å; Y423-S426 PolarHBondContact O-OG 2.96Å; Y423-L427 HydrophobicContact CD1-CD1 4.07Å; Y423-L427 HydrophobicContact CE1-CD1 3.55Å; Y423-L427 HydrophobicContact CE2-CD1 4.14Å; Y423-L427 PolarHBondContact O-N 2.72Å
424	R	94	Very high	90.8	Very high	9 Å²	9	49.1 Å²	49.1	3%	0.034	25%	0.254	C	S	.	.	H	α-helix	trans	-60.3	-42.6	175.7	-70.8	-172	-73.4	-105.9	-2	111.5	C317 Y357 E361 Q420 A421 S426 L427 L428	C317-R424 HydrophobicContact CB-CG 4.37Å; Y357-R424 HydrophobicContact CE2-CB 4.42Å; Y357-R424 VanDerWaalsContact OH-CB 3.3Å; Y357-R424 WeakPolarHBondContact OH-CB 3.31Å; E361-R424 IonicContact OE1-CZ 3.62Å; E361-R424 IonicContact OE1-NE 2.75Å; E361-R424 PolarHBondContact OE1-NE 3.07Å; E361-R424 VanDerWaalsContact OE1-NE 3.09Å; E361-R424 IonicContact OE1-NH2 3.48Å; E361-R424 PolarHBondContact OE1-NH2 3.03Å; E361-R424 IonicContact OE2-CZ 3.84Å; E361-R424 IonicContact OE2-NE 3.62Å; E361-R424 PolarHBondContact OE2-NE 2.94Å; Q420-R424 WeakPolarHBondContact O-CG 3.3Å; Q420-R424 PolarHBondContact O-N 2.63Å; A421-R424 PolarHBondContact O-N 3.45Å; R424-S426 VanDerWaalsContact C-N 3.29Å; R424-S426 PolarHBondContact O-N 2.7Å; R424-L427 PolarHBondContact O-N 2.73Å; R424-L427 VanDerWaalsContact O-N 3.12Å; R424-L428 HydrophobicContact CB-CD1 4.31Å; R424-L428 WeakPolarHBondContact O-CB 3.48Å; R424-L428 WeakPolarHBondContact O-CG 3.36Å; R424-L428 PolarHBondContact O-N 3.4Å
425	C	92.9	Very high	90.5	Very high	0 Å²	0	50 Å²	50	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-60.8	-37.7	177.9	-176.2	0	0	0	0	112.1	Y357 A421 F422 Y423 L427 S429 I441	Y357-C425 WeakPolarHBondContact OH-CA 3.3Å; Y357-C425 PolarHBondContact OH-N 2.85Å; Y357-C425 VanDerWaalsContact OH-N 3.12Å; A421-C425 WeakPolarHBondContact O-CB 3.37Å; A421-C425 PolarHBondContact O-N 2.66Å; F422-C425 PolarHBondContact O-N 3.17Å; Y423-C425 VanDerWaalsContact C-N 3.33Å; Y423-C425 PolarHBondContact O-N 2.66Å; C425-L427 PolarHBondContact O-N 2.67Å; C425-S429 WeakPolarHBondContact O-CB 3.33Å; C425-S429 PolarHBondContact O-N 3.39Å; C425-S429 VanDerWaalsContact O-N 3.08Å; C425-S429 PolarHBondContact O-OG 2.78Å; C425-S429 VanDerWaalsContact O-OG 3.07Å; C425-S429 PolarHBondContact SG-OG 2.82Å; C425-I441 HydrophobicContact CB-CD1 3.7Å
426	S	91	Very high	90.2	Very high	44 Å²	44	53.2 Å²	53.2	31%	0.308	27%	0.274	S	S	.	.	H	α-helix	trans	-64.1	-27.8	177.4	80.9	0	0	0	0	113.9	F422 Y423 R424	F422-S426 PolarHBondContact O-N 3.46Å; Y423-S426 WeakPolarHBondContact O-CB 3.47Å; Y423-S426 PolarHBondContact O-N 2.59Å; Y423-S426 PolarHBondContact O-OG 2.96Å; R424-S426 VanDerWaalsContact C-N 3.29Å; R424-S426 PolarHBondContact O-N 2.7Å
427	L	90.2	Very high	90.2	Very high	41 Å²	41	48.6 Å²	48.6	22%	0.215	25%	0.253	C	S	.	.	H	α-helix	trans	-94.6	-42.8	-176.6	-68.3	163.3	0	0	0	112.3	C317 Y320 Q321 Y423 R424 C425	C317-L427 VanDerWaalsContact SG-CD1 3.53Å; Y320-L427 WeakPolarHBondContact CE1-O 3.41Å; Q321-L427 HydrophobicContact CG-CD1 4.35Å; Q321-L427 HydrophobicContact CG-CD2 4.49Å; Y423-L427 HydrophobicContact CD1-CD1 4.07Å; Y423-L427 HydrophobicContact CE1-CD1 3.55Å; Y423-L427 HydrophobicContact CE2-CD1 4.14Å; Y423-L427 PolarHBondContact O-N 2.72Å; R424-L427 PolarHBondContact O-N 2.73Å; R424-L427 VanDerWaalsContact O-N 3.12Å; C425-L427 PolarHBondContact O-N 2.67Å
428	L	91.8	Very high	90.1	Very high	5 Å²	5	47.4 Å²	47.4	3%	0.026	25%	0.247	C	C	.	.	H	α-helix	trans	-93.7	-23	-169.4	-62.8	172	0	0	0	113.3	L316 Y320 L354 Y357 R424	L316-L428 HydrophobicContact CD2-CD1 4.19Å; L316-L428 HydrophobicContact CG-CD1 4.33Å; L316-L428 HydrophobicContact CG-CD2 4.31Å; Y320-L428 HydrophobicContact CD1-CD2 3.97Å; Y320-L428 HydrophobicContact CD2-CD2 4.21Å; Y320-L428 HydrophobicContact CG-CD2 3.74Å; L354-L428 HydrophobicContact CD2-CB 4.04Å; L354-L428 HydrophobicContact CD2-CD2 3.8Å; Y357-L428 HydrophobicContact CD1-CB 3.99Å; Y357-L428 HydrophobicContact CD2-CB 4.47Å; Y357-L428 HydrophobicContact CD2-CD1 3.65Å; Y357-L428 HydrophobicContact CE1-CB 3.94Å; Y357-L428 HydrophobicContact CE1-CD1 4.41Å; Y357-L428 HydrophobicContact CE2-CB 4.42Å; Y357-L428 HydrophobicContact CE2-CD1 3.41Å; Y357-L428 VanDerWaalsContact CE2-CD1 3.41Å; Y357-L428 HydrophobicContact CG-CB 4.28Å; Y357-L428 HydrophobicContact CG-CD1 4.26Å; R424-L428 HydrophobicContact CB-CD1 4.31Å; R424-L428 WeakPolarHBondContact O-CB 3.48Å; R424-L428 WeakPolarHBondContact O-CG 3.36Å; R424-L428 PolarHBondContact O-N 3.4Å
429	S	89.5	Confident	89.9	Confident	14 Å²	14	53.2 Å²	53.2	10%	0.098	27%	0.269	C	S	.	.	S	Bend	trans	-81.9	142.2	-179.8	-60.1	0	0	0	0	112.3	C425 N437	C425-S429 WeakPolarHBondContact O-CB 3.33Å; C425-S429 PolarHBondContact O-N 3.39Å; C425-S429 VanDerWaalsContact O-N 3.08Å; C425-S429 PolarHBondContact O-OG 2.78Å; C425-S429 VanDerWaalsContact O-OG 3.07Å; C425-S429 PolarHBondContact SG-OG 2.82Å; S429-N437 PolarHBondContact OG-ND2 3.05Å
430	S	84	Confident	89.8	Confident	64 Å²	64	49.9 Å²	49.9	45%	0.448	26%	0.256	S	S	.	.			trans	-66.2	153.6	168.8	79.7	0	0	0	0	111.2	V432 S433 M434	S430-V432 PolarHBondContact O-N 3.39Å; S430-S433 PolarHBondContact O-N 3.01Å; S430-S433 PolarHBondContact O-OG 3.36Å; S430-S433 PolarHBondContact OG-N 3.49Å; S430-S433 PolarHBondContact OG-OG 3.44Å; S430-M434 WeakPolarHBondContact O-CB 3.46Å; S430-M434 PolarHBondContact O-N 2.91Å
431	M	78.6	Confident	89.9	Confident	166 Å²	166	46.6 Å²	46.6	82%	0.818	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-27.9	176.3	-72.9	-163.2	-73.9	0	0	113.2
432	V	81	Confident	89.7	Confident	143 Å²	143	47 Å²	47	87%	0.867	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.9	-39.1	-179	-176.7	0	0	0	0	111.5	S430	S430-V432 PolarHBondContact O-N 3.39Å
433	S	85.2	Confident	89.6	Confident	41 Å²	41	50 Å²	50	29%	0.287	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.9	-1	-178.7	65.4	0	0	0	0	113.7	S430 V435 E436 N437	S430-S433 PolarHBondContact O-N 3.01Å; S430-S433 PolarHBondContact O-OG 3.36Å; S430-S433 PolarHBondContact OG-N 3.49Å; S430-S433 PolarHBondContact OG-OG 3.44Å; S433-V435 PolarHBondContact O-N 3.12Å; S433-E436 PolarHBondContact O-N 3.37Å; S433-N437 WeakPolarHBondContact O-CB 3.29Å; S433-N437 PolarHBondContact O-N 2.73Å; S433-N437 PolarHBondContact O-OD1 2.85Å
434	M	87.9	Confident	89.6	Confident	27 Å²	27	44 Å²	44	13%	0.133	24%	0.24	C	C	.	.	H	α-helix	trans	-60.8	-47.6	-171.3	-173.3	168.3	-70.5	0	0	112.7	S430 E436 N437 V438	S430-M434 WeakPolarHBondContact O-CB 3.46Å; S430-M434 PolarHBondContact O-N 2.91Å; M434-E436 VanDerWaalsContact C-N 3.35Å; M434-E436 PolarHBondContact O-N 2.93Å; M434-N437 PolarHBondContact O-N 3.4Å; M434-V438 HydrophobicContact CG-CG2 4.47Å; M434-V438 WeakPolarHBondContact O-CB 3.43Å; M434-V438 VanDerWaalsContact O-CG2 3.25Å; M434-V438 WeakPolarHBondContact O-CG2 3.22Å; M434-V438 PolarHBondContact O-N 3.08Å
435	V	87.7	Confident	89.6	Confident	20 Å²	20	43.5 Å²	43.5	12%	0.121	24%	0.238	C	C	.	.	H	α-helix	trans	-62.2	-44.2	-178.5	-178.4	0	0	0	0	111	S433 V438 R439 L504 C507 E509	S433-V435 PolarHBondContact O-N 3.12Å; V435-V438 PolarHBondContact O-N 3.37Å; V435-R439 WeakPolarHBondContact O-CB 3.47Å; V435-R439 PolarHBondContact O-N 3.22Å; V435-L504 HydrophobicContact CB-CD2 4.38Å; V435-L504 HydrophobicContact CG1-CD2 4.24Å; V435-L504 HydrophobicContact CG2-CD2 4.09Å; V435-C507 HydrophobicContact CG2-CB 3.63Å; V435-E509 HydrophobicContact CG1-CB 4.27Å
436	E	88.7	Confident	89.5	Confident	80 Å²	80	44.3 Å²	44.3	37%	0.374	24%	0.243	S	C	.	.	H	α-helix	trans	-67.9	-40.1	-179.3	-179.2	54	-153.7	0	0	112.3	S433 M434 R439 Q440	S433-E436 PolarHBondContact O-N 3.37Å; M434-E436 VanDerWaalsContact C-N 3.35Å; M434-E436 PolarHBondContact O-N 2.93Å; E436-R439 WeakPolarHBondContact O-CB 3.21Å; E436-R439 PolarHBondContact O-N 3.11Å; E436-R439 IonicContact OE1-CZ 3.17Å; E436-R439 IonicContact OE1-NE 2.79Å; E436-R439 IonicContact OE1-NH2 2.6Å; E436-R439 PolarHBondContact OE1-NH2 2.9Å; E436-R439 IonicContact OE2-CZ 2.9Å; E436-R439 VanDerWaalsContact OE2-CZ 3.31Å; E436-R439 IonicContact OE2-NE 2.69Å; E436-R439 PolarHBondContact OE2-NE 3.16Å; E436-R439 IonicContact OE2-NH2 2.96Å; E436-R439 PolarHBondContact OE2-NH2 2.82Å; E436-Q440 WeakPolarHBondContact O-CG 3.47Å; E436-Q440 PolarHBondContact O-N 3.24Å; E436-Q440 VanDerWaalsContact O-N 3.09Å
437	N	92.3	Very high	89.5	Confident	14 Å²	14	45.8 Å²	45.8	8%	0.075	25%	0.245	C	C	.	.	H	α-helix	trans	-66.5	-43.1	176.2	-69.9	-6.2	0	0	0	111.5	I358 S429 S433 M434 R439 Q440 I441	I358-N437 HydrophobicContact CD1-CB 3.75Å; I358-N437 HydrophobicContact CG1-CB 4.04Å; S429-N437 PolarHBondContact OG-ND2 3.05Å; S433-N437 WeakPolarHBondContact O-CB 3.29Å; S433-N437 PolarHBondContact O-N 2.73Å; S433-N437 PolarHBondContact O-OD1 2.85Å; M434-N437 PolarHBondContact O-N 3.4Å; N437-R439 VanDerWaalsContact C-N 3.33Å; N437-R439 PolarHBondContact O-N 3.44Å; N437-Q440 PolarHBondContact O-N 2.94Å; N437-I441 PolarHBondContact O-N 3.49Å
438	V	92.4	Very high	89.6	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-61.5	-41.8	174.6	168.9	0	0	0	0	110.9	F422 M434 V435 Q440 I441 L442 V500 L503 L504	F422-V438 HydrophobicContact CD1-CG1 4.49Å; F422-V438 HydrophobicContact CE1-CG1 4.05Å; M434-V438 HydrophobicContact CG-CG2 4.47Å; M434-V438 WeakPolarHBondContact O-CB 3.43Å; M434-V438 VanDerWaalsContact O-CG2 3.25Å; M434-V438 WeakPolarHBondContact O-CG2 3.22Å; M434-V438 PolarHBondContact O-N 3.08Å; V435-V438 PolarHBondContact O-N 3.37Å; V438-Q440 VanDerWaalsContact C-N 3.33Å; V438-Q440 PolarHBondContact O-N 3.38Å; V438-I441 PolarHBondContact O-N 2.89Å; V438-L442 VanDerWaalsContact O-CB 3.27Å; V438-L442 WeakPolarHBondContact O-CB 3.43Å; V438-L442 PolarHBondContact O-N 2.84Å; V438-V500 HydrophobicContact CG1-CG1 3.87Å; V438-L503 HydrophobicContact CG2-CB 4.33Å; V438-L503 HydrophobicContact CG2-CD1 3.93Å; V438-L504 HydrophobicContact CB-CD2 4.45Å; V438-L504 HydrophobicContact CG1-CD1 4.26Å; V438-L504 HydrophobicContact CG1-CD2 4.23Å; V438-L504 HydrophobicContact CG1-CG 4.36Å
439	R	90.6	Very high	89.6	Confident	122 Å²	122	44.5 Å²	44.5	46%	0.46	24%	0.237	S	C	.	.	H	α-helix	trans	-59.7	-40.8	176.2	-171	-179.9	72.9	88.1	-1.6	112.3	V435 E436 N437 L442 S443	V435-R439 WeakPolarHBondContact O-CB 3.47Å; V435-R439 PolarHBondContact O-N 3.22Å; E436-R439 WeakPolarHBondContact O-CB 3.21Å; E436-R439 PolarHBondContact O-N 3.11Å; E436-R439 IonicContact OE1-CZ 3.17Å; E436-R439 IonicContact OE1-NE 2.79Å; E436-R439 IonicContact OE1-NH2 2.6Å; E436-R439 PolarHBondContact OE1-NH2 2.9Å; E436-R439 IonicContact OE2-CZ 2.9Å; E436-R439 VanDerWaalsContact OE2-CZ 3.31Å; E436-R439 IonicContact OE2-NE 2.69Å; E436-R439 PolarHBondContact OE2-NE 3.16Å; E436-R439 IonicContact OE2-NH2 2.96Å; E436-R439 PolarHBondContact OE2-NH2 2.82Å; N437-R439 VanDerWaalsContact C-N 3.33Å; N437-R439 PolarHBondContact O-N 3.44Å; R439-L442 PolarHBondContact O-N 3.13Å; R439-S443 WeakPolarHBondContact O-CB 3.43Å; R439-S443 PolarHBondContact O-N 3.42Å
440	Q	92.2	Very high	89.6	Confident	57 Å²	57	44 Å²	44	27%	0.266	23%	0.234	S	C	.	.	H	α-helix	trans	-65	-44.2	176.6	-72.9	178.9	62.2	0	0	112.5	T362 E436 N437 V438 S443 I444	T362-Q440 HydrophobicContact CG2-CB 4.09Å; E436-Q440 WeakPolarHBondContact O-CG 3.47Å; E436-Q440 PolarHBondContact O-N 3.24Å; E436-Q440 VanDerWaalsContact O-N 3.09Å; N437-Q440 PolarHBondContact O-N 2.94Å; V438-Q440 VanDerWaalsContact C-N 3.33Å; V438-Q440 PolarHBondContact O-N 3.38Å; Q440-S443 PolarHBondContact O-N 2.98Å; Q440-I444 WeakPolarHBondContact O-CG1 3.21Å; Q440-I444 PolarHBondContact O-N 3.38Å
441	I	94.7	Very high	89.8	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-65.2	-43	176.9	-62.6	170.2	0	0	0	110.4	I358 L365 A421 F422 C425 N437 V438 S443 I444 L445	I358-I441 HydrophobicContact CD1-CD1 4.31Å; I358-I441 HydrophobicContact CD1-CG1 4.3Å; L365-I441 HydrophobicContact CD2-CG2 3.89Å; A421-I441 HydrophobicContact CB-CD1 4.16Å; A421-I441 HydrophobicContact CB-CG2 4.03Å; F422-I441 HydrophobicContact CD1-CB 4.25Å; F422-I441 HydrophobicContact CD1-CD1 4.4Å; F422-I441 HydrophobicContact CD1-CG2 3.86Å; F422-I441 HydrophobicContact CD2-CG2 4.42Å; F422-I441 HydrophobicContact CE1-CB 3.72Å; F422-I441 HydrophobicContact CE1-CG2 3.46Å; F422-I441 VanDerWaalsContact CE1-CG2 3.46Å; F422-I441 HydrophobicContact CE2-CG2 4.08Å; F422-I441 HydrophobicContact CG-CG2 4.31Å; F422-I441 HydrophobicContact CZ-CB 4.2Å; F422-I441 HydrophobicContact CZ-CG2 3.58Å; C425-I441 HydrophobicContact CB-CD1 3.7Å; N437-I441 PolarHBondContact O-N 3.49Å; V438-I441 PolarHBondContact O-N 2.89Å; I441-S443 VanDerWaalsContact C-N 3.33Å; I441-S443 PolarHBondContact O-N 3.04Å; I441-I444 WeakPolarHBondContact O-CB 3.5Å; I441-I444 PolarHBondContact O-N 3.49Å; I441-I444 VanDerWaalsContact O-N 3.14Å; I441-L445 PolarHBondContact O-N 3.36Å
442	L	91.7	Very high	90.2	Very high	8 Å²	8	41.2 Å²	41.2	4%	0.042	21%	0.212	C	C	.	.	H	α-helix	trans	-65	-35.9	178.4	-171.7	61	0	0	0	112.5	F422 V438 R439 I444 L445 T446 I496 C513 A517	F422-L442 HydrophobicContact CZ-CB 4.3Å; F422-L442 HydrophobicContact CZ-CD1 4.32Å; V438-L442 VanDerWaalsContact O-CB 3.27Å; V438-L442 WeakPolarHBondContact O-CB 3.43Å; V438-L442 PolarHBondContact O-N 2.84Å; R439-L442 PolarHBondContact O-N 3.13Å; L442-I444 VanDerWaalsContact C-N 3.3Å; L442-I444 PolarHBondContact O-N 2.87Å; L442-L445 HydrophobicContact CD1-CD2 4.32Å; L442-L445 PolarHBondContact O-N 3.39Å; L442-T446 WeakPolarHBondContact O-CB 3.35Å; L442-T446 WeakPolarHBondContact O-CG2 3.35Å; L442-T446 PolarHBondContact O-N 2.78Å; L442-T446 PolarHBondContact O-OG1 2.87Å; L442-I496 HydrophobicContact CD1-CD1 3.5Å; L442-C513 WeakPolarHBondContact CD2-SG 3.15Å; L442-A517 HydrophobicContact CD1-CB 4.02Å; L442-A517 HydrophobicContact CD2-CB 3.71Å; L442-A517 HydrophobicContact CG-CB 4.06Å
443	S	91.4	Very high	90.6	Very high	65 Å²	65	34.4 Å²	34.4	46%	0.455	17%	0.17	S	C	.	.	H	α-helix	trans	-62.6	-36.1	172.6	-177	0	0	0	0	112.3	R439 Q440 I441 T446 Q447	R439-S443 WeakPolarHBondContact O-CB 3.43Å; R439-S443 PolarHBondContact O-N 3.42Å; Q440-S443 PolarHBondContact O-N 2.98Å; I441-S443 VanDerWaalsContact C-N 3.33Å; I441-S443 PolarHBondContact O-N 3.04Å; S443-T446 WeakPolarHBondContact CA-OG1 3.45Å; S443-T446 PolarHBondContact O-OG1 2.99Å; S443-T446 VanDerWaalsContact O-OG1 3.1Å; S443-Q447 VanDerWaalsContact O-CB 3.25Å; S443-Q447 WeakPolarHBondContact O-CB 3.29Å; S443-Q447 PolarHBondContact O-N 2.82Å
444	I	93.5	Very high	90.8	Very high	3 Å²	3	32.7 Å²	32.7	2%	0.015	16%	0.158	C	C	.	.	H	α-helix	trans	-70.6	-47	176.9	-66.7	167	0	0	0	109.9	T362 L365 R366 Q440 I441 L442 T446 Q447 Y448	T362-I444 HydrophobicContact CG2-CD1 3.8Å; L365-I444 HydrophobicContact CB-CG2 4.47Å; L365-I444 HydrophobicContact CD2-CB 4.13Å; L365-I444 HydrophobicContact CD2-CD1 4.15Å; L365-I444 HydrophobicContact CD2-CG2 3.83Å; L365-I444 HydrophobicContact CG-CG2 3.84Å; R366-I444 HydrophobicContact CG-CD1 3.99Å; R366-I444 HydrophobicContact CG-CG1 4.11Å; R366-I444 HydrophobicContact CG-CG2 4.25Å; Q440-I444 WeakPolarHBondContact O-CG1 3.21Å; Q440-I444 PolarHBondContact O-N 3.38Å; I441-I444 WeakPolarHBondContact O-CB 3.5Å; I441-I444 PolarHBondContact O-N 3.49Å; I441-I444 VanDerWaalsContact O-N 3.14Å; L442-I444 VanDerWaalsContact C-N 3.3Å; L442-I444 PolarHBondContact O-N 2.87Å; I444-T446 PolarHBondContact O-N 3.28Å; I444-Q447 PolarHBondContact O-N 3.17Å; I444-Y448 HydrophobicContact CG2-CD2 3.69Å; I444-Y448 HydrophobicContact CG2-CE2 3.87Å; I444-Y448 VanDerWaalsContact O-CD2 3.31Å; I444-Y448 WeakPolarHBondContact O-CD2 3.45Å; I444-Y448 PolarHBondContact O-N 2.88Å
445	L	93.6	Very high	90.8	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-55.4	-50.4	176.4	173.5	58.1	0	0	0	111.3	I414 L415 T418 F422 I441 L442 L449 F492	I414-L445 HydrophobicContact CG2-CD1 3.87Å; L415-L445 HydrophobicContact CD2-CD1 3.91Å; T418-L445 HydrophobicContact CG2-CB 3.83Å; T418-L445 HydrophobicContact CG2-CD1 3.96Å; T418-L445 HydrophobicContact CG2-CG 4.34Å; F422-L445 HydrophobicContact CE2-CD2 4.43Å; I441-L445 PolarHBondContact O-N 3.36Å; L442-L445 HydrophobicContact CD1-CD2 4.32Å; L442-L445 PolarHBondContact O-N 3.39Å; L445-L449 HydrophobicContact CD1-CB 4Å; L445-L449 HydrophobicContact CD1-CD2 3.85Å; L445-L449 WeakPolarHBondContact O-CB 3.38Å; L445-L449 PolarHBondContact O-N 3.07Å; L445-F492 HydrophobicContact CD2-CD2 4.11Å; L445-F492 HydrophobicContact CD2-CE2 3.83Å; L445-F492 HydrophobicContact CG-CD2 4.3Å; L445-F492 HydrophobicContact CG-CE2 3.96Å
446	T	90.7	Very high	90.8	Very high	16 Å²	16	32.9 Å²	32.9	10%	0.098	16%	0.156	C	C	.	.	I	π-helix	trans	-66.7	-37.3	-178.9	48.9	0	0	0	0	112.9	L442 S443 I444 C450 H451 F492 L520	L442-T446 WeakPolarHBondContact O-CB 3.35Å; L442-T446 WeakPolarHBondContact O-CG2 3.35Å; L442-T446 PolarHBondContact O-N 2.78Å; L442-T446 PolarHBondContact O-OG1 2.87Å; S443-T446 WeakPolarHBondContact CA-OG1 3.45Å; S443-T446 PolarHBondContact O-OG1 2.99Å; S443-T446 VanDerWaalsContact O-OG1 3.1Å; I444-T446 PolarHBondContact O-N 3.28Å; T446-C450 WeakPolarHBondContact O-CA 3.31Å; T446-C450 WeakPolarHBondContact O-CB 3.36Å; T446-C450 PolarHBondContact O-N 3.05Å; T446-C450 VanDerWaalsContact O-N 3.13Å; T446-H451 PolarHBondContact O-N 2.93Å; T446-H451 VanDerWaalsContact O-N 3.11Å; T446-F492 HydrophobicContact CG2-CE2 4.2Å; T446-F492 HydrophobicContact CG2-CZ 4.04Å; T446-L520 HydrophobicContact CG2-CD1 3.68Å
447	Q	91.3	Very high	90.7	Very high	75 Å²	75	29.1 Å²	29.1	35%	0.35	14%	0.139	S	C	.	.	I	π-helix	trans	-61.9	-53.2	174.7	179.9	-176.7	-18	0	0	111.8	S443 I444 H451 E452	S443-Q447 VanDerWaalsContact O-CB 3.25Å; S443-Q447 WeakPolarHBondContact O-CB 3.29Å; S443-Q447 PolarHBondContact O-N 2.82Å; I444-Q447 PolarHBondContact O-N 3.17Å; Q447-H451 WeakPolarHBondContact O-CB 3.37Å; Q447-H451 PolarHBondContact O-N 3.21Å; Q447-E452 PolarHBondContact NE2-OE1 2.82Å; Q447-E452 WeakPolarHBondContact O-CB 3.24Å; Q447-E452 PolarHBondContact O-N 3.26Å
448	Y	92.5	Very high	90.3	Very high	19 Å²	19	28.5 Å²	28.5	8%	0.075	14%	0.135	C	C	.	.	I	π-helix	trans	-80.9	-41.1	-172.2	-72	-70.6	0	0	0	113.4	R366 C369 K370 L373 I444 H453	R366-Y448 HydrophobicContact CB-CE2 4.28Å; R366-Y448 HydrophobicContact CG-CE2 4.04Å; C369-Y448 HydrophobicContact CB-CD1 4.16Å; C369-Y448 HydrophobicContact CB-CD2 3.56Å; C369-Y448 HydrophobicContact CB-CE2 4.12Å; C369-Y448 HydrophobicContact CB-CG 3.59Å; K370-Y448 HydrophobicContact CB-CE1 4.19Å; L373-Y448 HydrophobicContact CD1-CD1 3.63Å; L373-Y448 HydrophobicContact CD1-CG 4.23Å; I444-Y448 HydrophobicContact CG2-CD2 3.69Å; I444-Y448 HydrophobicContact CG2-CE2 3.87Å; I444-Y448 VanDerWaalsContact O-CD2 3.31Å; I444-Y448 WeakPolarHBondContact O-CD2 3.45Å; I444-Y448 PolarHBondContact O-N 2.88Å; Y448-H453 WeakPolarHBondContact O-CB 3.08Å; Y448-H453 PolarHBondContact O-N 2.93Å
449	L	92.1	Very high	90	Very high	1 Å²	1	31.9 Å²	31.9	1%	0.005	15%	0.153	C	C	.	.	I	π-helix	trans	-80.7	-53.1	-179.6	-175.4	63	0	0	0	112	A411 I414 L415 L445 H453 V454 I488 F492	A411-L449 HydrophobicContact CB-CD1 3.62Å; I414-L449 HydrophobicContact CG2-CB 4.21Å; L415-L449 HydrophobicContact CD1-CD2 4.44Å; L415-L449 HydrophobicContact CD2-CD2 3.61Å; L415-L449 HydrophobicContact CG-CD2 3.97Å; L445-L449 HydrophobicContact CD1-CB 4Å; L445-L449 HydrophobicContact CD1-CD2 3.85Å; L445-L449 WeakPolarHBondContact O-CB 3.38Å; L445-L449 PolarHBondContact O-N 3.07Å; L449-H453 WeakPolarHBondContact O-CB 3.37Å; L449-V454 VanDerWaalsContact O-CG2 3.25Å; L449-V454 WeakPolarHBondContact O-CG2 3.39Å; L449-V454 PolarHBondContact O-N 3.03Å; L449-I488 HydrophobicContact CD1-CG2 3.95Å; L449-I488 HydrophobicContact CD2-CG2 4.41Å; L449-I488 HydrophobicContact CG-CG2 4.32Å; L449-F492 HydrophobicContact CD2-CB 4.42Å; L449-F492 HydrophobicContact CD2-CD2 3.97Å
450	C	88.6	Confident	89.5	Confident	3 Å²	3	26.4 Å²	26.4	2%	0.02	13%	0.134	C	C	.	.	I	π-helix	trans	-77.6	-57.1	-174.4	-53.9	0	0	0	0	111.3	T446 V454 E455	T446-C450 WeakPolarHBondContact O-CA 3.31Å; T446-C450 WeakPolarHBondContact O-CB 3.36Å; T446-C450 PolarHBondContact O-N 3.05Å; T446-C450 VanDerWaalsContact O-N 3.13Å; C450-V454 PolarHBondContact O-N 3.03Å; C450-E455 WeakPolarHBondContact O-CB 3.44Å; C450-E455 WeakPolarHBondContact O-CG 3.42Å; C450-E455 PolarHBondContact O-N 3.15Å
451	H	88.1	Confident	88.9	Confident	116 Å²	116	24.4 Å²	24.4	54%	0.537	13%	0.127	S	C	.	.	I	π-helix	trans	-77.6	-51.3	-172.1	-170.4	59.2	0	0	0	113.2	T446 Q447 E455 Y456	T446-H451 PolarHBondContact O-N 2.93Å; T446-H451 VanDerWaalsContact O-N 3.11Å; Q447-H451 WeakPolarHBondContact O-CB 3.37Å; Q447-H451 PolarHBondContact O-N 3.21Å; H451-E455 IonicContact CE1-OE2 2.69Å; H451-E455 IonicContact CG-OE2 2.74Å; H451-E455 IonicContact ND1-OE2 3.31Å; H451-E455 PolarHBondContact ND1-OE2 3.41Å; H451-Y456 PolarHBondContact O-N 3.23Å
452	E	87.7	Confident	88.2	Confident	56 Å²	56	25.5 Å²	25.5	26%	0.262	13%	0.132	S	C	.	.	I	π-helix	trans	-81.3	-17.9	-171.8	-77	-160.7	-142	0	0	115.5	L373 Y377 K384 Q447	L373-E452 HydrophobicContact CD1-CB 4.27Å; Y377-E452 PolarHBondContact OH-O 3.19Å; Y377-E452 VanDerWaalsContact OH-O 3.05Å; K384-E452 PolarHBondContact NZ-O 2.98Å; K384-E452 IonicContact NZ-OE2 3.47Å; K384-E452 PolarHBondContact NZ-OE2 3.29Å; Q447-E452 PolarHBondContact NE2-OE1 2.82Å; Q447-E452 WeakPolarHBondContact O-CB 3.24Å; Q447-E452 PolarHBondContact O-N 3.26Å
453	H	90	Very high	87.4	Confident	0 Å²	0	27.1 Å²	27.1	0%	0	14%	0.144	C	C	.	.	I	π-helix	trans	-114.9	-65.7	-178.5	-170.5	52.1	0	0	0	111.8	L373 F376 S407 Y448 L449 A457	L373-H453 HydrophobicContact CD2-CB 3.68Å; F376-H453 AromaticContact CE1-CE1 3.75Å; S407-H453 PolarHBondContact N-NE2 3.02Å; S407-H453 PolarHBondContact O-NE2 3.26Å; S407-H453 VanDerWaalsContact O-NE2 3.14Å; Y448-H453 WeakPolarHBondContact O-CB 3.08Å; Y448-H453 PolarHBondContact O-N 2.93Å; L449-H453 WeakPolarHBondContact O-CB 3.37Å; H453-A457 VanDerWaalsContact O-CB 3.27Å; H453-A457 WeakPolarHBondContact O-CB 3.43Å; H453-A457 PolarHBondContact O-N 2.64Å
454	V	89.5	Confident	86.3	Confident	5 Å²	5	25.6 Å²	25.6	3%	0.03	14%	0.135	C	C	.	.	I	π-helix	trans	-69.5	-57.5	-173.9	176.3	0	0	0	0	112.2	L406 L449 C450 Y456 A457 I458 I488 V524	L406-V454 HydrophobicContact CD1-CB 4.47Å; L406-V454 HydrophobicContact CD1-CG2 4.03Å; L449-V454 VanDerWaalsContact O-CG2 3.25Å; L449-V454 WeakPolarHBondContact O-CG2 3.39Å; L449-V454 PolarHBondContact O-N 3.03Å; C450-V454 PolarHBondContact O-N 3.03Å; V454-Y456 VanDerWaalsContact C-N 3.31Å; V454-Y456 PolarHBondContact O-N 2.93Å; V454-A457 PolarHBondContact O-N 3.17Å; V454-I458 HydrophobicContact CG1-CD1 3.72Å; V454-I458 VanDerWaalsContact O-CG1 3.27Å; V454-I458 WeakPolarHBondContact O-CG1 3.35Å; V454-I458 PolarHBondContact O-N 3.18Å; V454-I488 HydrophobicContact CG2-CD1 4.4Å; V454-I488 HydrophobicContact CG2-CG2 3.72Å; V454-V524 HydrophobicContact CG1-CG1 3.65Å; V454-V524 HydrophobicContact CG1-CG2 4.1Å
455	E	87.2	Confident	85.3	Confident	17 Å²	17	26.3 Å²	26.3	8%	0.079	14%	0.14	C	C	.	.	I	π-helix	trans	-60.8	-41.3	179.9	-75.4	-172	169.3	0	0	111.6	C450 H451 I458 D459 V524 K527	C450-E455 WeakPolarHBondContact O-CB 3.44Å; C450-E455 WeakPolarHBondContact O-CG 3.42Å; C450-E455 PolarHBondContact O-N 3.15Å; H451-E455 IonicContact CE1-OE2 2.69Å; H451-E455 IonicContact CG-OE2 2.74Å; H451-E455 IonicContact ND1-OE2 3.31Å; H451-E455 PolarHBondContact ND1-OE2 3.41Å; E455-I458 PolarHBondContact O-N 2.85Å; E455-D459 WeakPolarHBondContact O-CB 3.31Å; E455-D459 VanDerWaalsContact O-CG 3.28Å; E455-D459 PolarHBondContact O-N 3.34Å; E455-V524 HydrophobicContact CG-CG2 3.77Å; E455-K527 IonicContact OE2-NZ 3.18Å
456	Y	87.5	Confident	84	Confident	34 Å²	34	28.1 Å²	28.1	13%	0.133	15%	0.152	C	C	.	.	H	α-helix	trans	-60.9	-47.2	176.9	179.4	-106.1	0	0	0	112.2	Y377 H382 K384 H451 V454 I458 D459 V460	Y377-Y456 HydrophobicContact CE1-CD1 4.29Å; Y377-Y456 HydrophobicContact CE1-CE1 4.18Å; H382-Y456 AromaticContact CD2-CE1 3.77Å; H382-Y456 AromaticContact NE2-CE1 3.3Å; H382-Y456 VanDerWaalsContact NE2-CE1 3.3Å; H382-Y456 WeakPolarHBondContact NE2-CE1 3.26Å; H382-Y456 AromaticContact NE2-CZ 3.45Å; H382-Y456 PolarHBondContact NE2-OH 3.02Å; K384-Y456 WeakPolarHBondContact CA-OH 3.26Å; K384-Y456 HydrophobicContact CG-CE1 4.05Å; H451-Y456 PolarHBondContact O-N 3.23Å; V454-Y456 VanDerWaalsContact C-N 3.31Å; V454-Y456 PolarHBondContact O-N 2.93Å; Y456-I458 VanDerWaalsContact C-N 3.33Å; Y456-I458 PolarHBondContact O-N 2.94Å; Y456-D459 PolarHBondContact O-N 3.22Å; Y456-V460 HydrophobicContact CE1-CG2 4.24Å; Y456-V460 HydrophobicContact CE2-CG2 4.18Å; Y456-V460 WeakPolarHBondContact O-CG2 3.42Å; Y456-V460 PolarHBondContact O-N 3.02Å; Y456-V460 VanDerWaalsContact O-N 3.08Å
457	A	86.6	Confident	82.8	Confident	1 Å²	1	31.2 Å²	31.2	1%	0.008	17%	0.171	C	C	.	.	H	α-helix	trans	-62.4	-40.9	177.2	0	0	0	0	0	111.8	L405 L406 H453 V454 A461 L481	L405-A457 HydrophobicContact CB-CB 4.17Å; L406-A457 HydrophobicContact CB-CB 4.12Å; L406-A457 HydrophobicContact CD1-CB 4.15Å; H453-A457 VanDerWaalsContact O-CB 3.27Å; H453-A457 WeakPolarHBondContact O-CB 3.43Å; H453-A457 PolarHBondContact O-N 2.64Å; V454-A457 PolarHBondContact O-N 3.17Å; A457-A461 WeakPolarHBondContact O-CB 3.34Å; A457-A461 PolarHBondContact O-N 3.49Å; A457-L481 HydrophobicContact CB-CD1 4.06Å; A457-L481 WeakPolarHBondContact O-CD1 3.46Å
458	I	85.3	Confident	81.3	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-64.2	-45.1	176.5	-66.5	164.2	0	0	0	111	V454 E455 Y456 V460 A461 L462 L481 V524 K527 L528	V454-I458 HydrophobicContact CG1-CD1 3.72Å; V454-I458 VanDerWaalsContact O-CG1 3.27Å; V454-I458 WeakPolarHBondContact O-CG1 3.35Å; V454-I458 PolarHBondContact O-N 3.18Å; E455-I458 PolarHBondContact O-N 2.85Å; Y456-I458 VanDerWaalsContact C-N 3.33Å; Y456-I458 PolarHBondContact O-N 2.94Å; I458-V460 PolarHBondContact O-N 2.98Å; I458-A461 PolarHBondContact O-N 2.79Å; I458-L462 HydrophobicContact CG2-CD1 3.73Å; I458-L462 HydrophobicContact CG2-CG 3.98Å; I458-L462 WeakPolarHBondContact O-CB 3.2Å; I458-L462 VanDerWaalsContact O-CG 3.27Å; I458-L462 WeakPolarHBondContact O-CG 2.89Å; I458-L462 PolarHBondContact O-N 3.2Å; I458-L481 HydrophobicContact CB-CD2 4.47Å; I458-L481 HydrophobicContact CG1-CD2 3.67Å; I458-V524 HydrophobicContact CD1-CG1 3.69Å; I458-K527 HydrophobicContact CG2-CB 3.71Å; I458-K527 HydrophobicContact CG2-CD 4.36Å; I458-L528 HydrophobicContact CD1-CD2 3.61Å; I458-L528 HydrophobicContact CD1-CG 3.97Å; I458-L528 HydrophobicContact CG1-CD2 3.79Å; I458-L528 HydrophobicContact CG2-CD2 4.4Å
459	D	84.5	Confident	79.6	Confident	72 Å²	72	39.9 Å²	39.9	39%	0.385	21%	0.212	S	C	.	.	H	α-helix	trans	-63.5	-40.8	-179.3	-74.1	-20.2	0	0	0	111.7	E455 Y456 S463 K527	E455-D459 WeakPolarHBondContact O-CB 3.31Å; E455-D459 VanDerWaalsContact O-CG 3.28Å; E455-D459 PolarHBondContact O-N 3.34Å; Y456-D459 PolarHBondContact O-N 3.22Å; D459-S463 PolarHBondContact O-N 2.86Å; D459-K527 WeakPolarHBondContact OD1-CD 3.45Å; D459-K527 WeakPolarHBondContact OD1-CE 3.33Å; D459-K527 IonicContact OD1-NZ 3.83Å; D459-K527 PolarHBondContact OD1-NZ 3.45Å; D459-K527 IonicContact OD2-NZ 2.66Å; D459-K527 PolarHBondContact OD2-NZ 3.41Å
460	V	81.3	Confident	77.7	Confident	7 Å²	7	41.6 Å²	41.6	4%	0.042	23%	0.23	C	C	.	.	H	α-helix	trans	-61.7	-46.5	173.6	177.1	0	0	0	0	110.4	F388 L397 L405 Y456 I458 S463 A464	F388-V460 HydrophobicContact CE2-CG2 3.85Å; F388-V460 HydrophobicContact CZ-CG2 4.27Å; L397-V460 HydrophobicContact CD1-CG1 3.96Å; L405-V460 HydrophobicContact CD1-CB 4.15Å; L405-V460 HydrophobicContact CD1-CG1 3.78Å; L405-V460 HydrophobicContact CD1-CG2 4.26Å; Y456-V460 HydrophobicContact CE1-CG2 4.24Å; Y456-V460 HydrophobicContact CE2-CG2 4.18Å; Y456-V460 WeakPolarHBondContact O-CG2 3.42Å; Y456-V460 PolarHBondContact O-N 3.02Å; Y456-V460 VanDerWaalsContact O-N 3.08Å; I458-V460 PolarHBondContact O-N 2.98Å; V460-S463 PolarHBondContact O-N 3.47Å; V460-S463 PolarHBondContact O-OG 3.04Å; V460-A464 PolarHBondContact O-N 3.39Å
461	A	79.6	Confident	76.2	Confident	15 Å²	15	47.8 Å²	47.8	12%	0.124	26%	0.259	C	S	.	.	H	α-helix	trans	-69	-37.5	-179.2	0	0	0	0	0	113.3	A457 I458 S463 A464 V465 F478 L481	A457-A461 WeakPolarHBondContact O-CB 3.34Å; A457-A461 PolarHBondContact O-N 3.49Å; I458-A461 PolarHBondContact O-N 2.79Å; A461-S463 PolarHBondContact O-N 3.43Å; A461-A464 WeakPolarHBondContact O-CB 3.43Å; A461-A464 PolarHBondContact O-N 3.41Å; A461-V465 PolarHBondContact O-N 3.19Å; A461-F478 HydrophobicContact CB-CD2 3.93Å; A461-L481 HydrophobicContact CB-CD1 3.71Å
462	L	79.1	Confident	74.5	Confident	23 Å²	23	44.6 Å²	44.6	12%	0.12	26%	0.257	C	S	.	.	H	α-helix	trans	-62.2	-28.2	175.2	-79	176.8	0	0	0	113.3	I458 A464 F478 K527 K534	I458-L462 HydrophobicContact CG2-CD1 3.73Å; I458-L462 HydrophobicContact CG2-CG 3.98Å; I458-L462 WeakPolarHBondContact O-CB 3.2Å; I458-L462 VanDerWaalsContact O-CG 3.27Å; I458-L462 WeakPolarHBondContact O-CG 2.89Å; I458-L462 PolarHBondContact O-N 3.2Å; L462-A464 VanDerWaalsContact C-N 3.32Å; L462-F478 HydrophobicContact CD2-CE2 3.78Å; L462-F478 HydrophobicContact CD2-CZ 4.21Å; L462-F478 HydrophobicContact CG-CE2 4.12Å; L462-K527 HydrophobicContact CD1-CB 4.2Å; L462-K534 PolarHBondContact O-NZ 3.48Å; L462-K534 VanDerWaalsContact O-NZ 3.15Å
463	S	74.9	Confident	72.9	Confident	41 Å²	41	45.7 Å²	45.7	29%	0.287	27%	0.271	S	S	.	.	H	α-helix	trans	-76.8	-20.5	175.6	79.3	0	0	0	0	113	D459 V460 A461	D459-S463 PolarHBondContact O-N 2.86Å; V460-S463 PolarHBondContact O-N 3.47Å; V460-S463 PolarHBondContact O-OG 3.04Å; A461-S463 PolarHBondContact O-N 3.43Å
464	A	69.8	Low	71.3	Confident	33 Å²	33	46.7 Å²	46.7	27%	0.273	28%	0.277	S	S	.	.	H	α-helix	trans	-90.5	-17.5	-178.7	0	0	0	0	0	114.2	L397 V460 A461 L462 P466	L397-A464 HydrophobicContact CD2-CB 3.57Å; V460-A464 PolarHBondContact O-N 3.39Å; A461-A464 WeakPolarHBondContact O-CB 3.43Å; A461-A464 PolarHBondContact O-N 3.41Å; L462-A464 VanDerWaalsContact C-N 3.32Å; A464-P466 VanDerWaalsContact O-CD 3.31Å; A464-P466 WeakPolarHBondContact O-CD 3.45Å
465	V	71.5	Confident	69.8	Low	19 Å²	19	51.2 Å²	51.2	12%	0.115	30%	0.301	C	S	.	.	S	Bend	trans	-67.6	117.4	-178.6	-176	0	0	0	0	110.5	A461 T467 F478 K534 V535	A461-V465 PolarHBondContact O-N 3.19Å; V465-T467 PolarHBondContact O-N 2.91Å; V465-F478 HydrophobicContact CG2-CB 4.08Å; V465-F478 HydrophobicContact CG2-CD2 4.13Å; V465-F478 HydrophobicContact CG2-CG 4.12Å; V465-K534 HydrophobicContact CB-CB 4.45Å; V465-K534 HydrophobicContact CB-CD 4.41Å; V465-K534 HydrophobicContact CG1-CB 3.83Å; V465-V535 HydrophobicContact CG1-CG2 4.18Å
466	P	67.3	Low	68.7	Low	37 Å²	37	53.2 Å²	53.2	24%	0.24	31%	0.309	C	S	.	.			trans	-71.2	127.5	179.5	28	-32.4	0	0	0	110.6	A464	A464-P466 VanDerWaalsContact O-CD 3.31Å; A464-P466 WeakPolarHBondContact O-CD 3.45Å
467	T	63.9	Low	67.7	Low	81 Å²	81	53.5 Å²	53.5	50%	0.497	32%	0.319	S	S	.	.			trans	-104.7	-3.4	174.7	51.6	0	0	0	0	113.5	V465 K534	V465-T467 PolarHBondContact O-N 2.91Å; T467-K534 HydrophobicContact CG2-CD 4.32Å; T467-K534 HydrophobicContact CG2-CG 4.39Å
468	Q	61.3	Low	67.3	Low	138 Å²	138	53.9 Å²	53.9	65%	0.645	32%	0.32	S	S	*	.	S	Bend	trans	-92.8	146.9	-174.5	-70.6	-175.2	-25.6	0	0	112.9
469	E	55	Low	66.9	Low	138 Å²	138	54 Å²	54	65%	0.645	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	141.1	179.5	-60.7	177.9	165.5	0	0	111.6
470	G	53.9	Low	66.4	Low	38 Å²	38	54.1 Å²	54.1	39%	0.392	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	104.9	-5.1	163.3	0	0	0	0	0	118.5
471	H	55.4	Low	66.5	Low	133 Å²	133	54 Å²	54	62%	0.616	32%	0.321	S	S	*	.			trans	-101.4	105.3	172.2	-70.2	-69.7	0	0	0	110.9	S473	H471-S473 PolarHBondContact O-N 3.07Å; H471-S473 VanDerWaalsContact O-N 3.13Å
472	G	52.4	Low	66.6	Low	48 Å²	48	53.3 Å²	53.3	50%	0.495	32%	0.315	S	S	.	.			trans	-72.6	7.5	-174.9	0	0	0	0	0	116.7	H542	G472-H542 VanDerWaalsContact CA-CE1 3.41Å; G472-H542 WeakPolarHBondContact CA-CE1 3.47Å
473	S	54.2	Low	66.6	Low	80 Å²	80	57.8 Å²	57.8	56%	0.559	33%	0.33	S	S	*	.			trans	-114.3	97.6	176	55.9	0	0	0	0	110	H471 D475	H471-S473 PolarHBondContact O-N 3.07Å; H471-S473 VanDerWaalsContact O-N 3.13Å; S473-D475 PolarHBondContact O-N 2.95Å; S473-D475 VanDerWaalsContact O-N 3.16Å
474	T	57.3	Low	67	Low	20 Å²	20	57.3 Å²	57.3	12%	0.123	32%	0.323	C	S	.	.			trans	-70.5	99.7	162.6	24.1	0	0	0	0	107.9	F476 A538 I539 Q584	T474-F476 PolarHBondContact O-N 2.69Å; T474-F476 VanDerWaalsContact O-N 3.09Å; T474-A538 HydrophobicContact CG2-CB 4.23Å; T474-I539 HydrophobicContact CG2-CG1 4.44Å; T474-Q584 VanDerWaalsContact OG1-CD 3.31Å; T474-Q584 PolarHBondContact OG1-NE2 2.92Å; T474-Q584 VanDerWaalsContact OG1-NE2 3.11Å; T474-Q584 PolarHBondContact OG1-OE1 3.2Å
475	D	58.7	Low	67.7	Low	100 Å²	100	55.7 Å²	55.7	54%	0.535	31%	0.31	S	S	.	.			trans	-62.3	112.7	172.5	-89	-9.3	0	0	0	109.3	S473 A477	S473-D475 PolarHBondContact O-N 2.95Å; S473-D475 VanDerWaalsContact O-N 3.16Å; D475-A477 PolarHBondContact O-N 3.03Å
476	F	62.6	Low	68.2	Low	59 Å²	59	56.2 Å²	56.2	26%	0.259	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.2	13.3	-174.9	-63.1	-68.5	0	0	0	114.4	T474 F478 L479 N480 S587	T474-F476 PolarHBondContact O-N 2.69Å; T474-F476 VanDerWaalsContact O-N 3.09Å; F476-F478 PolarHBondContact O-N 2.88Å; F476-L479 HydrophobicContact CD1-CD1 3.65Å; F476-L479 HydrophobicContact CD1-CG 4.41Å; F476-L479 HydrophobicContact CE1-CD1 4.24Å; F476-L479 PolarHBondContact O-N 3.49Å; F476-L479 VanDerWaalsContact O-N 3.08Å; F476-N480 PolarHBondContact O-N 2.71Å; F476-S587 WeakPolarHBondContact CE2-OG 3.34Å; F476-S587 WeakPolarHBondContact CZ-OG 3.34Å
477	A	67.6	Low	68.9	Low	41 Å²	41	56 Å²	56	34%	0.339	32%	0.318	S	S	.	.	H	α-helix	trans	-56.4	-37.4	179	0	0	0	0	0	112.2	D475 L481	D475-A477 PolarHBondContact O-N 3.03Å; A477-L481 PolarHBondContact O-N 3.27Å
478	F	77.7	Confident	70.1	Confident	8 Å²	8	52.3 Å²	52.3	4%	0.035	30%	0.295	C	S	.	.	H	α-helix	trans	-68	-37.6	177.4	-173.1	-92.7	0	0	0	112.8	A461 L462 V465 F476 L481 L482 L528 V535	A461-F478 HydrophobicContact CB-CD2 3.93Å; L462-F478 HydrophobicContact CD2-CE2 3.78Å; L462-F478 HydrophobicContact CD2-CZ 4.21Å; L462-F478 HydrophobicContact CG-CE2 4.12Å; V465-F478 HydrophobicContact CG2-CB 4.08Å; V465-F478 HydrophobicContact CG2-CD2 4.13Å; V465-F478 HydrophobicContact CG2-CG 4.12Å; F476-F478 PolarHBondContact O-N 2.88Å; F478-L481 PolarHBondContact O-N 3.43Å; F478-L482 WeakPolarHBondContact O-CB 3.46Å; F478-L482 PolarHBondContact O-N 2.79Å; F478-L528 HydrophobicContact CZ-CD2 4.48Å; F478-V535 HydrophobicContact CB-CG2 4.37Å; F478-V535 HydrophobicContact CD1-CG2 3.88Å; F478-V535 HydrophobicContact CG-CG2 4.37Å
479	L	76.3	Confident	71.3	Confident	2 Å²	2	46.1 Å²	46.1	1%	0.01	27%	0.267	C	S	.	.	H	α-helix	trans	-70.3	-36.5	-179.7	-65.6	-172.8	0	0	0	112.2	F476 L481 L482 R483 L532 V535 L588 C591	F476-L479 HydrophobicContact CD1-CD1 3.65Å; F476-L479 HydrophobicContact CD1-CG 4.41Å; F476-L479 HydrophobicContact CE1-CD1 4.24Å; F476-L479 PolarHBondContact O-N 3.49Å; F476-L479 VanDerWaalsContact O-N 3.08Å; L479-L481 VanDerWaalsContact C-N 3.34Å; L479-L482 HydrophobicContact CD2-CD2 4.3Å; L479-L482 WeakPolarHBondContact O-CB 3.46Å; L479-L482 PolarHBondContact O-N 3.46Å; L479-R483 PolarHBondContact O-N 2.86Å; L479-L532 HydrophobicContact CD2-CD1 4.39Å; L479-V535 HydrophobicContact CD2-CG1 4.35Å; L479-L588 HydrophobicContact CD1-CD2 3.79Å; L479-L588 HydrophobicContact CD1-CG 4.48Å; L479-L588 HydrophobicContact CD2-CD2 4.03Å; L479-C591 HydrophobicContact CB-CB 3.62Å; L479-C591 VanDerWaalsContact CB-SG 3.57Å; L479-C591 HydrophobicContact CD1-CB 4.27Å; L479-C591 HydrophobicContact CG-CB 4.49Å
480	N	75.5	Confident	72.6	Confident	75 Å²	75	44.2 Å²	44.2	40%	0.401	26%	0.258	S	S	.	.	H	α-helix	trans	-65.8	-38.5	172.9	-77.9	-32.7	0	0	0	112.2	F476 L482 R483 Q484	F476-N480 PolarHBondContact O-N 2.71Å; N480-L482 VanDerWaalsContact C-N 3.33Å; N480-R483 PolarHBondContact O-N 3.28Å; N480-Q484 PolarHBondContact O-N 2.96Å
481	L	82.1	Confident	74.3	Confident	5 Å²	5	45.1 Å²	45.1	3%	0.026	25%	0.254	C	S	.	.	H	α-helix	trans	-65.5	-37.5	173.7	-175.7	145.9	0	0	0	111.9	L406 A457 I458 A461 A477 F478 L479 R483 Q484 A485 L528	L406-L481 HydrophobicContact CD2-CG 4.24Å; A457-L481 HydrophobicContact CB-CD1 4.06Å; A457-L481 WeakPolarHBondContact O-CD1 3.46Å; I458-L481 HydrophobicContact CB-CD2 4.47Å; I458-L481 HydrophobicContact CG1-CD2 3.67Å; A461-L481 HydrophobicContact CB-CD1 3.71Å; A477-L481 PolarHBondContact O-N 3.27Å; F478-L481 PolarHBondContact O-N 3.43Å; L479-L481 VanDerWaalsContact C-N 3.34Å; L481-R483 PolarHBondContact O-N 3.45Å; L481-Q484 PolarHBondContact O-N 3.19Å; L481-A485 VanDerWaalsContact O-CB 3.29Å; L481-A485 WeakPolarHBondContact O-CB 3.06Å; L481-A485 PolarHBondContact O-N 2.6Å; L481-L528 HydrophobicContact CD2-CD2 4.38Å
482	L	82	Confident	75.9	Confident	1 Å²	1	38.8 Å²	38.8	1%	0.005	22%	0.224	C	C	.	.	H	α-helix	trans	-58.7	-44.9	176.4	-173.3	63	0	0	0	111.7	F478 L479 N480 A485 A486 L528 L532 L592 F738	F478-L482 WeakPolarHBondContact O-CB 3.46Å; F478-L482 PolarHBondContact O-N 2.79Å; L479-L482 HydrophobicContact CD2-CD2 4.3Å; L479-L482 WeakPolarHBondContact O-CB 3.46Å; L479-L482 PolarHBondContact O-N 3.46Å; N480-L482 VanDerWaalsContact C-N 3.33Å; L482-A485 PolarHBondContact O-N 2.81Å; L482-A486 WeakPolarHBondContact O-CB 3.47Å; L482-A486 PolarHBondContact O-N 2.96Å; L482-L528 HydrophobicContact CD1-CB 3.74Å; L482-L528 HydrophobicContact CD1-CD1 4.08Å; L482-L528 HydrophobicContact CD1-CD2 3.71Å; L482-L528 HydrophobicContact CD1-CG 4.03Å; L482-L532 HydrophobicContact CD2-CD1 4.19Å; L482-L592 HydrophobicContact CD2-CD1 4.44Å; L482-L592 HydrophobicContact CD2-CD2 3.51Å; L482-L592 HydrophobicContact CD2-CG 4.25Å; L482-L592 HydrophobicContact CG-CD2 4.1Å; L482-F738 HydrophobicContact CD1-CE2 3.78Å; L482-F738 HydrophobicContact CD1-CZ 3.59Å; L482-F738 HydrophobicContact CG-CZ 4.19Å
483	R	79.7	Confident	77.6	Confident	117 Å²	117	38.9 Å²	38.9	44%	0.442	21%	0.212	S	C	.	.	H	α-helix	trans	-59.6	-49.4	176	-173.4	-176.6	63.5	73.1	-1.2	111.9	E408 L479 N480 L481 A486 A487	E408-R483 IonicContact OE1-NH1 3.7Å; L479-R483 PolarHBondContact O-N 2.86Å; N480-R483 PolarHBondContact O-N 3.28Å; L481-R483 PolarHBondContact O-N 3.45Å; R483-A486 PolarHBondContact O-N 3.12Å; R483-A487 PolarHBondContact O-N 3.06Å; R483-A487 VanDerWaalsContact O-N 3.12Å
484	Q	82.4	Confident	79.2	Confident	30 Å²	30	40.6 Å²	40.6	14%	0.14	21%	0.206	C	C	.	.	H	α-helix	trans	-65.7	-39.7	179.2	-72.2	176.2	-18.7	0	0	112.2	S404 L406 N480 L481 A487 I488	S404-Q484 VanDerWaalsContact OG-CD 3.28Å; S404-Q484 PolarHBondContact OG-NE2 3.2Å; S404-Q484 VanDerWaalsContact OG-NE2 3.14Å; S404-Q484 PolarHBondContact OG-OE1 3.03Å; L406-Q484 HydrophobicContact CD2-CB 3.65Å; L406-Q484 HydrophobicContact CG-CB 4.2Å; L406-Q484 PolarHBondContact O-OE1 3.23Å; L406-Q484 VanDerWaalsContact O-OE1 3.05Å; N480-Q484 PolarHBondContact O-N 2.96Å; L481-Q484 PolarHBondContact O-N 3.19Å; Q484-A487 PolarHBondContact O-N 3.41Å; Q484-I488 WeakPolarHBondContact O-CG1 3.16Å; Q484-I488 PolarHBondContact O-N 2.87Å
485	A	85.9	Confident	80.7	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-65.6	-38.8	177.9	0	0	0	0	0	111.8	L406 L481 L482 I488 S489 L528	L406-A485 HydrophobicContact CD2-CB 3.81Å; L481-A485 VanDerWaalsContact O-CB 3.29Å; L481-A485 WeakPolarHBondContact O-CB 3.06Å; L481-A485 PolarHBondContact O-N 2.6Å; L482-A485 PolarHBondContact O-N 2.81Å; A485-I488 PolarHBondContact O-N 2.82Å; A485-S489 WeakPolarHBondContact O-CB 3.34Å; A485-S489 PolarHBondContact O-N 3.06Å; A485-S489 PolarHBondContact O-OG 2.99Å; A485-L528 HydrophobicContact CB-CD1 3.94Å; A485-L528 HydrophobicContact CB-CD2 3.96Å
486	A	80.6	Confident	82.2	Confident	30 Å²	30	35.7 Å²	35.7	25%	0.248	18%	0.179	C	C	.	.	H	α-helix	trans	-62.9	-44.1	173.9	0	0	0	0	0	111.8	L482 R483 S489 H490 F738	L482-A486 WeakPolarHBondContact O-CB 3.47Å; L482-A486 PolarHBondContact O-N 2.96Å; R483-A486 PolarHBondContact O-N 3.12Å; A486-S489 PolarHBondContact O-N 3.22Å; A486-H490 PolarHBondContact O-N 2.67Å; A486-F738 HydrophobicContact CB-CE1 4.14Å
487	A	82.9	Confident	83.3	Confident	33 Å²	33	35.8 Å²	35.8	27%	0.273	18%	0.182	S	C	.	.	H	α-helix	trans	-60	-46.9	176.2	0	0	0	0	0	112	E408 R483 Q484 S489 H490 L491	E408-A487 HydrophobicContact CG-CB 4.47Å; R483-A487 PolarHBondContact O-N 3.06Å; R483-A487 VanDerWaalsContact O-N 3.12Å; Q484-A487 PolarHBondContact O-N 3.41Å; A487-S489 VanDerWaalsContact C-N 3.35Å; A487-S489 PolarHBondContact O-N 3.16Å; A487-H490 PolarHBondContact O-N 3.23Å; A487-L491 WeakPolarHBondContact O-CG 3.43Å; A487-L491 PolarHBondContact O-N 3.22Å; A487-L491 VanDerWaalsContact O-N 3.08Å
488	I	88.1	Confident	84.3	Confident	3 Å²	3	38.4 Å²	38.4	2%	0.015	19%	0.19	C	C	.	.	H	α-helix	trans	-64.1	-39.7	177.6	-66	169.7	0	0	0	111.5	L406 E408 A411 L449 V454 Q484 A485 H490 L491 F492	L406-I488 HydrophobicContact CD1-CD1 3.61Å; L406-I488 HydrophobicContact CD2-CD1 3.99Å; L406-I488 HydrophobicContact CG-CD1 3.63Å; E408-I488 HydrophobicContact CG-CG1 4.34Å; A411-I488 HydrophobicContact CB-CB 4.39Å; A411-I488 HydrophobicContact CB-CD1 3.89Å; A411-I488 HydrophobicContact CB-CG1 3.68Å; A411-I488 HydrophobicContact CB-CG2 3.9Å; L449-I488 HydrophobicContact CD1-CG2 3.95Å; L449-I488 HydrophobicContact CD2-CG2 4.41Å; L449-I488 HydrophobicContact CG-CG2 4.32Å; V454-I488 HydrophobicContact CG2-CD1 4.4Å; V454-I488 HydrophobicContact CG2-CG2 3.72Å; Q484-I488 WeakPolarHBondContact O-CG1 3.16Å; Q484-I488 PolarHBondContact O-N 2.87Å; A485-I488 PolarHBondContact O-N 2.82Å; I488-H490 VanDerWaalsContact C-N 3.33Å; I488-H490 PolarHBondContact O-N 3.03Å; I488-L491 PolarHBondContact O-N 2.99Å; I488-F492 PolarHBondContact O-N 3.01Å
489	S	86.4	Confident	84.9	Confident	8 Å²	8	39 Å²	39	6%	0.056	20%	0.195	C	C	.	.	H	α-helix	trans	-61	-42.8	178.1	-57.9	0	0	0	0	111.5	A485 A486 A487 F492 E493 M521	A485-S489 WeakPolarHBondContact O-CB 3.34Å; A485-S489 PolarHBondContact O-N 3.06Å; A485-S489 PolarHBondContact O-OG 2.99Å; A486-S489 PolarHBondContact O-N 3.22Å; A487-S489 VanDerWaalsContact C-N 3.35Å; A487-S489 PolarHBondContact O-N 3.16Å; S489-F492 PolarHBondContact O-N 3.2Å; S489-E493 PolarHBondContact O-N 3.48Å; S489-M521 WeakPolarHBondContact CB-SD 3.37Å; S489-M521 PolarHBondContact OG-SD 3.08Å
490	H	83.9	Confident	85.5	Confident	98 Å²	98	38.9 Å²	38.9	45%	0.454	20%	0.195	S	C	.	.	H	α-helix	trans	-65.2	-43.1	175.7	-178.2	-88.4	0	0	0	112.6	A486 A487 I488 F492 E493 R494	A486-H490 PolarHBondContact O-N 2.67Å; A487-H490 PolarHBondContact O-N 3.23Å; I488-H490 VanDerWaalsContact C-N 3.33Å; I488-H490 PolarHBondContact O-N 3.03Å; H490-F492 VanDerWaalsContact C-N 3.32Å; H490-F492 PolarHBondContact O-N 2.94Å; H490-E493 PolarHBondContact O-N 2.73Å; H490-R494 WeakPolarHBondContact O-CB 3.24Å; H490-R494 PolarHBondContact O-N 3.11Å
491	L	88	Confident	86.1	Confident	56 Å²	56	36.8 Å²	36.8	29%	0.293	18%	0.184	S	C	.	.	H	α-helix	trans	-62.2	-39.9	176.4	-68.3	174	0	0	0	112	I412 L415 A487 I488 Q495	I412-L491 HydrophobicContact CD1-CD1 4.43Å; I412-L491 HydrophobicContact CG1-CD1 3.86Å; L415-L491 HydrophobicContact CD1-CB 3.53Å; L415-L491 HydrophobicContact CD1-CD1 4.44Å; A487-L491 WeakPolarHBondContact O-CG 3.43Å; A487-L491 PolarHBondContact O-N 3.22Å; A487-L491 VanDerWaalsContact O-N 3.08Å; I488-L491 PolarHBondContact O-N 2.99Å; L491-Q495 PolarHBondContact O-N 3.25Å; L491-Q495 VanDerWaalsContact O-N 3.17Å
492	F	90	Very high	86.3	Confident	1 Å²	1	39.8 Å²	39.8	0%	0.004	21%	0.205	C	C	.	.	H	α-helix	trans	-62.7	-49.3	175.5	175.1	-93.3	0	0	0	112.1	L445 T446 L449 I488 S489 H490 R494 Q495 I496 A517 M521	L445-F492 HydrophobicContact CD2-CD2 4.11Å; L445-F492 HydrophobicContact CD2-CE2 3.83Å; L445-F492 HydrophobicContact CG-CD2 4.3Å; L445-F492 HydrophobicContact CG-CE2 3.96Å; T446-F492 HydrophobicContact CG2-CE2 4.2Å; T446-F492 HydrophobicContact CG2-CZ 4.04Å; L449-F492 HydrophobicContact CD2-CB 4.42Å; L449-F492 HydrophobicContact CD2-CD2 3.97Å; I488-F492 PolarHBondContact O-N 3.01Å; S489-F492 PolarHBondContact O-N 3.2Å; H490-F492 VanDerWaalsContact C-N 3.32Å; H490-F492 PolarHBondContact O-N 2.94Å; F492-R494 VanDerWaalsContact C-N 3.33Å; F492-R494 PolarHBondContact O-N 3.35Å; F492-Q495 PolarHBondContact O-N 2.81Å; F492-I496 HydrophobicContact CD1-CG1 4.15Å; F492-I496 HydrophobicContact CE1-CD1 4.16Å; F492-I496 HydrophobicContact CE1-CG1 3.84Å; F492-I496 HydrophobicContact CE2-CD1 4.43Å; F492-I496 HydrophobicContact CZ-CD1 3.94Å; F492-I496 HydrophobicContact CZ-CG1 4.09Å; F492-I496 WeakPolarHBondContact O-CG1 3.46Å; F492-I496 PolarHBondContact O-N 3.34Å; F492-A517 HydrophobicContact CZ-CB 4.35Å; F492-M521 HydrophobicContact CB-CE 3.66Å; F492-M521 HydrophobicContact CD1-CE 3.17Å; F492-M521 HydrophobicContact CE1-CE 3.87Å; F492-M521 HydrophobicContact CG-CE 3.54Å
493	E	86.8	Confident	86.4	Confident	50 Å²	50	41 Å²	41	23%	0.234	21%	0.211	C	C	.	.	H	α-helix	trans	-61.5	-41.6	179.2	-75.3	-164.3	-172	0	0	112.5	S489 H490 Q495 I496 D497 H742	S489-E493 PolarHBondContact O-N 3.48Å; H490-E493 PolarHBondContact O-N 2.73Å; E493-Q495 VanDerWaalsContact C-N 3.3Å; E493-Q495 PolarHBondContact O-N 3.21Å; E493-I496 WeakPolarHBondContact O-CB 3.31Å; E493-I496 PolarHBondContact O-N 3.33Å; E493-I496 VanDerWaalsContact O-N 3.17Å; E493-D497 PolarHBondContact O-N 3.45Å; E493-H742 IonicContact OE1-CE1 3.27Å; E493-H742 IonicContact OE1-CG 2.69Å; E493-H742 IonicContact OE1-ND1 3.54Å; E493-H742 PolarHBondContact OE1-ND1 2.82Å; E493-H742 IonicContact OE2-CE1 3.61Å; E493-H742 PolarHBondContact OE2-CE1 3.09Å; E493-H742 IonicContact OE2-CG 2.71Å; E493-H742 IonicContact OE2-ND1 3.46Å; E493-H742 PolarHBondContact OE2-ND1 3.37Å
494	R	88.9	Confident	86.7	Confident	115 Å²	115	35.8 Å²	35.8	43%	0.434	19%	0.191	S	C	.	.	H	α-helix	trans	-57.8	-42.9	175.4	-175.4	174.2	-176.8	170.1	3.7	111.7	D12 H490 F492 D497 D498	D12-R494 IonicContact OD2-NH2 3.95Å; D12-R494 PolarHBondContact OD2-NH2 3.03Å; H490-R494 WeakPolarHBondContact O-CB 3.24Å; H490-R494 PolarHBondContact O-N 3.11Å; F492-R494 VanDerWaalsContact C-N 3.33Å; F492-R494 PolarHBondContact O-N 3.35Å; R494-D497 PolarHBondContact O-N 2.85Å; R494-D498 WeakPolarHBondContact CG-OD2 3.34Å; R494-D498 IonicContact NE-OD2 3.57Å; R494-D498 WeakPolarHBondContact O-CB 3.42Å; R494-D498 VanDerWaalsContact O-CG 3.32Å; R494-D498 PolarHBondContact O-N 3.49Å
495	Q	89.3	Confident	86.2	Confident	14 Å²	14	41.8 Å²	41.8	7%	0.065	22%	0.22	C	C	.	.	H	α-helix	trans	-67.2	-37.8	177.4	-178.2	172.2	-15.1	0	0	113	L415 T418 L491 F492 E493 D497 S499	L415-Q495 HydrophobicContact CD2-CB 4.36Å; L415-Q495 PolarHBondContact O-NE2 3.46Å; L415-Q495 PolarHBondContact O-OE1 2.82Å; L415-Q495 VanDerWaalsContact O-OE1 3.08Å; T418-Q495 PolarHBondContact OG1-NE2 2.71Å; L491-Q495 PolarHBondContact O-N 3.25Å; L491-Q495 VanDerWaalsContact O-N 3.17Å; F492-Q495 PolarHBondContact O-N 2.81Å; E493-Q495 VanDerWaalsContact C-N 3.3Å; E493-Q495 PolarHBondContact O-N 3.21Å; Q495-D497 VanDerWaalsContact C-N 3.32Å; Q495-D497 PolarHBondContact O-N 2.79Å; Q495-S499 VanDerWaalsContact O-CB 3.29Å; Q495-S499 WeakPolarHBondContact O-CB 3.49Å; Q495-S499 PolarHBondContact O-N 3.24Å
496	I	89.5	Confident	85.2	Confident	3 Å²	3	46.6 Å²	46.6	2%	0.015	25%	0.253	C	S	.	.	I	π-helix	trans	-57.9	-48.6	174.4	-65	-75	0	0	0	109.7	L442 F492 E493 V500 V501 L514 A517	L442-I496 HydrophobicContact CD1-CD1 3.5Å; F492-I496 HydrophobicContact CD1-CG1 4.15Å; F492-I496 HydrophobicContact CE1-CD1 4.16Å; F492-I496 HydrophobicContact CE1-CG1 3.84Å; F492-I496 HydrophobicContact CE2-CD1 4.43Å; F492-I496 HydrophobicContact CZ-CD1 3.94Å; F492-I496 HydrophobicContact CZ-CG1 4.09Å; F492-I496 WeakPolarHBondContact O-CG1 3.46Å; F492-I496 PolarHBondContact O-N 3.34Å; E493-I496 WeakPolarHBondContact O-CB 3.31Å; E493-I496 PolarHBondContact O-N 3.33Å; E493-I496 VanDerWaalsContact O-N 3.17Å; I496-V500 HydrophobicContact CD1-CG2 4.32Å; I496-V500 WeakPolarHBondContact O-CA 3.28Å; I496-V500 WeakPolarHBondContact O-CB 3.38Å; I496-V500 PolarHBondContact O-N 3.4Å; I496-V501 HydrophobicContact CG2-CG2 4.4Å; I496-V501 WeakPolarHBondContact O-CG2 3.47Å; I496-V501 PolarHBondContact O-N 3.19Å; I496-L514 HydrophobicContact CG2-CD2 3.82Å; I496-A517 HydrophobicContact CD1-CB 3.94Å
497	D	86.7	Confident	84.6	Confident	62 Å²	62	46.7 Å²	46.7	33%	0.332	25%	0.252	S	S	.	.	I	π-helix	trans	-71.2	-39.3	-177.2	-72.7	-14.1	0	0	0	112.8	E493 R494 Q495 P502 R518	E493-D497 PolarHBondContact O-N 3.45Å; R494-D497 PolarHBondContact O-N 2.85Å; Q495-D497 VanDerWaalsContact C-N 3.32Å; Q495-D497 PolarHBondContact O-N 2.79Å; D497-P502 WeakPolarHBondContact O-CD 3.49Å; D497-R518 IonicContact OD1-NH2 2.8Å; D497-R518 PolarHBondContact OD1-NH2 3.47Å
498	D	88.7	Confident	83.9	Confident	95 Å²	95	51 Å²	51	51%	0.508	28%	0.277	S	S	.	.	I	π-helix	trans	-80	-35.8	-177.3	-70.8	-15.3	0	0	0	113.2	R494 P502	R494-D498 WeakPolarHBondContact CG-OD2 3.34Å; R494-D498 IonicContact NE-OD2 3.57Å; R494-D498 WeakPolarHBondContact O-CB 3.42Å; R494-D498 VanDerWaalsContact O-CG 3.32Å; R494-D498 PolarHBondContact O-N 3.49Å; D498-P502 WeakPolarHBondContact O-CG 3.18Å
499	S	89.8	Confident	83	Confident	21 Å²	21	57.6 Å²	57.6	15%	0.147	31%	0.308	C	S	.	.	I	π-helix	trans	-111.2	-34.8	-170	-54.2	0	0	0	0	114.1	Q495 L503	Q495-S499 VanDerWaalsContact O-CB 3.29Å; Q495-S499 WeakPolarHBondContact O-CB 3.49Å; Q495-S499 PolarHBondContact O-N 3.24Å; S499-L503 WeakPolarHBondContact O-CD1 3.13Å; S499-L503 WeakPolarHBondContact O-CG 3.21Å
500	V	89.5	Confident	82.2	Confident	0 Å²	0	57.3 Å²	57.3	0%	0	31%	0.306	C	S	.	.	I	π-helix	trans	-96	-45.9	-172.4	-176.8	0	0	0	0	111.5	F422 V438 I496 L503 L504 L514	F422-V500 HydrophobicContact CD1-CG2 4.32Å; F422-V500 HydrophobicContact CD2-CG2 4.13Å; F422-V500 HydrophobicContact CE1-CG2 3.9Å; F422-V500 HydrophobicContact CE2-CG2 3.69Å; F422-V500 HydrophobicContact CG-CG2 4.44Å; F422-V500 HydrophobicContact CZ-CG2 3.57Å; V438-V500 HydrophobicContact CG1-CG1 3.87Å; I496-V500 HydrophobicContact CD1-CG2 4.32Å; I496-V500 WeakPolarHBondContact O-CA 3.28Å; I496-V500 WeakPolarHBondContact O-CB 3.38Å; I496-V500 PolarHBondContact O-N 3.4Å; V500-L503 PolarHBondContact O-N 3.22Å; V500-L503 VanDerWaalsContact O-N 3.16Å; V500-L504 HydrophobicContact CG1-CD1 3.75Å; V500-L504 HydrophobicContact CG1-CG 4.42Å; V500-L504 PolarHBondContact O-N 3.43Å; V500-L514 HydrophobicContact CB-CD2 4.45Å; V500-L514 HydrophobicContact CG1-CD2 3.84Å
501	V	87.3	Confident	81.7	Confident	30 Å²	30	58.3 Å²	58.3	18%	0.182	31%	0.311	C	S	.	.	H	α-helix	trans	-56.3	-46.2	-179.5	171	0	0	0	0	112.2	I496 L503 L504 Q505 L514	I496-V501 HydrophobicContact CG2-CG2 4.4Å; I496-V501 WeakPolarHBondContact O-CG2 3.47Å; I496-V501 PolarHBondContact O-N 3.19Å; V501-L503 PolarHBondContact O-N 3.27Å; V501-L504 PolarHBondContact O-N 2.99Å; V501-L504 VanDerWaalsContact O-N 3.09Å; V501-Q505 HydrophobicContact CG1-CG 4.19Å; V501-Q505 WeakPolarHBondContact O-CG 3.25Å; V501-Q505 PolarHBondContact O-N 2.83Å; V501-Q505 VanDerWaalsContact O-N 3.12Å; V501-L514 HydrophobicContact CG2-CD1 4.06Å; V501-L514 HydrophobicContact CG2-CD2 3.91Å
502	P	86.3	Confident	81.2	Confident	69 Å²	69	60.3 Å²	60.3	45%	0.448	32%	0.322	S	S	.	.	H	α-helix	trans	-60.8	-29.8	179.6	-25.7	36.7	0	0	0	114.1	D497 D498 L504	D497-P502 WeakPolarHBondContact O-CD 3.49Å; D498-P502 WeakPolarHBondContact O-CG 3.18Å; P502-L504 VanDerWaalsContact C-N 3.35Å
503	L	84.7	Confident	80.6	Confident	27 Å²	27	60.7 Å²	60.7	14%	0.141	33%	0.325	C	S	.	.	H	α-helix	trans	-76.3	-23.8	178.9	-57.7	179.1	0	0	0	112.7	F422 V438 S499 V500 V501	F422-L503 HydrophobicContact CB-CD1 4.37Å; F422-L503 HydrophobicContact CD1-CD1 4.49Å; V438-L503 HydrophobicContact CG2-CB 4.33Å; V438-L503 HydrophobicContact CG2-CD1 3.93Å; S499-L503 WeakPolarHBondContact O-CD1 3.13Å; S499-L503 WeakPolarHBondContact O-CG 3.21Å; V500-L503 PolarHBondContact O-N 3.22Å; V500-L503 VanDerWaalsContact O-N 3.16Å; V501-L503 PolarHBondContact O-N 3.27Å
504	L	84.3	Confident	80.3	Confident	6 Å²	6	59.5 Å²	59.5	3%	0.031	32%	0.32	C	S	.	.	H	α-helix	trans	-105.4	-11.6	-172.9	-63.7	-178.4	0	0	0	114.1	V435 V438 V500 V501 P502 S506 C507 C513 L514	V435-L504 HydrophobicContact CB-CD2 4.38Å; V435-L504 HydrophobicContact CG1-CD2 4.24Å; V435-L504 HydrophobicContact CG2-CD2 4.09Å; V438-L504 HydrophobicContact CB-CD2 4.45Å; V438-L504 HydrophobicContact CG1-CD1 4.26Å; V438-L504 HydrophobicContact CG1-CD2 4.23Å; V438-L504 HydrophobicContact CG1-CG 4.36Å; V500-L504 HydrophobicContact CG1-CD1 3.75Å; V500-L504 HydrophobicContact CG1-CG 4.42Å; V500-L504 PolarHBondContact O-N 3.43Å; V501-L504 PolarHBondContact O-N 2.99Å; V501-L504 VanDerWaalsContact O-N 3.09Å; P502-L504 VanDerWaalsContact C-N 3.35Å; L504-S506 PolarHBondContact O-N 2.81Å; L504-C507 PolarHBondContact O-N 3.16Å; L504-C513 HydrophobicContact CD1-CB 4.16Å; L504-L514 HydrophobicContact CD1-CD1 4.44Å; L504-L514 HydrophobicContact CD1-CD2 4.17Å; L504-L514 HydrophobicContact CD1-CG 3.93Å
505	Q	72.7	Confident	79.9	Confident	156 Å²	156	59 Å²	59	73%	0.729	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.7	-27.5	-176.3	-85.8	175.4	13.2	0	0	115	V501	V501-Q505 HydrophobicContact CG1-CG 4.19Å; V501-Q505 WeakPolarHBondContact O-CG 3.25Å; V501-Q505 PolarHBondContact O-N 2.83Å; V501-Q505 VanDerWaalsContact O-N 3.12Å
506	S	65.1	Low	79.4	Confident	101 Å²	101	63.1 Å²	63.1	71%	0.706	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91	-7.7	-177.8	55.8	0	0	0	0	114.1	L504	L504-S506 PolarHBondContact O-N 2.81Å
507	C	66.9	Low	78.8	Confident	33 Å²	33	63 Å²	63	22%	0.223	34%	0.343	C	S	.	.			trans	-119.9	122.4	-169.8	-63.8	0	0	0	0	111.5	V435 L504 E509 G510	V435-C507 HydrophobicContact CG2-CB 3.63Å; L504-C507 PolarHBondContact O-N 3.16Å; C507-E509 VanDerWaalsContact C-N 3.26Å; C507-E509 PolarHBondContact O-N 3.35Å; C507-G510 PolarHBondContact O-N 3.12Å
508	P	68.4	Low	78.4	Confident	124 Å²	124	66 Å²	66	81%	0.805	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-28.9	-178	25	-33	0	0	0	113.3	G510	P508-G510 PolarHBondContact O-N 3.12Å
509	E	68.9	Low	78.1	Confident	140 Å²	140	70.5 Å²	70.5	65%	0.654	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.8	-18.3	176.1	-64.4	179.9	173.7	0	0	113.1	V435 C507 E511 N512	V435-E509 HydrophobicContact CG1-CB 4.27Å; C507-E509 VanDerWaalsContact C-N 3.26Å; C507-E509 PolarHBondContact O-N 3.35Å; E509-E511 PolarHBondContact O-N 3.04Å; E509-N512 PolarHBondContact O-N 3.06Å
510	G	70.3	Confident	77.5	Confident	2 Å²	2	72.5 Å²	72.5	2%	0.021	37%	0.368	C	S	.	.	H	α-helix	trans	-63.1	-26.5	-180	0	0	0	0	0	114	C507 P508 N512 C513 L514	C507-G510 PolarHBondContact O-N 3.12Å; P508-G510 PolarHBondContact O-N 3.12Å; G510-N512 VanDerWaalsContact C-N 3.32Å; G510-N512 PolarHBondContact O-N 3.36Å; G510-C513 PolarHBondContact O-N 2.9Å; G510-L514 WeakPolarHBondContact O-CG 3.5Å; G510-L514 PolarHBondContact O-N 3.28Å
511	E	72.9	Confident	76.9	Confident	119 Å²	119	72.9 Å²	72.9	56%	0.556	37%	0.37	S	S	*	.	H	α-helix	trans	-65.7	-34.5	179.5	-159.1	-171	142.1	0	0	112.1	E509 L514 K515	E509-E511 PolarHBondContact O-N 3.04Å; E511-L514 PolarHBondContact O-N 3.41Å; E511-K515 VanDerWaalsContact O-CG 3.29Å; E511-K515 WeakPolarHBondContact O-CG 3.48Å; E511-K515 PolarHBondContact O-N 3.17Å; E511-K515 WeakPolarHBondContact OE1-CE 3.33Å; E511-K515 IonicContact OE1-NZ 2.71Å; E511-K515 PolarHBondContact OE1-NZ 2.95Å
512	N	78.2	Confident	76.6	Confident	98 Å²	98	73.8 Å²	73.8	52%	0.524	38%	0.376	S	S	.	.	H	α-helix	trans	-69.1	-43.1	177.7	-69.2	-18.5	0	0	0	111.3	E509 G510 L514 K515 D516	E509-N512 PolarHBondContact O-N 3.06Å; G510-N512 VanDerWaalsContact C-N 3.32Å; G510-N512 PolarHBondContact O-N 3.36Å; N512-L514 VanDerWaalsContact C-N 3.29Å; N512-L514 PolarHBondContact O-N 3.03Å; N512-K515 WeakPolarHBondContact O-CB 3.47Å; N512-K515 PolarHBondContact O-N 3.41Å; N512-K515 VanDerWaalsContact O-N 3.16Å; N512-D516 PolarHBondContact O-N 3.06Å
513	C	76.9	Confident	76.4	Confident	9 Å²	9	72.3 Å²	72.3	6%	0.061	37%	0.37	C	S	.	.	H	α-helix	trans	-59.6	-39.7	176.7	-169.2	0	0	0	0	112	L442 L504 G510 A517	L442-C513 WeakPolarHBondContact CD2-SG 3.15Å; L504-C513 HydrophobicContact CD1-CB 4.16Å; G510-C513 PolarHBondContact O-N 2.9Å; C513-A517 PolarHBondContact O-N 2.8Å
514	L	81.4	Confident	76.2	Confident	25 Å²	25	71.1 Å²	71.1	13%	0.131	36%	0.363	C	S	.	.	H	α-helix	trans	-71.1	-37	176	-68.9	171.6	0	0	0	112.6	I496 V500 V501 L504 G510 E511 N512 R518	I496-L514 HydrophobicContact CG2-CD2 3.82Å; V500-L514 HydrophobicContact CB-CD2 4.45Å; V500-L514 HydrophobicContact CG1-CD2 3.84Å; V501-L514 HydrophobicContact CG2-CD1 4.06Å; V501-L514 HydrophobicContact CG2-CD2 3.91Å; L504-L514 HydrophobicContact CD1-CD1 4.44Å; L504-L514 HydrophobicContact CD1-CD2 4.17Å; L504-L514 HydrophobicContact CD1-CG 3.93Å; G510-L514 WeakPolarHBondContact O-CG 3.5Å; G510-L514 PolarHBondContact O-N 3.28Å; E511-L514 PolarHBondContact O-N 3.41Å; N512-L514 VanDerWaalsContact C-N 3.29Å; N512-L514 PolarHBondContact O-N 3.03Å; L514-R518 WeakPolarHBondContact O-CB 3.33Å; L514-R518 WeakPolarHBondContact O-CG 3.41Å; L514-R518 PolarHBondContact O-N 2.79Å; L514-R518 VanDerWaalsContact O-N 3.08Å
515	K	81.2	Confident	76.1	Confident	106 Å²	106	71.7 Å²	71.7	46%	0.461	37%	0.366	S	S	.	.	H	α-helix	trans	-61.4	-43.8	175.1	-78.9	170.6	-176.9	163.9	0	111.5	E511 N512 R518 R519	E511-K515 VanDerWaalsContact O-CG 3.29Å; E511-K515 WeakPolarHBondContact O-CG 3.48Å; E511-K515 PolarHBondContact O-N 3.17Å; E511-K515 WeakPolarHBondContact OE1-CE 3.33Å; E511-K515 IonicContact OE1-NZ 2.71Å; E511-K515 PolarHBondContact OE1-NZ 2.95Å; N512-K515 WeakPolarHBondContact O-CB 3.47Å; N512-K515 PolarHBondContact O-N 3.41Å; N512-K515 VanDerWaalsContact O-N 3.16Å; K515-R518 PolarHBondContact O-N 3.49Å; K515-R519 VanDerWaalsContact O-CB 3.3Å; K515-R519 WeakPolarHBondContact O-CB 3.35Å; K515-R519 PolarHBondContact O-N 3.38Å
516	D	78.6	Confident	76.7	Confident	99 Å²	99	67.5 Å²	67.5	53%	0.529	35%	0.351	S	S	.	.	H	α-helix	trans	-64.2	-43.9	-179.2	-70.7	-21.1	0	0	0	112	N512 R519 L520	N512-D516 PolarHBondContact O-N 3.06Å; D516-R519 PolarHBondContact O-N 2.86Å; D516-L520 PolarHBondContact O-N 2.84Å
517	A	76.3	Confident	77.6	Confident	2 Å²	2	64.8 Å²	64.8	2%	0.017	33%	0.326	C	S	.	.	H	α-helix	trans	-64.7	-41.7	176.4	0	0	0	0	0	113	L442 F492 I496 C513 R519 L520	L442-A517 HydrophobicContact CD1-CB 4.02Å; L442-A517 HydrophobicContact CD2-CB 3.71Å; L442-A517 HydrophobicContact CG-CB 4.06Å; F492-A517 HydrophobicContact CZ-CB 4.35Å; I496-A517 HydrophobicContact CD1-CB 3.94Å; C513-A517 PolarHBondContact O-N 2.8Å; A517-R519 VanDerWaalsContact C-N 3.34Å; A517-L520 PolarHBondContact O-N 3.47Å
518	R	79.2	Confident	78.5	Confident	124 Å²	124	63.2 Å²	63.2	47%	0.468	32%	0.316	S	S	.	.	H	α-helix	trans	-69.5	-31	177.5	-71.2	177.2	176.6	178.1	-1.9	112.5	D497 L514 K515 L520 M521 T522	D497-R518 IonicContact OD1-NH2 2.8Å; D497-R518 PolarHBondContact OD1-NH2 3.47Å; L514-R518 WeakPolarHBondContact O-CB 3.33Å; L514-R518 WeakPolarHBondContact O-CG 3.41Å; L514-R518 PolarHBondContact O-N 2.79Å; L514-R518 VanDerWaalsContact O-N 3.08Å; K515-R518 PolarHBondContact O-N 3.49Å; R518-L520 VanDerWaalsContact C-N 3.32Å; R518-L520 PolarHBondContact O-N 3.08Å; R518-M521 PolarHBondContact O-N 3.19Å; R518-T522 PolarHBondContact O-N 3.17Å; R518-T522 PolarHBondContact O-OG1 3.35Å
519	R	81.9	Confident	79.2	Confident	189 Å²	189	58.4 Å²	58.4	71%	0.713	28%	0.283	S	S	*	.	H	α-helix	trans	-63.4	-36.1	177.7	-167	179	-171.7	177.6	2.3	112.6	K515 D516 A517 T522 A523	K515-R519 VanDerWaalsContact O-CB 3.3Å; K515-R519 WeakPolarHBondContact O-CB 3.35Å; K515-R519 PolarHBondContact O-N 3.38Å; D516-R519 PolarHBondContact O-N 2.86Å; A517-R519 VanDerWaalsContact C-N 3.34Å; R519-T522 WeakPolarHBondContact O-CB 3.43Å; R519-T522 PolarHBondContact O-N 3.4Å; R519-A523 PolarHBondContact O-N 2.95Å
520	L	75.8	Confident	80	Confident	63 Å²	63	58 Å²	58	33%	0.33	28%	0.279	S	S	.	.	H	α-helix	trans	-67.3	-39.4	176	-72.7	169.6	0	0	0	112	T446 D516 A517 R518 T522 A523 V524	T446-L520 HydrophobicContact CG2-CD1 3.68Å; D516-L520 PolarHBondContact O-N 2.84Å; A517-L520 PolarHBondContact O-N 3.47Å; R518-L520 VanDerWaalsContact C-N 3.32Å; R518-L520 PolarHBondContact O-N 3.08Å; L520-T522 VanDerWaalsContact C-N 3.3Å; L520-T522 PolarHBondContact O-N 3.46Å; L520-A523 WeakPolarHBondContact O-CB 3.37Å; L520-A523 PolarHBondContact O-N 2.86Å; L520-V524 PolarHBondContact O-N 3.39Å; L520-V524 VanDerWaalsContact O-N 3.12Å
521	M	78	Confident	80.5	Confident	8 Å²	8	57.9 Å²	57.9	4%	0.039	28%	0.278	C	S	.	.	H	α-helix	trans	-63.2	-39	175.3	-165.6	56.1	71.4	0	0	111.7	S489 F492 R518 A523 V524 E525	S489-M521 WeakPolarHBondContact CB-SD 3.37Å; S489-M521 PolarHBondContact OG-SD 3.08Å; F492-M521 HydrophobicContact CB-CE 3.66Å; F492-M521 HydrophobicContact CD1-CE 3.17Å; F492-M521 HydrophobicContact CE1-CE 3.87Å; F492-M521 HydrophobicContact CG-CE 3.54Å; R518-M521 PolarHBondContact O-N 3.19Å; M521-A523 PolarHBondContact O-N 3.46Å; M521-V524 WeakPolarHBondContact O-CB 3.39Å; M521-V524 PolarHBondContact O-N 3.34Å; M521-V524 VanDerWaalsContact O-N 3.16Å; M521-V524 HydrophobicContact SD-CB 4.31Å; M521-V524 HydrophobicContact SD-CG1 4.44Å; M521-E525 WeakPolarHBondContact O-CG 3.36Å; M521-E525 PolarHBondContact O-N 3Å
522	T	80.8	Confident	81.1	Confident	50 Å²	50	52.3 Å²	52.3	31%	0.307	25%	0.252	S	S	.	.	H	α-helix	trans	-60.9	-32.3	172.7	-51.6	0	0	0	0	112.6	R518 R519 L520 T526	R518-T522 PolarHBondContact O-N 3.17Å; R518-T522 PolarHBondContact O-OG1 3.35Å; R519-T522 WeakPolarHBondContact O-CB 3.43Å; R519-T522 PolarHBondContact O-N 3.4Å; L520-T522 VanDerWaalsContact C-N 3.3Å; L520-T522 PolarHBondContact O-N 3.46Å; T522-T526 WeakPolarHBondContact O-CB 3.37Å; T522-T526 PolarHBondContact O-N 3.31Å; T522-T526 PolarHBondContact O-OG1 3.45Å
523	A	81.5	Confident	81.4	Confident	38 Å²	38	50.2 Å²	50.2	31%	0.314	24%	0.241	S	C	.	.	H	α-helix	trans	-68.9	-41.8	175.5	0	0	0	0	0	111.8	R519 L520 M521 T526 K527	R519-A523 PolarHBondContact O-N 2.95Å; L520-A523 WeakPolarHBondContact O-CB 3.37Å; L520-A523 PolarHBondContact O-N 2.86Å; M521-A523 PolarHBondContact O-N 3.46Å; A523-T526 PolarHBondContact O-N 3.29Å; A523-K527 PolarHBondContact O-N 3.02Å; A523-K527 VanDerWaalsContact O-N 3.12Å
524	V	82.2	Confident	81.8	Confident	1 Å²	1	53.4 Å²	53.4	1%	0.006	25%	0.254	C	S	.	.	H	α-helix	trans	-59.3	-50.6	172.5	170.8	0	0	0	0	110.7	V454 E455 I458 L520 M521 T526 K527 L528	V454-V524 HydrophobicContact CG1-CG1 3.65Å; V454-V524 HydrophobicContact CG1-CG2 4.1Å; E455-V524 HydrophobicContact CG-CG2 3.77Å; I458-V524 HydrophobicContact CD1-CG1 3.69Å; L520-V524 PolarHBondContact O-N 3.39Å; L520-V524 VanDerWaalsContact O-N 3.12Å; M521-V524 WeakPolarHBondContact O-CB 3.39Å; M521-V524 PolarHBondContact O-N 3.34Å; M521-V524 VanDerWaalsContact O-N 3.16Å; M521-V524 HydrophobicContact SD-CB 4.31Å; M521-V524 HydrophobicContact SD-CG1 4.44Å; V524-T526 VanDerWaalsContact C-N 3.31Å; V524-T526 PolarHBondContact O-N 2.89Å; V524-K527 PolarHBondContact O-N 3.14Å; V524-K527 VanDerWaalsContact O-N 3.09Å; V524-L528 HydrophobicContact CG1-CD1 4.21Å; V524-L528 WeakPolarHBondContact O-CG 3.27Å; V524-L528 PolarHBondContact O-N 3.39Å
525	E	82.2	Confident	81.9	Confident	19 Å²	19	52.8 Å²	52.8	9%	0.089	25%	0.251	C	S	.	.	H	α-helix	trans	-55.4	-44.4	176.1	-70.6	178.8	150	0	0	112	M521 K527 L528 D529 F738	M521-E525 WeakPolarHBondContact O-CG 3.36Å; M521-E525 PolarHBondContact O-N 3Å; E525-K527 VanDerWaalsContact C-N 3.29Å; E525-K527 PolarHBondContact O-N 3.29Å; E525-L528 PolarHBondContact O-N 3.05Å; E525-L528 VanDerWaalsContact O-N 3.17Å; E525-D529 PolarHBondContact O-N 3.39Å; E525-F738 HydrophobicContact CB-CB 4.2Å; E525-F738 HydrophobicContact CG-CB 4.02Å
526	T	85	Confident	82.2	Confident	68 Å²	68	47.8 Å²	47.8	42%	0.417	23%	0.229	S	C	.	.	H	α-helix	trans	-63	-35.3	179.1	-55.6	0	0	0	0	112	T522 A523 V524 K530	T522-T526 WeakPolarHBondContact O-CB 3.37Å; T522-T526 PolarHBondContact O-N 3.31Å; T522-T526 PolarHBondContact O-OG1 3.45Å; A523-T526 PolarHBondContact O-N 3.29Å; V524-T526 VanDerWaalsContact C-N 3.31Å; V524-T526 PolarHBondContact O-N 2.89Å; T526-K530 WeakPolarHBondContact O-CG 3.45Å; T526-K530 PolarHBondContact O-N 3.05Å
527	K	84.2	Confident	82.6	Confident	44 Å²	44	45.2 Å²	45.2	19%	0.191	22%	0.217	C	C	.	.	H	α-helix	trans	-72	-38.3	175.3	-70.8	-175.2	178.4	-171.1	0	111.7	E455 I458 D459 L462 A523 V524 E525 K530 G531	E455-K527 IonicContact OE2-NZ 3.18Å; I458-K527 HydrophobicContact CG2-CB 3.71Å; I458-K527 HydrophobicContact CG2-CD 4.36Å; D459-K527 WeakPolarHBondContact OD1-CD 3.45Å; D459-K527 WeakPolarHBondContact OD1-CE 3.33Å; D459-K527 IonicContact OD1-NZ 3.83Å; D459-K527 PolarHBondContact OD1-NZ 3.45Å; D459-K527 IonicContact OD2-NZ 2.66Å; D459-K527 PolarHBondContact OD2-NZ 3.41Å; L462-K527 HydrophobicContact CD1-CB 4.2Å; A523-K527 PolarHBondContact O-N 3.02Å; A523-K527 VanDerWaalsContact O-N 3.12Å; V524-K527 PolarHBondContact O-N 3.14Å; V524-K527 VanDerWaalsContact O-N 3.09Å; E525-K527 VanDerWaalsContact C-N 3.29Å; E525-K527 PolarHBondContact O-N 3.29Å; K527-K530 PolarHBondContact O-N 3.32Å; K527-G531 PolarHBondContact O-N 3.24Å; K527-G531 VanDerWaalsContact O-N 3.1Å
528	L	84.1	Confident	83	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-62.7	-44	173.8	-66.2	176.3	0	0	0	111.3	I458 F478 L481 L482 A485 V524 E525 K530 G531 L532 F738	I458-L528 HydrophobicContact CD1-CD2 3.61Å; I458-L528 HydrophobicContact CD1-CG 3.97Å; I458-L528 HydrophobicContact CG1-CD2 3.79Å; I458-L528 HydrophobicContact CG2-CD2 4.4Å; F478-L528 HydrophobicContact CZ-CD2 4.48Å; L481-L528 HydrophobicContact CD2-CD2 4.38Å; L482-L528 HydrophobicContact CD1-CB 3.74Å; L482-L528 HydrophobicContact CD1-CD1 4.08Å; L482-L528 HydrophobicContact CD1-CD2 3.71Å; L482-L528 HydrophobicContact CD1-CG 4.03Å; A485-L528 HydrophobicContact CB-CD1 3.94Å; A485-L528 HydrophobicContact CB-CD2 3.96Å; V524-L528 HydrophobicContact CG1-CD1 4.21Å; V524-L528 WeakPolarHBondContact O-CG 3.27Å; V524-L528 PolarHBondContact O-N 3.39Å; E525-L528 PolarHBondContact O-N 3.05Å; E525-L528 VanDerWaalsContact O-N 3.17Å; L528-K530 VanDerWaalsContact C-N 3.34Å; L528-K530 PolarHBondContact O-N 2.72Å; L528-G531 PolarHBondContact O-N 3.02Å; L528-G531 VanDerWaalsContact O-N 3.13Å; L528-L532 PolarHBondContact O-N 2.65Å; L528-F738 HydrophobicContact CB-CE2 4.18Å; L528-F738 HydrophobicContact CD1-CZ 4.38Å
529	D	83.8	Confident	83.4	Confident	22 Å²	22	39.9 Å²	39.9	12%	0.118	20%	0.2	C	C	.	.	H	α-helix	trans	-56.4	-45.8	174.5	-77.6	1.3	0	0	0	111.3	E525 G531 L532 D533 Y737 F738	E525-D529 PolarHBondContact O-N 3.39Å; D529-G531 VanDerWaalsContact C-N 3.33Å; D529-G531 PolarHBondContact O-N 2.93Å; D529-L532 PolarHBondContact O-N 3.34Å; D529-D533 WeakPolarHBondContact O-CB 3.27Å; D529-D533 PolarHBondContact O-N 2.85Å; D529-Y737 VanDerWaalsContact CG-CB 3.49Å; D529-Y737 WeakPolarHBondContact OD1-CB 3.25Å; D529-Y737 PolarHBondContact OD2-N 3.42Å; D529-F738 VanDerWaalsContact OD1-CD2 3.28Å; D529-F738 WeakPolarHBondContact OD1-CD2 2.98Å
530	K	84.7	Confident	83.7	Confident	132 Å²	132	31.5 Å²	31.5	57%	0.574	17%	0.169	S	C	*	.	H	α-helix	trans	-61.6	-38.6	176.4	-75.6	176.8	-178.4	-178.3	0	112.9	T526 K527 L528 K534	T526-K530 WeakPolarHBondContact O-CG 3.45Å; T526-K530 PolarHBondContact O-N 3.05Å; K527-K530 PolarHBondContact O-N 3.32Å; L528-K530 VanDerWaalsContact C-N 3.34Å; L528-K530 PolarHBondContact O-N 2.72Å; K530-K534 WeakPolarHBondContact O-CG 3.3Å; K530-K534 PolarHBondContact O-N 3.25Å; K530-K534 VanDerWaalsContact O-N 3.11Å
531	G	81.2	Confident	84.3	Confident	0 Å²	0	30 Å²	30	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-73.7	-38.1	179.3	0	0	0	0	0	112.6	K527 L528 D529 D533 K534 V535	K527-G531 PolarHBondContact O-N 3.24Å; K527-G531 VanDerWaalsContact O-N 3.1Å; L528-G531 PolarHBondContact O-N 3.02Å; L528-G531 VanDerWaalsContact O-N 3.13Å; D529-G531 VanDerWaalsContact C-N 3.33Å; D529-G531 PolarHBondContact O-N 2.93Å; G531-D533 VanDerWaalsContact C-N 3.33Å; G531-D533 PolarHBondContact O-N 3.26Å; G531-K534 PolarHBondContact O-N 3.3Å; G531-V535 WeakPolarHBondContact O-CG2 3.45Å; G531-V535 PolarHBondContact O-N 3.12Å
532	L	85.7	Confident	84.8	Confident	2 Å²	2	30.9 Å²	30.9	1%	0.01	17%	0.166	C	C	.	.	H	α-helix	trans	-61.9	-42	172.2	-173.6	62.6	0	0	0	111.3	L479 L482 L528 D529 K534 V535 L536 L592 T600 Y737	L479-L532 HydrophobicContact CD2-CD1 4.39Å; L482-L532 HydrophobicContact CD2-CD1 4.19Å; L528-L532 PolarHBondContact O-N 2.65Å; D529-L532 PolarHBondContact O-N 3.34Å; L532-K534 PolarHBondContact O-N 2.87Å; L532-V535 PolarHBondContact O-N 2.95Å; L532-L536 WeakPolarHBondContact O-CG 3.15Å; L532-L536 PolarHBondContact O-N 3.5Å; L532-L592 HydrophobicContact CD1-CD1 4.27Å; L532-T600 HydrophobicContact CD1-CG2 3.84Å; L532-T600 HydrophobicContact CD2-CG2 4.21Å; L532-T600 HydrophobicContact CG-CG2 4.33Å; L532-Y737 HydrophobicContact CD2-CD1 3.51Å; L532-Y737 HydrophobicContact CD2-CE1 3.81Å; L532-Y737 HydrophobicContact CD2-CG 4.02Å
533	D	85.9	Confident	85.3	Confident	53 Å²	53	28.6 Å²	28.6	28%	0.283	15%	0.152	S	C	.	.	H	α-helix	trans	-60.1	-42.4	174.4	-179.6	64.4	0	0	0	112.6	D529 G531 L536 T537 R607	D529-D533 WeakPolarHBondContact O-CB 3.27Å; D529-D533 PolarHBondContact O-N 2.85Å; G531-D533 VanDerWaalsContact C-N 3.33Å; G531-D533 PolarHBondContact O-N 3.26Å; D533-L536 PolarHBondContact O-N 3.48Å; D533-T537 VanDerWaalsContact O-CB 3.31Å; D533-T537 WeakPolarHBondContact O-CB 3.39Å; D533-T537 PolarHBondContact O-N 3.45Å; D533-T537 PolarHBondContact O-OG1 3.14Å; D533-R607 IonicContact OD1-CZ 3.13Å; D533-R607 IonicContact OD1-NH1 2.98Å; D533-R607 PolarHBondContact OD1-NH1 3.42Å; D533-R607 IonicContact OD1-NH2 3.31Å; D533-R607 PolarHBondContact OD1-NH2 3.48Å
534	K	84.3	Confident	85.7	Confident	76 Å²	76	32.2 Å²	32.2	33%	0.33	16%	0.157	S	C	.	.	H	α-helix	trans	-62.6	-42.6	173.7	-75.1	-174.1	177.8	-170.8	0	112.3	L462 V465 T467 K530 G531 L532 T537 A538	L462-K534 PolarHBondContact O-NZ 3.48Å; L462-K534 VanDerWaalsContact O-NZ 3.15Å; V465-K534 HydrophobicContact CB-CB 4.45Å; V465-K534 HydrophobicContact CB-CD 4.41Å; V465-K534 HydrophobicContact CG1-CB 3.83Å; T467-K534 HydrophobicContact CG2-CD 4.32Å; T467-K534 HydrophobicContact CG2-CG 4.39Å; K530-K534 WeakPolarHBondContact O-CG 3.3Å; K530-K534 PolarHBondContact O-N 3.25Å; K530-K534 VanDerWaalsContact O-N 3.11Å; G531-K534 PolarHBondContact O-N 3.3Å; L532-K534 PolarHBondContact O-N 2.87Å; K534-T537 PolarHBondContact O-N 3.18Å; K534-A538 WeakPolarHBondContact O-CB 3.32Å; K534-A538 PolarHBondContact O-N 3.02Å
535	V	83.8	Confident	86.1	Confident	12 Å²	12	36 Å²	36	7%	0.073	17%	0.174	C	C	.	.	H	α-helix	trans	-62.7	-48.2	177.1	171.3	0	0	0	0	110.7	V465 F478 L479 G531 L532 T537 A538 I539	V465-V535 HydrophobicContact CG1-CG2 4.18Å; F478-V535 HydrophobicContact CB-CG2 4.37Å; F478-V535 HydrophobicContact CD1-CG2 3.88Å; F478-V535 HydrophobicContact CG-CG2 4.37Å; L479-V535 HydrophobicContact CD2-CG1 4.35Å; G531-V535 WeakPolarHBondContact O-CG2 3.45Å; G531-V535 PolarHBondContact O-N 3.12Å; L532-V535 PolarHBondContact O-N 2.95Å; V535-T537 VanDerWaalsContact C-N 3.3Å; V535-T537 PolarHBondContact O-N 3.13Å; V535-A538 PolarHBondContact O-N 2.95Å; V535-I539 HydrophobicContact CG1-CD1 4.03Å; V535-I539 WeakPolarHBondContact O-CG1 3.45Å; V535-I539 PolarHBondContact O-N 3.45Å
536	L	87.6	Confident	86.5	Confident	1 Å²	1	35.8 Å²	35.8	1%	0.005	17%	0.173	C	C	.	.	H	α-helix	trans	-60.8	-40.1	176.6	-70.4	-179.9	0	0	0	111.7	L532 D533 I539 V540 T600 E603 L604	L532-L536 WeakPolarHBondContact O-CG 3.15Å; L532-L536 PolarHBondContact O-N 3.5Å; D533-L536 PolarHBondContact O-N 3.48Å; L536-I539 PolarHBondContact O-N 3.16Å; L536-V540 WeakPolarHBondContact O-CB 3.49Å; L536-V540 WeakPolarHBondContact O-CG2 3.3Å; L536-V540 PolarHBondContact O-N 2.86Å; L536-T600 HydrophobicContact CD1-CG2 4.37Å; L536-T600 HydrophobicContact CD2-CG2 4.03Å; L536-E603 HydrophobicContact CD1-CB 4.28Å; L536-E603 HydrophobicContact CD1-CG 3.97Å; L536-L604 HydrophobicContact CD2-CB 3.9Å; L536-L604 HydrophobicContact CD2-CD1 4.09Å; L536-L604 HydrophobicContact CD2-CG 4.45Å
537	T	87.2	Confident	86.7	Confident	45 Å²	45	32.7 Å²	32.7	28%	0.276	15%	0.154	S	C	.	.	H	α-helix	trans	-65.1	-40.7	176.4	-58.5	0	0	0	0	111.9	D533 K534 V535 V540 N541 R607	D533-T537 VanDerWaalsContact O-CB 3.31Å; D533-T537 WeakPolarHBondContact O-CB 3.39Å; D533-T537 PolarHBondContact O-N 3.45Å; D533-T537 PolarHBondContact O-OG1 3.14Å; K534-T537 PolarHBondContact O-N 3.18Å; V535-T537 VanDerWaalsContact C-N 3.3Å; V535-T537 PolarHBondContact O-N 3.13Å; T537-V540 PolarHBondContact O-N 3.34Å; T537-N541 VanDerWaalsContact O-CB 3.29Å; T537-N541 WeakPolarHBondContact O-CB 3.46Å; T537-N541 PolarHBondContact O-N 3.35Å; T537-N541 PolarHBondContact O-ND2 3.26Å; T537-R607 PolarHBondContact OG1-NH1 2.73Å
538	A	84.4	Confident	86.9	Confident	14 Å²	14	34.7 Å²	34.7	12%	0.116	17%	0.173	C	C	.	.	H	α-helix	trans	-62.6	-45	175.4	0	0	0	0	0	111.9	T474 K534 V535 V540 N541 H542	T474-A538 HydrophobicContact CG2-CB 4.23Å; K534-A538 WeakPolarHBondContact O-CB 3.32Å; K534-A538 PolarHBondContact O-N 3.02Å; V535-A538 PolarHBondContact O-N 2.95Å; A538-V540 PolarHBondContact O-N 3.36Å; A538-N541 PolarHBondContact O-N 3.43Å; A538-H542 PolarHBondContact O-N 2.83Å
539	I	87.1	Confident	87.1	Confident	1 Å²	1	37.7 Å²	37.7	1%	0.005	19%	0.194	C	C	.	.	H	α-helix	trans	-58	-48.7	175.7	-66.9	166.3	0	0	0	110.4	T474 V535 L536 H542 V543 Y580 Q584 L588 L604	T474-I539 HydrophobicContact CG2-CG1 4.44Å; V535-I539 HydrophobicContact CG1-CD1 4.03Å; V535-I539 WeakPolarHBondContact O-CG1 3.45Å; V535-I539 PolarHBondContact O-N 3.45Å; L536-I539 PolarHBondContact O-N 3.16Å; I539-H542 PolarHBondContact O-N 2.89Å; I539-V543 WeakPolarHBondContact O-CG2 3.32Å; I539-V543 PolarHBondContact O-N 3.42Å; I539-Y580 HydrophobicContact CG2-CE1 4Å; I539-Q584 HydrophobicContact CD1-CB 4.2Å; I539-Q584 HydrophobicContact CD1-CG 4.42Å; I539-Q584 HydrophobicContact CG1-CB 4.47Å; I539-Q584 HydrophobicContact CG1-CG 4.18Å; I539-Q584 HydrophobicContact CG2-CB 4.34Å; I539-Q584 HydrophobicContact CG2-CG 4.18Å; I539-L588 HydrophobicContact CD1-CD1 4.38Å; I539-L604 HydrophobicContact CB-CD1 4.46Å; I539-L604 HydrophobicContact CG2-CD1 3.8Å
540	V	88.9	Confident	87.4	Confident	12 Å²	12	40.4 Å²	40.4	7%	0.073	21%	0.206	C	C	.	.	H	α-helix	trans	-69.5	-36.8	-177.2	174.3	0	0	0	0	111.9	L536 T537 A538 H542 V543 R544 L604 R607 V611	L536-V540 WeakPolarHBondContact O-CB 3.49Å; L536-V540 WeakPolarHBondContact O-CG2 3.3Å; L536-V540 PolarHBondContact O-N 2.86Å; T537-V540 PolarHBondContact O-N 3.34Å; A538-V540 PolarHBondContact O-N 3.36Å; V540-H542 VanDerWaalsContact C-N 3.34Å; V540-V543 PolarHBondContact O-N 2.88Å; V540-R544 PolarHBondContact O-N 3.4Å; V540-L604 HydrophobicContact CG2-CD1 4.21Å; V540-R607 HydrophobicContact CG1-CB 4.33Å; V540-R607 HydrophobicContact CG2-CB 3.64Å; V540-V611 HydrophobicContact CG1-CB 4.46Å; V540-V611 HydrophobicContact CG1-CG2 3.34Å
541	N	88.3	Confident	87.6	Confident	31 Å²	31	34.9 Å²	34.9	17%	0.166	18%	0.182	C	C	.	.	H	α-helix	trans	-66.1	-36.8	174.3	-75.6	-14.4	0	0	0	111.7	T537 A538 R544 F545	T537-N541 VanDerWaalsContact O-CB 3.29Å; T537-N541 WeakPolarHBondContact O-CB 3.46Å; T537-N541 PolarHBondContact O-N 3.35Å; T537-N541 PolarHBondContact O-ND2 3.26Å; A538-N541 PolarHBondContact O-N 3.43Å; N541-R544 PolarHBondContact O-N 2.92Å; N541-R544 PolarHBondContact OD1-NH1 3.39Å; N541-F545 WeakPolarHBondContact O-CB 3.46Å; N541-F545 PolarHBondContact O-N 3.03Å
542	H	88.3	Confident	87.7	Confident	28 Å²	28	41.3 Å²	41.3	13%	0.13	21%	0.211	C	C	.	.	H	α-helix	trans	-67	-39.8	173.8	-167	69.2	0	0	0	111.8	G472 A538 I539 V540 R544 F545 I546 Y580	G472-H542 VanDerWaalsContact CA-CE1 3.41Å; G472-H542 WeakPolarHBondContact CA-CE1 3.47Å; A538-H542 PolarHBondContact O-N 2.83Å; I539-H542 PolarHBondContact O-N 2.89Å; V540-H542 VanDerWaalsContact C-N 3.34Å; H542-R544 VanDerWaalsContact C-N 3.34Å; H542-R544 PolarHBondContact O-N 3.34Å; H542-F545 WeakPolarHBondContact O-CB 3.11Å; H542-F545 PolarHBondContact O-N 2.93Å; H542-I546 WeakPolarHBondContact O-CG1 3.49Å; H542-I546 PolarHBondContact O-N 3.36Å; H542-Y580 HydrophobicContact CB-CE1 3.92Å; H542-Y580 AromaticContact CD2-CD1 3.82Å; H542-Y580 AromaticContact CD2-CD2 3.63Å; H542-Y580 AromaticContact CD2-CE1 3.58Å; H542-Y580 AromaticContact CD2-CE2 3.38Å; H542-Y580 WeakPolarHBondContact CD2-CE2 3.44Å; H542-Y580 AromaticContact CD2-CG 3.85Å; H542-Y580 AromaticContact CD2-CZ 3.35Å; H542-Y580 AromaticContact CG-CZ 3.82Å
543	V	90.7	Very high	87.6	Confident	2 Å²	2	51.3 Å²	51.3	1%	0.012	25%	0.248	C	C	.	.	H	α-helix	trans	-59.4	-45	171.6	171	0	0	0	0	111.2	I539 V540 F545 I546 L547 V577 Y580 F608 V611	I539-V543 WeakPolarHBondContact O-CG2 3.32Å; I539-V543 PolarHBondContact O-N 3.42Å; V540-V543 PolarHBondContact O-N 2.88Å; V543-F545 VanDerWaalsContact C-N 3.3Å; V543-F545 PolarHBondContact O-N 2.86Å; V543-I546 PolarHBondContact O-N 3.28Å; V543-L547 HydrophobicContact CG1-CD1 3.99Å; V543-L547 HydrophobicContact CG1-CG 4.47Å; V543-L547 WeakPolarHBondContact O-CG 3.37Å; V543-L547 PolarHBondContact O-N 3.49Å; V543-V577 HydrophobicContact CG1-CG1 3.88Å; V543-V577 HydrophobicContact CG1-CG2 4.16Å; V543-V577 HydrophobicContact CG2-CG1 4.47Å; V543-Y580 HydrophobicContact CG2-CD1 3.95Å; V543-Y580 HydrophobicContact CG2-CE1 4.18Å; V543-F608 HydrophobicContact CG1-CD2 4.01Å; V543-F608 HydrophobicContact CG1-CE2 3.89Å; V543-V611 HydrophobicContact CG1-CG1 4.25Å
544	R	90.9	Very high	87.2	Confident	113 Å²	113	55.7 Å²	55.7	43%	0.426	27%	0.267	S	S	.	.	H	α-helix	trans	-59.6	-42.3	175.3	-175.9	-177.3	-69.8	142.4	-1.5	111.5	V540 N541 H542 L547 S548 V611	V540-R544 PolarHBondContact O-N 3.4Å; N541-R544 PolarHBondContact O-N 2.92Å; N541-R544 PolarHBondContact OD1-NH1 3.39Å; H542-R544 VanDerWaalsContact C-N 3.34Å; H542-R544 PolarHBondContact O-N 3.34Å; R544-L547 PolarHBondContact O-N 3.44Å; R544-S548 WeakPolarHBondContact O-CB 3.48Å; R544-S548 PolarHBondContact O-N 2.84Å; R544-S548 PolarHBondContact O-OG 3.49Å; R544-V611 HydrophobicContact CB-CG1 4.32Å
545	F	89.2	Confident	87	Confident	82 Å²	82	54.6 Å²	54.6	36%	0.36	27%	0.265	S	S	.	.	H	α-helix	trans	-58.4	-53	175.7	174.3	-99.6	0	0	0	111.2	N541 H542 V543 L547 S548 S549	N541-F545 WeakPolarHBondContact O-CB 3.46Å; N541-F545 PolarHBondContact O-N 3.03Å; H542-F545 WeakPolarHBondContact O-CB 3.11Å; H542-F545 PolarHBondContact O-N 2.93Å; V543-F545 VanDerWaalsContact C-N 3.3Å; V543-F545 PolarHBondContact O-N 2.86Å; F545-L547 VanDerWaalsContact C-N 3.32Å; F545-L547 PolarHBondContact O-N 2.73Å; F545-S548 PolarHBondContact O-N 2.97Å; F545-S548 VanDerWaalsContact O-N 3.1Å; F545-S548 PolarHBondContact O-OG 3.34Å; F545-S549 WeakPolarHBondContact O-CB 3.41Å; F545-S549 PolarHBondContact O-N 3.04Å; F545-S549 PolarHBondContact O-OG 2.99Å
546	I	90.3	Very high	87.1	Confident	14 Å²	14	54.1 Å²	54.1	7%	0.072	26%	0.262	C	S	.	.	H	α-helix	trans	-54.7	-47.7	177.6	-62.7	170.2	0	0	0	110.8	H542 V543 S548 S549 E550 L576 V577 Y580	H542-I546 WeakPolarHBondContact O-CG1 3.49Å; H542-I546 PolarHBondContact O-N 3.36Å; V543-I546 PolarHBondContact O-N 3.28Å; I546-S548 VanDerWaalsContact C-N 3.33Å; I546-S548 PolarHBondContact O-N 3.14Å; I546-S549 PolarHBondContact O-N 2.82Å; I546-S549 PolarHBondContact O-OG 3.37Å; I546-E550 HydrophobicContact CG2-CG 4.24Å; I546-E550 VanDerWaalsContact O-CB 3.3Å; I546-E550 WeakPolarHBondContact O-CB 3.3Å; I546-E550 PolarHBondContact O-N 3.2Å; I546-L576 HydrophobicContact CG2-CB 3.7Å; I546-L576 HydrophobicContact CG2-CD1 4.43Å; I546-V577 HydrophobicContact CB-CG2 4.02Å; I546-V577 HydrophobicContact CG2-CG2 3.7Å; I546-Y580 HydrophobicContact CD1-CG 4.31Å
547	L	91	Very high	86.7	Confident	3 Å²	3	57.9 Å²	57.9	2%	0.016	28%	0.278	C	S	.	.	H	α-helix	trans	-63.6	-37.2	179.8	-70.3	171.6	0	0	0	112.7	V543 R544 F545 Q551 A573 V577 V611 I612 H615	V543-L547 HydrophobicContact CG1-CD1 3.99Å; V543-L547 HydrophobicContact CG1-CG 4.47Å; V543-L547 WeakPolarHBondContact O-CG 3.37Å; V543-L547 PolarHBondContact O-N 3.49Å; R544-L547 PolarHBondContact O-N 3.44Å; F545-L547 VanDerWaalsContact C-N 3.32Å; F545-L547 PolarHBondContact O-N 2.73Å; L547-Q551 WeakPolarHBondContact O-CB 3.16Å; L547-Q551 PolarHBondContact O-N 2.91Å; L547-A573 HydrophobicContact CD2-CB 4.46Å; L547-V577 HydrophobicContact CD2-CG2 3.88Å; L547-V577 HydrophobicContact CG-CG2 3.95Å; L547-V611 HydrophobicContact CD1-CG1 3.81Å; L547-I612 HydrophobicContact CD1-CD1 3.82Å; L547-H615 HydrophobicContact CD1-CB 4.25Å
548	S	88	Confident	86.1	Confident	85 Å²	85	57.6 Å²	57.6	59%	0.594	28%	0.277	S	S	*	.	H	α-helix	trans	-76.8	-29	179.2	68.1	0	0	0	0	113.8	R544 F545 I546	R544-S548 WeakPolarHBondContact O-CB 3.48Å; R544-S548 PolarHBondContact O-N 2.84Å; R544-S548 PolarHBondContact O-OG 3.49Å; F545-S548 PolarHBondContact O-N 2.97Å; F545-S548 VanDerWaalsContact O-N 3.1Å; F545-S548 PolarHBondContact O-OG 3.34Å; I546-S548 VanDerWaalsContact C-N 3.33Å; I546-S548 PolarHBondContact O-N 3.14Å
549	S	88	Confident	85.3	Confident	63 Å²	63	65.3 Å²	65.3	44%	0.441	31%	0.311	S	S	.	.	H	α-helix	trans	-89.7	-37.6	-176.5	62.1	0	0	0	0	113	F545 I546	F545-S549 WeakPolarHBondContact O-CB 3.41Å; F545-S549 PolarHBondContact O-N 3.04Å; F545-S549 PolarHBondContact O-OG 2.99Å; I546-S549 PolarHBondContact O-N 2.82Å; I546-S549 PolarHBondContact O-OG 3.37Å
550	E	89.4	Confident	83.9	Confident	80 Å²	80	72 Å²	72	37%	0.374	35%	0.346	S	S	.	.	H	α-helix	trans	-98.7	-27	-170.8	-63.5	-72.2	159.2	0	0	113.3	I546 N572 A573 L576	I546-E550 HydrophobicContact CG2-CG 4.24Å; I546-E550 VanDerWaalsContact O-CB 3.3Å; I546-E550 WeakPolarHBondContact O-CB 3.3Å; I546-E550 PolarHBondContact O-N 3.2Å; E550-N572 PolarHBondContact OE2-ND2 3.37Å; E550-N572 VanDerWaalsContact OE2-ND2 3.08Å; E550-A573 HydrophobicContact CB-CB 3.74Å; E550-L576 HydrophobicContact CB-CD1 4.46Å; E550-L576 HydrophobicContact CG-CD1 3.65Å
551	Q	89	Confident	82	Confident	15 Å²	15	78.3 Å²	78.3	7%	0.07	38%	0.38	C	S	.	.			trans	-88.7	117.9	-177.1	-161.9	72.3	5.1	0	0	111.7	L547 F556 S571 A573 F619	L547-Q551 WeakPolarHBondContact O-CB 3.16Å; L547-Q551 PolarHBondContact O-N 2.91Å; Q551-F556 HydrophobicContact CG-CE2 3.87Å; Q551-F556 HydrophobicContact CG-CZ 4.32Å; Q551-S571 VanDerWaalsContact OE1-CB 3.26Å; Q551-S571 PolarHBondContact OE1-OG 2.94Å; Q551-A573 HydrophobicContact CB-CB 4.01Å; Q551-F619 HydrophobicContact CB-CZ 4.42Å; Q551-F619 HydrophobicContact CG-CE1 4.43Å; Q551-F619 HydrophobicContact CG-CZ 4.02Å
552	K	84.6	Confident	80	Confident	136 Å²	136	84.1 Å²	84.1	59%	0.591	41%	0.411	S	S	*	.			trans	-96.2	153.6	179.7	-60.8	178.8	-174.9	172.4	0	110.9	Q554 D555	K552-Q554 PolarHBondContact O-N 3.49Å; K552-D555 PolarHBondContact N-OD2 3.28Å; K552-D555 WeakPolarHBondContact O-CB 3.47Å; K552-D555 PolarHBondContact O-N 2.88Å; K552-D555 VanDerWaalsContact O-N 3.1Å
553	R	81.9	Confident	78.2	Confident	212 Å²	212	90.8 Å²	90.8	80%	0.8	44%	0.442	S	S	*	.	G	3₁₀ helix	trans	-59	-31	175.3	-69.8	-175.4	179.4	176.7	0.4	113.4	D555 K557 F619	R553-D555 PolarHBondContact O-N 3.38Å; R553-K557 PolarHBondContact O-N 2.9Å; R553-F619 HydrophobicContact CG-CD1 4.4Å; R553-F619 HydrophobicContact CG-CE1 4.22Å
554	Q	78.7	Confident	75.9	Confident	145 Å²	145	102.9 Å²	102.9	68%	0.678	49%	0.489	S	S	*	.	G	3₁₀ helix	trans	-68.5	-22.2	179.3	-68.5	172	-4.9	0	0	112.6	K552 F556 K557	K552-Q554 PolarHBondContact O-N 3.49Å; Q554-F556 VanDerWaalsContact C-N 3.25Å; Q554-F556 PolarHBondContact O-N 3.43Å; Q554-K557 CarbonylContact O-C 3.29Å; Q554-K557 VanDerWaalsContact O-C 3.29Å; Q554-K557 PolarHBondContact O-N 2.83Å
555	D	80.3	Confident	73.9	Confident	53 Å²	53	101 Å²	101	28%	0.283	51%	0.505	S	S	.	.	G	3₁₀ helix	trans	-66.5	-29	-177.5	-60.2	-25.9	0	0	0	112.5	K552 R553	K552-D555 PolarHBondContact N-OD2 3.28Å; K552-D555 WeakPolarHBondContact O-CB 3.47Å; K552-D555 PolarHBondContact O-N 2.88Å; K552-D555 VanDerWaalsContact O-N 3.1Å; R553-D555 PolarHBondContact O-N 3.38Å
556	F	85.2	Confident	72.3	Confident	2 Å²	2	100.7 Å²	100.7	1%	0.009	52%	0.517	C	S	.	.	G	3₁₀ helix	trans	-108.9	1.5	178.5	-60.5	-46.5	0	0	0	113.7	Q551 Q554 F619 Y621 N622 G625 H628 L629	Q551-F556 HydrophobicContact CG-CE2 3.87Å; Q551-F556 HydrophobicContact CG-CZ 4.32Å; Q554-F556 VanDerWaalsContact C-N 3.25Å; Q554-F556 PolarHBondContact O-N 3.43Å; F556-F619 HydrophobicContact CD2-CB 3.9Å; F556-F619 AromaticContact CD2-CD1 3.66Å; F556-F619 HydrophobicContact CD2-CD1 3.66Å; F556-F619 HydrophobicContact CD2-CD2 4.07Å; F556-F619 HydrophobicContact CD2-CE1 4.16Å; F556-F619 AromaticContact CD2-CG 3.6Å; F556-F619 HydrophobicContact CD2-CG 3.6Å; F556-F619 HydrophobicContact CE2-CD1 4.35Å; F556-F619 HydrophobicContact CE2-CD2 4.14Å; F556-F619 HydrophobicContact CE2-CE2 4.38Å; F556-F619 HydrophobicContact CE2-CG 4.14Å; F556-Y621 HydrophobicContact CB-CD1 3.68Å; F556-Y621 HydrophobicContact CB-CE1 3.66Å; F556-Y621 HydrophobicContact CD1-CD1 4.22Å; F556-Y621 AromaticContact CD1-CE1 3.75Å; F556-Y621 HydrophobicContact CD1-CE1 3.75Å; F556-Y621 AromaticContact CD2-CE1 3.77Å; F556-Y621 HydrophobicContact CD2-CE1 3.77Å; F556-Y621 HydrophobicContact CE1-CE1 4.3Å; F556-Y621 HydrophobicContact CE2-CE1 4.31Å; F556-Y621 AromaticContact CG-CD1 3.97Å; F556-Y621 HydrophobicContact CG-CD1 3.97Å; F556-Y621 AromaticContact CG-CE1 3.45Å; F556-Y621 HydrophobicContact CG-CE1 3.45Å; F556-Y621 VanDerWaalsContact CG-CE1 3.45Å; F556-N622 PolarHBondContact O-N 2.88Å; F556-G625 WeakPolarHBondContact O-CA 3.34Å; F556-H628 HydrophobicContact CD1-CB 4.5Å; F556-L629 HydrophobicContact CD1-CB 4.29Å; F556-L629 HydrophobicContact CE1-CB 3.99Å; F556-L629 HydrophobicContact CE1-CD1 4.35Å; F556-L629 HydrophobicContact CZ-CD1 4.25Å
557	K	79.6	Confident	70.8	Confident	80 Å²	80	107.1 Å²	107.1	35%	0.348	55%	0.551	S	S	.	*	S	Bend	trans	-143.7	69.3	174.3	-167.7	-179.5	178.5	169.3	0	110.5	R553 Q554 E697	R553-K557 PolarHBondContact O-N 2.9Å; Q554-K557 CarbonylContact O-C 3.29Å; Q554-K557 VanDerWaalsContact O-C 3.29Å; Q554-K557 PolarHBondContact O-N 2.83Å; K557-E697 VanDerWaalsContact CE-CD 3.45Å; K557-E697 WeakPolarHBondContact CE-OE1 2.93Å; K557-E697 VanDerWaalsContact CE-OE2 3.24Å; K557-E697 WeakPolarHBondContact CE-OE2 3.24Å; K557-E697 VanDerWaalsContact NZ-CD 3.33Å; K557-E697 IonicContact NZ-OE1 3.77Å; K557-E697 PolarHBondContact NZ-OE1 3.4Å; K557-E697 IonicContact NZ-OE2 2.61Å
558	P	74.9	Confident	69.4	Low	39 Å²	39	110.1 Å²	110.1	25%	0.253	57%	0.57	S	S	.	*			trans	-62.4	138.1	171.6	25.1	-34.3	0	0	0	110.5	N622 Q624	P558-N622 WeakPolarHBondContact CD-OD1 3.4Å; P558-N622 PolarHBondContact O-ND2 2.68Å; P558-Q624 HydrophobicContact CG-CB 3.82Å
559	E	67.9	Low	68.8	Low	176 Å²	176	109.9 Å²	109.9	82%	0.822	57%	0.568	S	S	*	*			trans	-78.2	139.6	174.5	-64.6	-172.1	169.5	0	0	110.2	N561	E559-N561 PolarHBondContact O-N 3.03Å
560	D	57.2	Low	68.6	Low	140 Å²	140	108.6 Å²	108.6	75%	0.749	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.1	18.5	-166.9	-79.9	-37.4	0	0	0	117
561	N	49.2	Very low	68.4	Low	146 Å²	146	105.6 Å²	105.6	78%	0.781	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	-121.9	0.6	-167.2	-85.7	-27	0	0	0	118.6	E559	E559-N561 PolarHBondContact O-N 3.03Å
562	D	45.4	Very low	68.4	Low	152 Å²	152	109.4 Å²	109.4	81%	0.813	57%	0.568	S	S	*	*	S	Bend	trans	-144	129	174.8	-77.7	-52.1	0	0	0	113.4
563	Q	50.7	Low	68.8	Low	168 Å²	168	103 Å²	103	79%	0.785	54%	0.54	S	S	*	.			trans	84.9	68	170.5	-64.7	164.8	6.2	0	0	118.9	G565	Q563-G565 PolarHBondContact O-N 3.18Å
564	Y	41.7	Very low	69.3	Low	256 Å²	256	92.9 Å²	92.9	100%	1.004	50%	0.502	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	95.4	146.9	-91.2	-94.4	0	0	0	109.6
565	G	49.5	Very low	69.9	Low	75 Å²	75	89.8 Å²	89.8	77%	0.773	49%	0.493	S	S	*	.	T	Hydrogen-bonded Turn	trans	147.3	-4.1	166.6	0	0	0	0	0	119	Q563	Q563-G565 PolarHBondContact O-N 3.18Å
566	A	55.3	Low	70.5	Confident	74 Å²	74	90.3 Å²	90.3	61%	0.612	50%	0.495	S	S	*	.	P	Polyproline II helix	trans	-79.7	128.3	179.5	0	0	0	0	0	111.8
567	I	58.8	Low	70.9	Confident	150 Å²	150	90.2 Å²	90.2	77%	0.769	50%	0.495	S	S	*	.	P	Polyproline II helix	trans	-62.6	130.6	173.1	-60.7	164.9	0	0	0	107.9	S569	I567-S569 PolarHBondContact O-N 2.79Å; I567-S569 VanDerWaalsContact O-N 3.12Å
568	P	62.6	Low	71.5	Confident	65 Å²	65	87 Å²	87	42%	0.422	48%	0.482	S	S	.	.	P	Polyproline II helix	trans	-55.3	121.6	176.8	-20.7	30.2	0	0	0	109.8	V627	P568-V627 HydrophobicContact CB-CG1 3.91Å; P568-V627 HydrophobicContact CG-CG1 3.89Å
569	S	75.1	Confident	72.3	Confident	80 Å²	80	92.5 Å²	92.5	56%	0.559	50%	0.502	S	S	*	.			trans	-122	155.2	178.6	53.4	0	0	0	0	109.9	I567	I567-S569 PolarHBondContact O-N 2.79Å; I567-S569 VanDerWaalsContact O-N 3.12Å
570	C	83.2	Confident	73.4	Confident	37 Å²	37	84.9 Å²	84.9	25%	0.25	47%	0.466	C	S	.	.			trans	-65.6	151.2	177.5	-50	0	0	0	0	110.5	C574 D632	C570-C574 HydrophobicContact CB-CB 4.3Å; C570-D632 VanDerWaalsContact CA-OD1 3.25Å; C570-D632 WeakPolarHBondContact CA-OD1 3.17Å; C570-D632 WeakPolarHBondContact CB-OD1 3.44Å
571	S	86.8	Confident	75.1	Confident	17 Å²	17	78.4 Å²	78.4	12%	0.119	43%	0.431	C	S	.	.			trans	-63.1	155.6	175.2	63.7	0	0	0	0	112.1	Q551 A573 C574 T575 D632	Q551-S571 VanDerWaalsContact OE1-CB 3.26Å; Q551-S571 PolarHBondContact OE1-OG 2.94Å; S571-A573 PolarHBondContact O-N 3.5Å; S571-C574 WeakPolarHBondContact O-CB 3.34Å; S571-C574 PolarHBondContact O-N 2.77Å; S571-C574 WeakPolarHBondContact OG-CB 3.07Å; S571-C574 PolarHBondContact OG-N 2.72Å; S571-T575 PolarHBondContact O-N 3Å; S571-T575 VanDerWaalsContact O-N 3.07Å; S571-T575 PolarHBondContact O-OG1 3.09Å; S571-D632 WeakPolarHBondContact CB-OD2 3.28Å; S571-D632 PolarHBondContact N-OD1 3.49Å; S571-D632 VanDerWaalsContact OG-CG 3.25Å; S571-D632 PolarHBondContact OG-OD1 2.67Å; S571-D632 PolarHBondContact OG-OD2 3.05Å
572	N	88.4	Confident	77.1	Confident	95 Å²	95	74.2 Å²	74.2	51%	0.508	41%	0.411	S	S	.	.	H	α-helix	trans	-59.8	-40.1	172.2	-172.9	45.5	0	0	0	110.7	E550 C574 T575 L576	E550-N572 PolarHBondContact OE2-ND2 3.37Å; E550-N572 VanDerWaalsContact OE2-ND2 3.08Å; N572-C574 VanDerWaalsContact C-N 3.35Å; N572-C574 PolarHBondContact O-N 2.84Å; N572-T575 PolarHBondContact O-N 2.72Å; N572-L576 WeakPolarHBondContact O-CG 3.1Å; N572-L576 PolarHBondContact O-N 2.86Å
573	A	91.6	Very high	79.2	Confident	0 Å²	0	72.1 Å²	72.1	0%	0	40%	0.397	C	S	.	.	H	α-helix	trans	-61	-43.3	176.4	0	0	0	0	0	111.5	L547 E550 Q551 S571 T575 L576 V577	L547-A573 HydrophobicContact CD2-CB 4.46Å; E550-A573 HydrophobicContact CB-CB 3.74Å; Q551-A573 HydrophobicContact CB-CB 4.01Å; S571-A573 PolarHBondContact O-N 3.5Å; A573-T575 PolarHBondContact O-N 3.34Å; A573-L576 PolarHBondContact O-N 2.98Å; A573-V577 WeakPolarHBondContact O-CB 3.37Å; A573-V577 VanDerWaalsContact O-CG2 3.28Å; A573-V577 WeakPolarHBondContact O-CG2 3.46Å; A573-V577 PolarHBondContact O-N 2.91Å
574	C	93	Very high	81	Confident	0 Å²	0	64.3 Å²	64.3	0%	0	36%	0.36	C	S	.	.	H	α-helix	trans	-57.5	-47.9	174.1	175.9	0	0	0	0	111.7	C570 S571 N572 L576 V577 C578 D632 Y636	C570-C574 HydrophobicContact CB-CB 4.3Å; S571-C574 WeakPolarHBondContact O-CB 3.34Å; S571-C574 PolarHBondContact O-N 2.77Å; S571-C574 WeakPolarHBondContact OG-CB 3.07Å; S571-C574 PolarHBondContact OG-N 2.72Å; N572-C574 VanDerWaalsContact C-N 3.35Å; N572-C574 PolarHBondContact O-N 2.84Å; C574-L576 PolarHBondContact O-N 3.19Å; C574-V577 PolarHBondContact O-N 3.39Å; C574-C578 WeakPolarHBondContact O-CB 3.35Å; C574-C578 PolarHBondContact O-N 2.87Å; C574-C578 PolarHBondContact O-SG 3.13Å; C574-D632 HydrophobicContact CB-CB 4.05Å; C574-D632 VanDerWaalsContact CB-CG 3.49Å; C574-D632 VanDerWaalsContact CB-OD1 3.31Å; C574-D632 WeakPolarHBondContact CB-OD1 3.48Å; C574-Y636 WeakPolarHBondContact CA-OH 3.22Å; C574-Y636 HydrophobicContact CB-CE1 4.26Å
575	T	92	Very high	83.2	Confident	81 Å²	81	53 Å²	53	50%	0.497	32%	0.317	S	S	.	.	H	α-helix	trans	-60.6	-42.8	179.6	-56.3	0	0	0	0	112.3	S571 N572 A573 C578 K579	S571-T575 PolarHBondContact O-N 3Å; S571-T575 VanDerWaalsContact O-N 3.07Å; S571-T575 PolarHBondContact O-OG1 3.09Å; N572-T575 PolarHBondContact O-N 2.72Å; A573-T575 PolarHBondContact O-N 3.34Å; T575-C578 PolarHBondContact O-N 3.25Å; T575-K579 WeakPolarHBondContact O-CB 3.34Å; T575-K579 PolarHBondContact O-N 2.82Å
576	L	92.4	Very high	85	Confident	63 Å²	63	53.6 Å²	53.6	33%	0.33	30%	0.302	S	S	.	.	H	α-helix	trans	-66.8	-44.7	178	-71.3	170.9	0	0	0	112.3	I546 E550 N572 A573 C574 C578 K579 Y580	I546-L576 HydrophobicContact CG2-CB 3.7Å; I546-L576 HydrophobicContact CG2-CD1 4.43Å; E550-L576 HydrophobicContact CB-CD1 4.46Å; E550-L576 HydrophobicContact CG-CD1 3.65Å; N572-L576 WeakPolarHBondContact O-CG 3.1Å; N572-L576 PolarHBondContact O-N 2.86Å; A573-L576 PolarHBondContact O-N 2.98Å; C574-L576 PolarHBondContact O-N 3.19Å; L576-C578 VanDerWaalsContact C-N 3.35Å; L576-C578 PolarHBondContact O-N 2.75Å; L576-K579 PolarHBondContact O-N 3.34Å; L576-Y580 WeakPolarHBondContact O-CB 3.43Å; L576-Y580 PolarHBondContact O-N 3.06Å
577	V	93.8	Very high	86.3	Confident	0 Å²	0	51 Å²	51	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-60.4	-45.7	175.1	168.5	0	0	0	0	110.8	V543 I546 L547 A573 C574 Y580 L581 F608 Y636	V543-V577 HydrophobicContact CG1-CG1 3.88Å; V543-V577 HydrophobicContact CG1-CG2 4.16Å; V543-V577 HydrophobicContact CG2-CG1 4.47Å; I546-V577 HydrophobicContact CB-CG2 4.02Å; I546-V577 HydrophobicContact CG2-CG2 3.7Å; L547-V577 HydrophobicContact CD2-CG2 3.88Å; L547-V577 HydrophobicContact CG-CG2 3.95Å; A573-V577 WeakPolarHBondContact O-CB 3.37Å; A573-V577 VanDerWaalsContact O-CG2 3.28Å; A573-V577 WeakPolarHBondContact O-CG2 3.46Å; A573-V577 PolarHBondContact O-N 2.91Å; C574-V577 PolarHBondContact O-N 3.39Å; V577-Y580 PolarHBondContact O-N 3.11Å; V577-L581 VanDerWaalsContact O-CB 3.26Å; V577-L581 WeakPolarHBondContact O-CB 3.38Å; V577-L581 PolarHBondContact O-N 3.45Å; V577-F608 HydrophobicContact CG1-CE2 3.65Å; V577-F608 HydrophobicContact CG1-CZ 3.99Å; V577-Y636 HydrophobicContact CB-CE1 4.01Å; V577-Y636 HydrophobicContact CG1-CD1 4.4Å; V577-Y636 HydrophobicContact CG1-CE1 3.65Å
578	C	92.6	Very high	87.6	Confident	12 Å²	12	44 Å²	44	8%	0.081	24%	0.244	C	C	.	.	H	α-helix	trans	-59.6	-46.4	178.3	-80.5	0	0	0	0	112.4	C574 T575 L576 T582 I639	C574-C578 WeakPolarHBondContact O-CB 3.35Å; C574-C578 PolarHBondContact O-N 2.87Å; C574-C578 PolarHBondContact O-SG 3.13Å; T575-C578 PolarHBondContact O-N 3.25Å; L576-C578 VanDerWaalsContact C-N 3.35Å; L576-C578 PolarHBondContact O-N 2.75Å; C578-T582 WeakPolarHBondContact O-CB 3.44Å; C578-T582 PolarHBondContact O-N 2.94Å; C578-T582 PolarHBondContact O-OG1 3.42Å; C578-I639 HydrophobicContact CB-CD1 3.31Å; C578-I639 WeakPolarHBondContact O-CD1 3.2Å; C578-I639 WeakPolarHBondContact SG-CD1 3.04Å
579	K	91.8	Very high	88.7	Confident	155 Å²	155	43.3 Å²	43.3	67%	0.674	24%	0.241	S	C	*	.	H	α-helix	trans	-63.5	-47.1	177.3	-175.2	178	177.3	-177.7	0	111.6	T575 L576 Q583	T575-K579 WeakPolarHBondContact O-CB 3.34Å; T575-K579 PolarHBondContact O-N 2.82Å; L576-K579 PolarHBondContact O-N 3.34Å; K579-Q583 PolarHBondContact O-N 3.4Å; K579-Q583 VanDerWaalsContact O-N 3.14Å
580	Y	91.5	Very high	89	Confident	16 Å²	16	45.7 Å²	45.7	6%	0.063	25%	0.247	C	C	.	.	H	α-helix	trans	-62.7	-48.5	178.5	178.5	-105.5	0	0	0	111.8	I539 H542 V543 I546 L576 V577 T582 Q583 Q584	I539-Y580 HydrophobicContact CG2-CE1 4Å; H542-Y580 HydrophobicContact CB-CE1 3.92Å; H542-Y580 AromaticContact CD2-CD1 3.82Å; H542-Y580 AromaticContact CD2-CD2 3.63Å; H542-Y580 AromaticContact CD2-CE1 3.58Å; H542-Y580 AromaticContact CD2-CE2 3.38Å; H542-Y580 WeakPolarHBondContact CD2-CE2 3.44Å; H542-Y580 AromaticContact CD2-CG 3.85Å; H542-Y580 AromaticContact CD2-CZ 3.35Å; H542-Y580 AromaticContact CG-CZ 3.82Å; V543-Y580 HydrophobicContact CG2-CD1 3.95Å; V543-Y580 HydrophobicContact CG2-CE1 4.18Å; I546-Y580 HydrophobicContact CD1-CG 4.31Å; L576-Y580 WeakPolarHBondContact O-CB 3.43Å; L576-Y580 PolarHBondContact O-N 3.06Å; V577-Y580 PolarHBondContact O-N 3.11Å; Y580-T582 VanDerWaalsContact C-N 3.33Å; Y580-T582 PolarHBondContact O-N 3.34Å; Y580-Q583 WeakPolarHBondContact O-CB 3.21Å; Y580-Q583 PolarHBondContact O-N 2.94Å; Y580-Q584 HydrophobicContact CD1-CG 4.25Å; Y580-Q584 HydrophobicContact CD2-CG 4.37Å; Y580-Q584 HydrophobicContact CE1-CG 3.83Å; Y580-Q584 HydrophobicContact CE2-CG 3.96Å; Y580-Q584 WeakPolarHBondContact O-CG 3.45Å; Y580-Q584 PolarHBondContact O-N 3.4Å
581	L	91.7	Very high	88.6	Confident	4 Å²	4	44.6 Å²	44.6	2%	0.021	24%	0.24	C	C	.	.	H	α-helix	trans	-63	-40.1	-178.7	-169.4	68.1	0	0	0	111.7	V577 Q583 Q584 I585 L604 F608 I639	V577-L581 VanDerWaalsContact O-CB 3.26Å; V577-L581 WeakPolarHBondContact O-CB 3.38Å; V577-L581 PolarHBondContact O-N 3.45Å; L581-Q583 VanDerWaalsContact C-N 3.35Å; L581-Q583 PolarHBondContact O-N 3.32Å; L581-Q584 PolarHBondContact O-N 3.34Å; L581-I585 HydrophobicContact CD2-CD1 4.33Å; L581-I585 HydrophobicContact CG-CD1 3.82Å; L581-I585 HydrophobicContact CG-CG1 4.4Å; L581-I585 WeakPolarHBondContact O-CB 3.34Å; L581-I585 WeakPolarHBondContact O-CD1 3.33Å; L581-I585 VanDerWaalsContact O-CG1 3.22Å; L581-I585 WeakPolarHBondContact O-CG1 3.29Å; L581-I585 PolarHBondContact O-N 3.17Å; L581-L604 HydrophobicContact CD1-CD1 4.39Å; L581-L604 HydrophobicContact CD1-CD2 4.13Å; L581-L604 HydrophobicContact CD1-CG 4.36Å; L581-F608 HydrophobicContact CD2-CD1 3.87Å; L581-F608 HydrophobicContact CD2-CD2 4.4Å; L581-F608 HydrophobicContact CD2-CE1 3.75Å; L581-F608 HydrophobicContact CD2-CE2 4.3Å; L581-F608 HydrophobicContact CD2-CG 4.21Å; L581-F608 HydrophobicContact CD2-CZ 3.99Å; L581-I639 HydrophobicContact CD2-CG2 4.17Å
582	T	90.9	Very high	88.3	Confident	58 Å²	58	44.2 Å²	44.2	36%	0.356	24%	0.236	S	C	.	.	H	α-helix	trans	-61.7	-43.3	175.7	-55.5	0	0	0	0	111.4	C578 Y580 I585 N586	C578-T582 WeakPolarHBondContact O-CB 3.44Å; C578-T582 PolarHBondContact O-N 2.94Å; C578-T582 PolarHBondContact O-OG1 3.42Å; Y580-T582 VanDerWaalsContact C-N 3.33Å; Y580-T582 PolarHBondContact O-N 3.34Å; T582-I585 PolarHBondContact O-N 3.47Å; T582-N586 VanDerWaalsContact O-CG 3.29Å; T582-N586 PolarHBondContact O-N 3.01Å; T582-N586 VanDerWaalsContact O-N 3.1Å
583	Q	89.3	Confident	87.7	Confident	108 Å²	108	45.4 Å²	45.4	51%	0.505	24%	0.243	S	C	.	.	H	α-helix	trans	-60.8	-45.5	175.6	-176.2	-179.8	-5.3	0	0	111.5	K579 Y580 L581 N586 S587	K579-Q583 PolarHBondContact O-N 3.4Å; K579-Q583 VanDerWaalsContact O-N 3.14Å; Y580-Q583 WeakPolarHBondContact O-CB 3.21Å; Y580-Q583 PolarHBondContact O-N 2.94Å; L581-Q583 VanDerWaalsContact C-N 3.35Å; L581-Q583 PolarHBondContact O-N 3.32Å; Q583-N586 PolarHBondContact O-N 3.13Å; Q583-S587 PolarHBondContact O-N 3.28Å; Q583-S587 VanDerWaalsContact O-N 3.14Å; Q583-S587 PolarHBondContact O-OG 2.92Å
584	Q	88.2	Confident	87.1	Confident	4 Å²	4	48 Å²	48	2%	0.019	27%	0.269	C	S	.	.	H	α-helix	trans	-68.8	-36.6	179.6	-61.3	-56.6	-49	0	0	112.9	T474 I539 Y580 L581 S587 L588	T474-Q584 VanDerWaalsContact OG1-CD 3.31Å; T474-Q584 PolarHBondContact OG1-NE2 2.92Å; T474-Q584 VanDerWaalsContact OG1-NE2 3.11Å; T474-Q584 PolarHBondContact OG1-OE1 3.2Å; I539-Q584 HydrophobicContact CD1-CB 4.2Å; I539-Q584 HydrophobicContact CD1-CG 4.42Å; I539-Q584 HydrophobicContact CG1-CB 4.47Å; I539-Q584 HydrophobicContact CG1-CG 4.18Å; I539-Q584 HydrophobicContact CG2-CB 4.34Å; I539-Q584 HydrophobicContact CG2-CG 4.18Å; Y580-Q584 HydrophobicContact CD1-CG 4.25Å; Y580-Q584 HydrophobicContact CD2-CG 4.37Å; Y580-Q584 HydrophobicContact CE1-CG 3.83Å; Y580-Q584 HydrophobicContact CE2-CG 3.96Å; Y580-Q584 WeakPolarHBondContact O-CG 3.45Å; Y580-Q584 PolarHBondContact O-N 3.4Å; L581-Q584 PolarHBondContact O-N 3.34Å; Q584-S587 PolarHBondContact O-N 3.4Å; Q584-L588 WeakPolarHBondContact O-CB 3.18Å; Q584-L588 WeakPolarHBondContact O-CG 3.38Å; Q584-L588 PolarHBondContact O-N 3.04Å
585	I	89.1	Confident	86.2	Confident	19 Å²	19	51.4 Å²	51.4	10%	0.097	29%	0.293	C	S	.	.	H	α-helix	trans	-62.5	-44.2	175.7	-71.7	162.4	0	0	0	110.6	L581 T582 L588 S589 L601 L604 I639 I643	L581-I585 HydrophobicContact CD2-CD1 4.33Å; L581-I585 HydrophobicContact CG-CD1 3.82Å; L581-I585 HydrophobicContact CG-CG1 4.4Å; L581-I585 WeakPolarHBondContact O-CB 3.34Å; L581-I585 WeakPolarHBondContact O-CD1 3.33Å; L581-I585 VanDerWaalsContact O-CG1 3.22Å; L581-I585 WeakPolarHBondContact O-CG1 3.29Å; L581-I585 PolarHBondContact O-N 3.17Å; T582-I585 PolarHBondContact O-N 3.47Å; I585-L588 PolarHBondContact O-N 3.16Å; I585-S589 PolarHBondContact O-N 3.05Å; I585-S589 PolarHBondContact O-OG 3.03Å; I585-L601 HydrophobicContact CG1-CD2 4.23Å; I585-L601 HydrophobicContact CG2-CD2 4.08Å; I585-L604 HydrophobicContact CG1-CD2 4.18Å; I585-I639 HydrophobicContact CD1-CG2 3.96Å; I585-I643 HydrophobicContact CD1-CD1 3.55Å; I585-I643 HydrophobicContact CD1-CG1 3.94Å; I585-I643 HydrophobicContact CG1-CD1 4.38Å
586	N	87.5	Confident	85.4	Confident	87 Å²	87	48.3 Å²	48.3	47%	0.465	27%	0.273	S	S	.	.	H	α-helix	trans	-62.1	-44.7	177.7	-68.8	-11.9	0	0	0	111.2	T582 Q583 L588 S589 D590	T582-N586 VanDerWaalsContact O-CG 3.29Å; T582-N586 PolarHBondContact O-N 3.01Å; T582-N586 VanDerWaalsContact O-N 3.1Å; Q583-N586 PolarHBondContact O-N 3.13Å; N586-L588 VanDerWaalsContact C-N 3.33Å; N586-L588 PolarHBondContact O-N 3.34Å; N586-S589 WeakPolarHBondContact CA-OG 3.34Å; N586-S589 PolarHBondContact O-N 3.31Å; N586-S589 VanDerWaalsContact O-N 3.16Å; N586-S589 PolarHBondContact O-OG 3.44Å; N586-D590 PolarHBondContact O-N 3.4Å
587	S	82.9	Confident	85	Confident	21 Å²	21	46.5 Å²	46.5	15%	0.147	26%	0.263	C	S	.	.	H	α-helix	trans	-65.4	-34.5	176.7	-57.1	0	0	0	0	113.1	F476 Q583 Q584 C591	F476-S587 WeakPolarHBondContact CE2-OG 3.34Å; F476-S587 WeakPolarHBondContact CZ-OG 3.34Å; Q583-S587 PolarHBondContact O-N 3.28Å; Q583-S587 VanDerWaalsContact O-N 3.14Å; Q583-S587 PolarHBondContact O-OG 2.92Å; Q584-S587 PolarHBondContact O-N 3.4Å; S587-C591 PolarHBondContact O-N 3.11Å; S587-C591 PolarHBondContact O-SG 3.09Å; S587-C591 VanDerWaalsContact O-SG 3.37Å
588	L	86	Confident	84.5	Confident	1 Å²	1	50.3 Å²	50.3	1%	0.005	28%	0.282	C	S	.	.	H	α-helix	trans	-66.8	-39.5	171.8	-73.4	169.4	0	0	0	111.7	L479 I539 Q584 I585 N586 D590 C591 L592 T600 L601 L604	L479-L588 HydrophobicContact CD1-CD2 3.79Å; L479-L588 HydrophobicContact CD1-CG 4.48Å; L479-L588 HydrophobicContact CD2-CD2 4.03Å; I539-L588 HydrophobicContact CD1-CD1 4.38Å; Q584-L588 WeakPolarHBondContact O-CB 3.18Å; Q584-L588 WeakPolarHBondContact O-CG 3.38Å; Q584-L588 PolarHBondContact O-N 3.04Å; I585-L588 PolarHBondContact O-N 3.16Å; N586-L588 VanDerWaalsContact C-N 3.33Å; N586-L588 PolarHBondContact O-N 3.34Å; L588-D590 VanDerWaalsContact C-N 3.33Å; L588-C591 PolarHBondContact O-N 3.15Å; L588-L592 HydrophobicContact CD2-CD1 4.22Å; L588-L592 WeakPolarHBondContact O-CB 3.34Å; L588-L592 PolarHBondContact O-N 2.93Å; L588-T600 HydrophobicContact CD1-CG2 4.39Å; L588-T600 HydrophobicContact CD2-CG2 4.07Å; L588-L601 HydrophobicContact CB-CD2 4.44Å; L588-L601 HydrophobicContact CD1-CD2 4.28Å; L588-L604 HydrophobicContact CD1-CD2 3.8Å
589	S	85.4	Confident	84.1	Confident	51 Å²	51	52 Å²	52	36%	0.357	29%	0.291	S	S	.	.	H	α-helix	trans	-69.6	-27.6	176.8	56.5	0	0	0	0	114.1	I585 N586	I585-S589 PolarHBondContact O-N 3.05Å; I585-S589 PolarHBondContact O-OG 3.03Å; N586-S589 WeakPolarHBondContact CA-OG 3.34Å; N586-S589 PolarHBondContact O-N 3.31Å; N586-S589 VanDerWaalsContact O-N 3.16Å; N586-S589 PolarHBondContact O-OG 3.44Å
590	D	80.8	Confident	83.8	Confident	130 Å²	130	44.7 Å²	44.7	70%	0.695	26%	0.259	S	S	*	.	H	α-helix	trans	-75.5	-27.8	176.7	-66.4	-17.6	0	0	0	112	N586 L588	N586-D590 PolarHBondContact O-N 3.4Å; L588-D590 VanDerWaalsContact C-N 3.33Å
591	C	75.7	Confident	83.7	Confident	14 Å²	14	44.2 Å²	44.2	10%	0.095	26%	0.257	C	S	.	.	H	α-helix	trans	-102.6	-21.4	-175.7	-61.7	0	0	0	0	114.9	L479 S587 L588	L479-C591 HydrophobicContact CB-CB 3.62Å; L479-C591 VanDerWaalsContact CB-SG 3.57Å; L479-C591 HydrophobicContact CD1-CB 4.27Å; L479-C591 HydrophobicContact CG-CB 4.49Å; S587-C591 PolarHBondContact O-N 3.11Å; S587-C591 PolarHBondContact O-SG 3.09Å; S587-C591 VanDerWaalsContact O-SG 3.37Å; L588-C591 PolarHBondContact O-N 3.15Å
592	L	80.2	Confident	83.4	Confident	10 Å²	10	45.5 Å²	45.5	5%	0.052	27%	0.266	C	S	.	.			trans	-123.7	144.9	-177.3	-70	171.8	0	0	0	111.1	L482 L532 L588 N596 L597 T600	L482-L592 HydrophobicContact CD2-CD1 4.44Å; L482-L592 HydrophobicContact CD2-CD2 3.51Å; L482-L592 HydrophobicContact CD2-CG 4.25Å; L482-L592 HydrophobicContact CG-CD2 4.1Å; L532-L592 HydrophobicContact CD1-CD1 4.27Å; L588-L592 HydrophobicContact CD2-CD1 4.22Å; L588-L592 WeakPolarHBondContact O-CB 3.34Å; L588-L592 PolarHBondContact O-N 2.93Å; L592-N596 HydrophobicContact CD2-CB 4.41Å; L592-L597 HydrophobicContact CB-CB 4.08Å; L592-L597 HydrophobicContact CB-CD1 4.01Å; L592-T600 HydrophobicContact CD1-CG2 3.79Å; L592-T600 WeakPolarHBondContact CD1-OG1 3.26Å
593	D	75.4	Confident	83	Confident	119 Å²	119	45.3 Å²	45.3	64%	0.636	26%	0.261	S	S	*	.			trans	-127.1	166.4	-178.1	62.6	-18.7	0	0	0	113.2	C595 N596 L597	D593-C595 PolarHBondContact O-N 3.13Å; D593-N596 PolarHBondContact O-N 3.4Å; D593-L597 PolarHBondContact O-N 3.15Å
594	G	78.1	Confident	83.1	Confident	54 Å²	54	40.2 Å²	40.2	56%	0.557	24%	0.238	S	C	*	.	H	α-helix	trans	52.9	-129.8	170.3	0	0	0	0	0	115.5	N596 M598	G594-N596 VanDerWaalsContact C-N 3.35Å; G594-M598 WeakPolarHBondContact O-CG 3.34Å; G594-M598 PolarHBondContact O-N 3.35Å
595	C	74.1	Confident	83.1	Confident	73 Å²	73	40.2 Å²	40.2	49%	0.493	24%	0.238	S	C	.	.	H	α-helix	trans	-70.3	-31.3	-178.9	-67.6	0	0	0	0	112.6	D593 M598 N599	D593-C595 PolarHBondContact O-N 3.13Å; C595-M598 PolarHBondContact O-N 3.12Å; C595-N599 WeakPolarHBondContact O-CB 3.31Å; C595-N599 PolarHBondContact O-N 3.19Å; C595-N599 PolarHBondContact O-ND2 3.24Å
596	N	77	Confident	82.9	Confident	15 Å²	15	41.8 Å²	41.8	8%	0.08	25%	0.248	C	C	.	.	H	α-helix	trans	-65.5	-43.6	179	-70.6	-11.3	0	0	0	110.1	L592 D593 G594 T600 Y737 F738	L592-N596 HydrophobicContact CD2-CB 4.41Å; D593-N596 PolarHBondContact O-N 3.4Å; G594-N596 VanDerWaalsContact C-N 3.35Å; N596-T600 VanDerWaalsContact O-CB 3.31Å; N596-T600 WeakPolarHBondContact O-CB 3.34Å; N596-T600 PolarHBondContact O-N 3.48Å; N596-T600 PolarHBondContact O-OG1 3.28Å; N596-Y737 PolarHBondContact OD1-O 2.9Å; N596-F738 WeakPolarHBondContact ND2-CE1 3.47Å
597	L	83.7	Confident	83	Confident	25 Å²	25	39.6 Å²	39.6	13%	0.131	23%	0.233	C	C	.	.	H	α-helix	trans	-59	-50.8	172.5	-178.6	61.4	0	0	0	111.8	L592 D593 N599 T600 L601	L592-L597 HydrophobicContact CB-CB 4.08Å; L592-L597 HydrophobicContact CB-CD1 4.01Å; D593-L597 PolarHBondContact O-N 3.15Å; L597-N599 PolarHBondContact O-N 2.85Å; L597-T600 PolarHBondContact O-N 2.97Å; L597-T600 VanDerWaalsContact O-N 3.15Å; L597-L601 HydrophobicContact CD1-CD1 3.61Å; L597-L601 HydrophobicContact CD1-CG 3.91Å; L597-L601 HydrophobicContact CD2-CD1 4.38Å; L597-L601 HydrophobicContact CG-CD1 3.68Å; L597-L601 HydrophobicContact CG-CG 4.33Å; L597-L601 WeakPolarHBondContact O-CB 3.44Å; L597-L601 WeakPolarHBondContact O-CG 3.46Å; L597-L601 PolarHBondContact O-N 3.47Å
598	M	82.4	Confident	83.4	Confident	80 Å²	80	38.7 Å²	38.7	39%	0.394	23%	0.227	S	C	.	.	H	α-helix	trans	-60.9	-42.7	-178.4	-71.7	-65.8	107.3	0	0	113	G594 C595 L601 S602 V645	G594-M598 WeakPolarHBondContact O-CG 3.34Å; G594-M598 PolarHBondContact O-N 3.35Å; C595-M598 PolarHBondContact O-N 3.12Å; M598-L601 HydrophobicContact CE-CD1 4.16Å; M598-S602 VanDerWaalsContact O-CB 3.25Å; M598-S602 WeakPolarHBondContact O-CB 3.48Å; M598-S602 PolarHBondContact O-N 3.08Å; M598-V645 HydrophobicContact SD-CG2 4.39Å
599	N	83.4	Confident	83.5	Confident	49 Å²	49	40.2 Å²	40.2	26%	0.262	23%	0.234	S	C	.	.	H	α-helix	trans	-64.9	-42	175.8	-69	-20.4	0	0	0	110.5	C595 L597 S602 E603 Y737	C595-N599 WeakPolarHBondContact O-CB 3.31Å; C595-N599 PolarHBondContact O-N 3.19Å; C595-N599 PolarHBondContact O-ND2 3.24Å; L597-N599 PolarHBondContact O-N 2.85Å; N599-S602 PolarHBondContact O-N 3.22Å; N599-E603 PolarHBondContact O-N 3.45Å; N599-E603 VanDerWaalsContact O-N 3.07Å; N599-Y737 VanDerWaalsContact C-OH 3.3Å; N599-Y737 HydrophobicContact CB-CD1 4.16Å; N599-Y737 HydrophobicContact CB-CE1 3.71Å; N599-Y737 PolarHBondContact O-OH 3.38Å
600	T	86	Confident	83.6	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-65.6	-47.5	-176.8	-57.3	0	0	0	0	110.9	L532 L536 L588 L592 N596 L597 S602 E603 L604 Y737	L532-T600 HydrophobicContact CD1-CG2 3.84Å; L532-T600 HydrophobicContact CD2-CG2 4.21Å; L532-T600 HydrophobicContact CG-CG2 4.33Å; L536-T600 HydrophobicContact CD1-CG2 4.37Å; L536-T600 HydrophobicContact CD2-CG2 4.03Å; L588-T600 HydrophobicContact CD1-CG2 4.39Å; L588-T600 HydrophobicContact CD2-CG2 4.07Å; L592-T600 HydrophobicContact CD1-CG2 3.79Å; L592-T600 WeakPolarHBondContact CD1-OG1 3.26Å; N596-T600 VanDerWaalsContact O-CB 3.31Å; N596-T600 WeakPolarHBondContact O-CB 3.34Å; N596-T600 PolarHBondContact O-N 3.48Å; N596-T600 PolarHBondContact O-OG1 3.28Å; L597-T600 PolarHBondContact O-N 2.97Å; L597-T600 VanDerWaalsContact O-N 3.15Å; T600-S602 VanDerWaalsContact C-N 3.32Å; T600-S602 PolarHBondContact O-N 3.37Å; T600-E603 PolarHBondContact O-N 2.95Å; T600-L604 WeakPolarHBondContact O-CB 3.34Å; T600-L604 PolarHBondContact O-N 2.82Å; T600-Y737 VanDerWaalsContact CA-CE1 3.47Å; T600-Y737 WeakPolarHBondContact CA-OH 3.39Å; T600-Y737 WeakPolarHBondContact OG1-CE1 3.44Å
601	L	89	Confident	84.1	Confident	7 Å²	7	40.3 Å²	40.3	4%	0.037	22%	0.218	C	C	.	.	H	α-helix	trans	-64.6	-36.7	175.5	-66.8	172.6	0	0	0	111.8	I585 L588 L597 M598 L604 V605 I643 V645	I585-L601 HydrophobicContact CG1-CD2 4.23Å; I585-L601 HydrophobicContact CG2-CD2 4.08Å; L588-L601 HydrophobicContact CB-CD2 4.44Å; L588-L601 HydrophobicContact CD1-CD2 4.28Å; L597-L601 HydrophobicContact CD1-CD1 3.61Å; L597-L601 HydrophobicContact CD1-CG 3.91Å; L597-L601 HydrophobicContact CD2-CD1 4.38Å; L597-L601 HydrophobicContact CG-CD1 3.68Å; L597-L601 HydrophobicContact CG-CG 4.33Å; L597-L601 WeakPolarHBondContact O-CB 3.44Å; L597-L601 WeakPolarHBondContact O-CG 3.46Å; L597-L601 PolarHBondContact O-N 3.47Å; M598-L601 HydrophobicContact CE-CD1 4.16Å; L601-L604 PolarHBondContact O-N 2.88Å; L601-V605 VanDerWaalsContact O-CG2 3.24Å; L601-V605 WeakPolarHBondContact O-CG2 3.32Å; L601-V605 PolarHBondContact O-N 3.14Å; L601-I643 HydrophobicContact CB-CG2 3.66Å; L601-I643 HydrophobicContact CD1-CG2 3.74Å; L601-I643 HydrophobicContact CD2-CG2 4.27Å; L601-I643 HydrophobicContact CG-CG2 4.09Å; L601-V645 HydrophobicContact CB-CG2 4.31Å
602	S	85.6	Confident	84.8	Confident	30 Å²	30	39.8 Å²	39.8	21%	0.21	21%	0.214	C	C	.	.	H	α-helix	trans	-62.2	-46.2	176.7	-175.7	0	0	0	0	112.5	M598 N599 T600 V605 V606	M598-S602 VanDerWaalsContact O-CB 3.25Å; M598-S602 WeakPolarHBondContact O-CB 3.48Å; M598-S602 PolarHBondContact O-N 3.08Å; N599-S602 PolarHBondContact O-N 3.22Å; T600-S602 VanDerWaalsContact C-N 3.32Å; T600-S602 PolarHBondContact O-N 3.37Å; S602-V605 PolarHBondContact O-N 2.88Å; S602-V606 WeakPolarHBondContact O-CG2 3.03Å; S602-V606 PolarHBondContact O-N 3.24Å
603	E	84.2	Confident	85	Confident	54 Å²	54	40.2 Å²	40.2	25%	0.252	22%	0.217	S	C	.	.	H	α-helix	trans	-69.7	-40	177.3	-178.8	65.5	-163.2	0	0	112.2	L536 N599 T600 V605 V606 R607 Y737	L536-E603 HydrophobicContact CD1-CB 4.28Å; L536-E603 HydrophobicContact CD1-CG 3.97Å; N599-E603 PolarHBondContact O-N 3.45Å; N599-E603 VanDerWaalsContact O-N 3.07Å; T600-E603 PolarHBondContact O-N 2.95Å; E603-V605 PolarHBondContact O-N 3.22Å; E603-V606 PolarHBondContact O-N 2.98Å; E603-V606 VanDerWaalsContact O-N 3.11Å; E603-R607 HydrophobicContact CG-CG 4.44Å; E603-R607 WeakPolarHBondContact O-CG 3.46Å; E603-R607 PolarHBondContact O-N 3.2Å; E603-R607 IonicContact OE1-CZ 2.73Å; E603-R607 IonicContact OE1-NE 2.74Å; E603-R607 PolarHBondContact OE1-NE 3.22Å; E603-R607 IonicContact OE1-NH2 3.93Å; E603-R607 PolarHBondContact OE1-NH2 2.99Å; E603-R607 VanDerWaalsContact OE1-NH2 3.08Å; E603-Y737 HydrophobicContact CB-CE2 4.39Å; E603-Y737 WeakPolarHBondContact CB-OH 3.43Å; E603-Y737 HydrophobicContact CG-CE2 4.4Å; E603-Y737 WeakPolarHBondContact CG-OH 3.28Å
604	L	89.8	Confident	85.4	Confident	2 Å²	2	37.9 Å²	37.9	1%	0.01	21%	0.205	C	C	.	.	H	α-helix	trans	-53.2	-46.3	172.2	178.1	60.8	0	0	0	110.2	L536 I539 V540 L581 I585 L588 T600 L601 R607 F608	L536-L604 HydrophobicContact CD2-CB 3.9Å; L536-L604 HydrophobicContact CD2-CD1 4.09Å; L536-L604 HydrophobicContact CD2-CG 4.45Å; I539-L604 HydrophobicContact CB-CD1 4.46Å; I539-L604 HydrophobicContact CG2-CD1 3.8Å; V540-L604 HydrophobicContact CG2-CD1 4.21Å; L581-L604 HydrophobicContact CD1-CD1 4.39Å; L581-L604 HydrophobicContact CD1-CD2 4.13Å; L581-L604 HydrophobicContact CD1-CG 4.36Å; I585-L604 HydrophobicContact CG1-CD2 4.18Å; L588-L604 HydrophobicContact CD1-CD2 3.8Å; T600-L604 WeakPolarHBondContact O-CB 3.34Å; T600-L604 PolarHBondContact O-N 2.82Å; L601-L604 PolarHBondContact O-N 2.88Å; L604-R607 PolarHBondContact O-N 2.9Å; L604-F608 WeakPolarHBondContact O-CB 3.44Å; L604-F608 PolarHBondContact O-N 2.83Å
605	V	88.1	Confident	85.9	Confident	3 Å²	3	36.1 Å²	36.1	2%	0.018	18%	0.182	C	C	.	.	H	α-helix	trans	-65.5	-40.3	177.8	172.9	0	0	0	0	112.3	L601 S602 E603 F608 H609 V640 I643 A648 F652	L601-V605 VanDerWaalsContact O-CG2 3.24Å; L601-V605 WeakPolarHBondContact O-CG2 3.32Å; L601-V605 PolarHBondContact O-N 3.14Å; S602-V605 PolarHBondContact O-N 2.88Å; E603-V605 PolarHBondContact O-N 3.22Å; V605-F608 PolarHBondContact O-N 2.81Å; V605-H609 VanDerWaalsContact O-CB 3.23Å; V605-H609 WeakPolarHBondContact O-CB 3.13Å; V605-H609 PolarHBondContact O-N 3.25Å; V605-V640 HydrophobicContact CG1-CG1 3.68Å; V605-V640 HydrophobicContact CG2-CG1 4.03Å; V605-I643 HydrophobicContact CG2-CD1 3.59Å; V605-A648 HydrophobicContact CB-CB 4.18Å; V605-A648 HydrophobicContact CG1-CB 3.6Å; V605-A648 HydrophobicContact CG2-CB 4.04Å; V605-F652 HydrophobicContact CG1-CD2 4.39Å; V605-F652 HydrophobicContact CG1-CE2 3.99Å
606	V	85.9	Confident	86.6	Confident	52 Å²	52	32.7 Å²	32.7	32%	0.315	16%	0.158	S	C	.	.	H	α-helix	trans	-63.6	-45.4	177.4	170.4	0	0	0	0	110.9	S602 E603 H609 R610 L647 L651	S602-V606 WeakPolarHBondContact O-CG2 3.03Å; S602-V606 PolarHBondContact O-N 3.24Å; E603-V606 PolarHBondContact O-N 2.98Å; E603-V606 VanDerWaalsContact O-N 3.11Å; V606-H609 PolarHBondContact O-N 3.46Å; V606-R610 PolarHBondContact O-N 3.03Å; V606-L647 HydrophobicContact CG2-CD2 3.84Å; V606-L651 HydrophobicContact CG2-CD1 4.06Å
607	R	88.6	Confident	86.9	Confident	41 Å²	41	35.5 Å²	35.5	16%	0.155	17%	0.168	C	C	.	.	H	α-helix	trans	-65.5	-42.9	176.4	-66.7	-176	-173.1	-161.6	3.5	111.8	D533 T537 V540 E603 L604 R610 V611	D533-R607 IonicContact OD1-CZ 3.13Å; D533-R607 IonicContact OD1-NH1 2.98Å; D533-R607 PolarHBondContact OD1-NH1 3.42Å; D533-R607 IonicContact OD1-NH2 3.31Å; D533-R607 PolarHBondContact OD1-NH2 3.48Å; T537-R607 PolarHBondContact OG1-NH1 2.73Å; V540-R607 HydrophobicContact CG1-CB 4.33Å; V540-R607 HydrophobicContact CG2-CB 3.64Å; E603-R607 HydrophobicContact CG-CG 4.44Å; E603-R607 WeakPolarHBondContact O-CG 3.46Å; E603-R607 PolarHBondContact O-N 3.2Å; E603-R607 IonicContact OE1-CZ 2.73Å; E603-R607 IonicContact OE1-NE 2.74Å; E603-R607 PolarHBondContact OE1-NE 3.22Å; E603-R607 IonicContact OE1-NH2 3.93Å; E603-R607 PolarHBondContact OE1-NH2 2.99Å; E603-R607 VanDerWaalsContact OE1-NH2 3.08Å; L604-R607 PolarHBondContact O-N 2.9Å; R607-R610 PolarHBondContact O-N 3.34Å; R607-V611 PolarHBondContact O-N 2.87Å
608	F	91.6	Very high	87	Confident	3 Å²	3	41 Å²	41	1%	0.013	19%	0.193	C	C	.	.	H	α-helix	trans	-60.7	-49.4	175.5	177	-122.5	0	0	0	111.5	V543 V577 L581 L604 V605 R610 V611 I612 Y636 V640 F652	V543-F608 HydrophobicContact CG1-CD2 4.01Å; V543-F608 HydrophobicContact CG1-CE2 3.89Å; V577-F608 HydrophobicContact CG1-CE2 3.65Å; V577-F608 HydrophobicContact CG1-CZ 3.99Å; L581-F608 HydrophobicContact CD2-CD1 3.87Å; L581-F608 HydrophobicContact CD2-CD2 4.4Å; L581-F608 HydrophobicContact CD2-CE1 3.75Å; L581-F608 HydrophobicContact CD2-CE2 4.3Å; L581-F608 HydrophobicContact CD2-CG 4.21Å; L581-F608 HydrophobicContact CD2-CZ 3.99Å; L604-F608 WeakPolarHBondContact O-CB 3.44Å; L604-F608 PolarHBondContact O-N 2.83Å; V605-F608 PolarHBondContact O-N 2.81Å; F608-R610 VanDerWaalsContact C-N 3.29Å; F608-R610 PolarHBondContact O-N 3.17Å; F608-V611 PolarHBondContact O-N 3.17Å; F608-V611 VanDerWaalsContact O-N 3.14Å; F608-I612 HydrophobicContact CD2-CD1 4.48Å; F608-I612 HydrophobicContact CD2-CG1 4.13Å; F608-I612 HydrophobicContact CE1-CG1 4.27Å; F608-I612 HydrophobicContact CE2-CD1 3.7Å; F608-I612 HydrophobicContact CE2-CG1 3.67Å; F608-I612 HydrophobicContact CZ-CD1 3.93Å; F608-I612 HydrophobicContact CZ-CG1 3.74Å; F608-I612 WeakPolarHBondContact O-CG1 3.38Å; F608-I612 PolarHBondContact O-N 2.93Å; F608-Y636 HydrophobicContact CE1-CD1 4.35Å; F608-Y636 HydrophobicContact CE1-CG 4.36Å; F608-Y636 AromaticContact CZ-CD1 3.66Å; F608-Y636 HydrophobicContact CZ-CD1 3.66Å; F608-Y636 HydrophobicContact CZ-CE1 4.08Å; F608-Y636 AromaticContact CZ-CG 3.96Å; F608-Y636 HydrophobicContact CZ-CG 3.96Å; F608-V640 HydrophobicContact CD1-CG2 4.06Å; F608-V640 HydrophobicContact CE1-CG2 3.99Å; F608-F652 HydrophobicContact CD1-CE1 4.43Å; F608-F652 HydrophobicContact CD1-CE2 4.1Å; F608-F652 AromaticContact CD1-CZ 3.49Å; F608-F652 HydrophobicContact CD1-CZ 3.49Å; F608-F652 VanDerWaalsContact CD1-CZ 3.49Å; F608-F652 AromaticContact CE1-CE1 4Å; F608-F652 HydrophobicContact CE1-CE1 4Å; F608-F652 HydrophobicContact CE1-CE2 4.41Å; F608-F652 AromaticContact CE1-CZ 3.49Å; F608-F652 HydrophobicContact CE1-CZ 3.49Å; F608-F652 VanDerWaalsContact CE1-CZ 3.49Å
609	H	89.3	Confident	87.1	Confident	33 Å²	33	38.3 Å²	38.3	15%	0.153	18%	0.179	C	C	.	.	H	α-helix	trans	-56	-43.5	175.1	175.8	-87.1	0	0	0	111.7	V605 V606 I612 V613 L651 F652	V605-H609 VanDerWaalsContact O-CB 3.23Å; V605-H609 WeakPolarHBondContact O-CB 3.13Å; V605-H609 PolarHBondContact O-N 3.25Å; V606-H609 PolarHBondContact O-N 3.46Å; H609-I612 PolarHBondContact O-N 3.32Å; H609-V613 WeakPolarHBondContact O-CB 3.37Å; H609-V613 VanDerWaalsContact O-CG2 3.3Å; H609-V613 WeakPolarHBondContact O-CG2 3.45Å; H609-V613 PolarHBondContact O-N 3.09Å; H609-L651 HydrophobicContact CB-CD1 4.48Å; H609-F652 HydrophobicContact CB-CE2 3.86Å; H609-F652 HydrophobicContact CB-CZ 4.16Å
610	R	87.7	Confident	87	Confident	175 Å²	175	42 Å²	42	66%	0.66	20%	0.195	S	C	*	.	H	α-helix	trans	-60.9	-45.7	176.2	-174.1	176.6	178.7	174.7	0.2	111.9	V606 R607 F608 I612 V613 D614	V606-R610 PolarHBondContact O-N 3.03Å; R607-R610 PolarHBondContact O-N 3.34Å; F608-R610 VanDerWaalsContact C-N 3.29Å; F608-R610 PolarHBondContact O-N 3.17Å; R610-I612 PolarHBondContact O-N 3.01Å; R610-V613 PolarHBondContact O-N 3.34Å; R610-D614 WeakPolarHBondContact O-CB 3.43Å; R610-D614 VanDerWaalsContact O-CG 3.27Å; R610-D614 PolarHBondContact O-N 3.04Å
611	V	89.5	Confident	86.9	Confident	8 Å²	8	42.1 Å²	42.1	5%	0.048	20%	0.196	C	C	.	.	H	α-helix	trans	-61.6	-41.9	176.6	169	0	0	0	0	112.1	V540 V543 R544 L547 R607 F608 D614 H615	V540-V611 HydrophobicContact CG1-CB 4.46Å; V540-V611 HydrophobicContact CG1-CG2 3.34Å; V543-V611 HydrophobicContact CG1-CG1 4.25Å; R544-V611 HydrophobicContact CB-CG1 4.32Å; L547-V611 HydrophobicContact CD1-CG1 3.81Å; R607-V611 PolarHBondContact O-N 2.87Å; F608-V611 PolarHBondContact O-N 3.17Å; F608-V611 VanDerWaalsContact O-N 3.14Å; V611-D614 PolarHBondContact O-N 3.43Å; V611-H615 VanDerWaalsContact O-CB 3.27Å; V611-H615 WeakPolarHBondContact O-CB 3.49Å; V611-H615 PolarHBondContact O-N 2.91Å
612	I	90.7	Very high	86.6	Confident	2 Å²	2	42.8 Å²	42.8	1%	0.01	20%	0.199	C	C	.	.	H	α-helix	trans	-65.1	-43.5	176.7	-63.9	-57.2	0	0	0	111.3	L547 F608 H609 R610 H615 I616 Y636 L655	L547-I612 HydrophobicContact CD1-CD1 3.82Å; F608-I612 HydrophobicContact CD2-CD1 4.48Å; F608-I612 HydrophobicContact CD2-CG1 4.13Å; F608-I612 HydrophobicContact CE1-CG1 4.27Å; F608-I612 HydrophobicContact CE2-CD1 3.7Å; F608-I612 HydrophobicContact CE2-CG1 3.67Å; F608-I612 HydrophobicContact CZ-CD1 3.93Å; F608-I612 HydrophobicContact CZ-CG1 3.74Å; F608-I612 WeakPolarHBondContact O-CG1 3.38Å; F608-I612 PolarHBondContact O-N 2.93Å; H609-I612 PolarHBondContact O-N 3.32Å; R610-I612 PolarHBondContact O-N 3.01Å; I612-H615 WeakPolarHBondContact O-CB 3.45Å; I612-H615 PolarHBondContact O-N 3.46Å; I612-I616 HydrophobicContact CG2-CD1 3.85Å; I612-I616 HydrophobicContact CG2-CG1 4.44Å; I612-I616 VanDerWaalsContact O-CG1 3.27Å; I612-I616 WeakPolarHBondContact O-CG1 3.38Å; I612-I616 PolarHBondContact O-N 3.32Å; I612-Y636 HydrophobicContact CD1-CD2 4.06Å; I612-Y636 HydrophobicContact CD1-CE1 4.4Å; I612-Y636 HydrophobicContact CD1-CE2 3.56Å; I612-Y636 HydrophobicContact CG1-CD2 4.31Å; I612-Y636 HydrophobicContact CG1-CE2 4.29Å; I612-Y636 HydrophobicContact CG2-CD2 4.24Å; I612-Y636 HydrophobicContact CG2-CE2 4.29Å; I612-L655 HydrophobicContact CG2-CD2 3.79Å
613	V	84.5	Confident	86.2	Confident	20 Å²	20	45.3 Å²	45.3	12%	0.121	22%	0.217	C	C	.	.	H	α-helix	trans	-62.9	-46.7	177.3	170.1	0	0	0	0	111.2	H609 R610 H615 I616 Y617 L655	H609-V613 WeakPolarHBondContact O-CB 3.37Å; H609-V613 VanDerWaalsContact O-CG2 3.3Å; H609-V613 WeakPolarHBondContact O-CG2 3.45Å; H609-V613 PolarHBondContact O-N 3.09Å; R610-V613 PolarHBondContact O-N 3.34Å; V613-H615 VanDerWaalsContact C-N 3.26Å; V613-H615 PolarHBondContact O-N 3Å; V613-I616 PolarHBondContact O-N 2.61Å; V613-Y617 HydrophobicContact CG1-CD2 3.77Å; V613-Y617 HydrophobicContact CG1-CE2 3.46Å; V613-Y617 VanDerWaalsContact CG1-CE2 3.46Å; V613-Y617 WeakPolarHBondContact O-CD2 3.24Å; V613-Y617 PolarHBondContact O-N 3.32Å; V613-Y617 VanDerWaalsContact O-N 3.14Å; V613-L655 HydrophobicContact CG2-CD1 3.9Å; V613-L655 HydrophobicContact CG2-CD2 4.45Å
614	D	84.7	Confident	86	Confident	70 Å²	70	47.7 Å²	47.7	37%	0.374	23%	0.228	S	C	.	.	H	α-helix	trans	-61.9	-36.3	177	-69.7	-17.1	0	0	0	111.3	R610 V611 Q618	R610-D614 WeakPolarHBondContact O-CB 3.43Å; R610-D614 VanDerWaalsContact O-CG 3.27Å; R610-D614 PolarHBondContact O-N 3.04Å; V611-D614 PolarHBondContact O-N 3.43Å; D614-Q618 WeakPolarHBondContact O-CG 3.27Å
615	H	89.1	Confident	85.8	Confident	16 Å²	16	47.6 Å²	47.6	7%	0.074	23%	0.227	C	C	.	.	H	α-helix	trans	-65.9	-44.6	174.4	179.5	71.8	0	0	0	112	L547 V611 I612 V613 Y617 Q618 F619	L547-H615 HydrophobicContact CD1-CB 4.25Å; V611-H615 VanDerWaalsContact O-CB 3.27Å; V611-H615 WeakPolarHBondContact O-CB 3.49Å; V611-H615 PolarHBondContact O-N 2.91Å; I612-H615 WeakPolarHBondContact O-CB 3.45Å; I612-H615 PolarHBondContact O-N 3.46Å; V613-H615 VanDerWaalsContact C-N 3.26Å; V613-H615 PolarHBondContact O-N 3Å; H615-Y617 VanDerWaalsContact C-N 3.28Å; H615-Y617 PolarHBondContact O-N 3.33Å; H615-Q618 WeakPolarHBondContact O-CB 3.44Å; H615-Q618 PolarHBondContact O-N 2.83Å; H615-F619 AromaticContact CE1-CE2 3.33Å; H615-F619 WeakPolarHBondContact CE1-CE2 3.49Å; H615-F619 AromaticContact CE1-CZ 3.76Å; H615-F619 AromaticContact ND1-CE2 3.68Å; H615-F619 AromaticContact NE2-CE2 3.74Å; H615-F619 VanDerWaalsContact O-CD2 3.26Å; H615-F619 WeakPolarHBondContact O-CD2 3.36Å
616	I	87.3	Confident	85.6	Confident	1 Å²	1	47.4 Å²	47.4	1%	0.005	23%	0.227	C	C	.	.	H	α-helix	trans	-59.6	-39.6	178.1	-70.9	165.7	0	0	0	111.4	I612 V613 Q618 F619 Y621 L629 V633 L655 F692 L695	I612-I616 HydrophobicContact CG2-CD1 3.85Å; I612-I616 HydrophobicContact CG2-CG1 4.44Å; I612-I616 VanDerWaalsContact O-CG1 3.27Å; I612-I616 WeakPolarHBondContact O-CG1 3.38Å; I612-I616 PolarHBondContact O-N 3.32Å; V613-I616 PolarHBondContact O-N 2.61Å; I616-Q618 PolarHBondContact O-N 3.12Å; I616-Q618 VanDerWaalsContact O-N 3.14Å; I616-F619 PolarHBondContact O-N 2.84Å; I616-Y621 WeakPolarHBondContact CA-OH 3.27Å; I616-Y621 HydrophobicContact CG2-CE2 4.3Å; I616-Y621 PolarHBondContact O-OH 3.44Å; I616-Y621 VanDerWaalsContact O-OH 3.12Å; I616-L629 HydrophobicContact CD1-CD1 4Å; I616-L629 HydrophobicContact CG1-CD1 3.78Å; I616-L629 HydrophobicContact CG1-CD2 4.39Å; I616-L629 HydrophobicContact CG2-CD2 4.16Å; I616-V633 HydrophobicContact CD1-CG2 4.34Å; I616-L655 HydrophobicContact CD1-CD1 3.93Å; I616-L655 HydrophobicContact CD1-CD2 4.31Å; I616-L655 HydrophobicContact CD1-CG 4.43Å; I616-F692 HydrophobicContact CG2-CE1 3.88Å; I616-F692 HydrophobicContact CG2-CZ 3.83Å; I616-L695 HydrophobicContact CG2-CD1 4.14Å
617	Y	83.3	Confident	85.6	Confident	75 Å²	75	47.2 Å²	47.2	29%	0.294	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-9.8	178.2	-79.3	-62.7	0	0	0	114.7	V613 H615 L688 A691 F692 L695	V613-Y617 HydrophobicContact CG1-CD2 3.77Å; V613-Y617 HydrophobicContact CG1-CE2 3.46Å; V613-Y617 VanDerWaalsContact CG1-CE2 3.46Å; V613-Y617 WeakPolarHBondContact O-CD2 3.24Å; V613-Y617 PolarHBondContact O-N 3.32Å; V613-Y617 VanDerWaalsContact O-N 3.14Å; H615-Y617 VanDerWaalsContact C-N 3.28Å; H615-Y617 PolarHBondContact O-N 3.33Å; Y617-L688 HydrophobicContact CE2-CD2 4.46Å; Y617-L688 WeakPolarHBondContact OH-CD2 3.18Å; Y617-A691 HydrophobicContact CE1-CB 3.82Å; Y617-A691 WeakPolarHBondContact OH-CB 3.32Å; Y617-F692 HydrophobicContact CE1-CD2 4.28Å; Y617-F692 HydrophobicContact CE1-CE2 4.41Å; Y617-F692 HydrophobicContact CE2-CE2 4.29Å; Y617-F692 AromaticContact CZ-CD2 3.98Å; Y617-F692 AromaticContact CZ-CE2 3.85Å; Y617-F692 WeakPolarHBondContact OH-CD2 3.39Å; Y617-L695 HydrophobicContact CD1-CD1 4.07Å; Y617-L695 HydrophobicContact CD1-CD2 4.2Å; Y617-L695 HydrophobicContact CE1-CD1 4.25Å
618	Q	85.4	Confident	85.5	Confident	140 Å²	140	48.6 Å²	48.6	65%	0.654	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.2	-7.6	179.4	-66.8	172.4	13.8	0	0	113.9	D614 H615 I616	D614-Q618 WeakPolarHBondContact O-CG 3.27Å; H615-Q618 WeakPolarHBondContact O-CB 3.44Å; H615-Q618 PolarHBondContact O-N 2.83Å; I616-Q618 PolarHBondContact O-N 3.12Å; I616-Q618 VanDerWaalsContact O-N 3.14Å
619	F	85.9	Confident	85.5	Confident	23 Å²	23	48.7 Å²	48.7	10%	0.101	23%	0.234	C	C	.	.			trans	-118.8	159.2	-175.6	-63.5	-96.7	0	0	0	112.4	Q551 R553 F556 H615 I616 Y621	Q551-F619 HydrophobicContact CB-CZ 4.42Å; Q551-F619 HydrophobicContact CG-CE1 4.43Å; Q551-F619 HydrophobicContact CG-CZ 4.02Å; R553-F619 HydrophobicContact CG-CD1 4.4Å; R553-F619 HydrophobicContact CG-CE1 4.22Å; F556-F619 HydrophobicContact CD2-CB 3.9Å; F556-F619 AromaticContact CD2-CD1 3.66Å; F556-F619 HydrophobicContact CD2-CD1 3.66Å; F556-F619 HydrophobicContact CD2-CD2 4.07Å; F556-F619 HydrophobicContact CD2-CE1 4.16Å; F556-F619 AromaticContact CD2-CG 3.6Å; F556-F619 HydrophobicContact CD2-CG 3.6Å; F556-F619 HydrophobicContact CE2-CD1 4.35Å; F556-F619 HydrophobicContact CE2-CD2 4.14Å; F556-F619 HydrophobicContact CE2-CE2 4.38Å; F556-F619 HydrophobicContact CE2-CG 4.14Å; H615-F619 AromaticContact CE1-CE2 3.33Å; H615-F619 WeakPolarHBondContact CE1-CE2 3.49Å; H615-F619 AromaticContact CE1-CZ 3.76Å; H615-F619 AromaticContact ND1-CE2 3.68Å; H615-F619 AromaticContact NE2-CE2 3.74Å; H615-F619 VanDerWaalsContact O-CD2 3.26Å; H615-F619 WeakPolarHBondContact O-CD2 3.36Å; I616-F619 PolarHBondContact O-N 2.84Å; F619-Y621 HydrophobicContact CB-CE1 4.45Å; F619-Y621 HydrophobicContact CB-CE2 4Å; F619-Y621 WeakPolarHBondContact O-CE2 3.44Å
620	Q	80.7	Confident	85.4	Confident	127 Å²	127	48.7 Å²	48.7	59%	0.593	24%	0.235	S	C	*	.			trans	-108	148.3	166.8	-69.5	-177.8	-23.3	0	0	108.6
621	Y	85	Confident	85.6	Confident	2 Å²	2	41.6 Å²	41.6	1%	0.008	21%	0.212	C	C	.	.	B	Isolated β-bridge	trans	-124.5	132.3	-171.2	-58.9	-93.2	0	0	0	111.4	F556 I616 F619 L629 L662 L695 E697	F556-Y621 HydrophobicContact CB-CD1 3.68Å; F556-Y621 HydrophobicContact CB-CE1 3.66Å; F556-Y621 HydrophobicContact CD1-CD1 4.22Å; F556-Y621 AromaticContact CD1-CE1 3.75Å; F556-Y621 HydrophobicContact CD1-CE1 3.75Å; F556-Y621 AromaticContact CD2-CE1 3.77Å; F556-Y621 HydrophobicContact CD2-CE1 3.77Å; F556-Y621 HydrophobicContact CE1-CE1 4.3Å; F556-Y621 HydrophobicContact CE2-CE1 4.31Å; F556-Y621 AromaticContact CG-CD1 3.97Å; F556-Y621 HydrophobicContact CG-CD1 3.97Å; F556-Y621 AromaticContact CG-CE1 3.45Å; F556-Y621 HydrophobicContact CG-CE1 3.45Å; F556-Y621 VanDerWaalsContact CG-CE1 3.45Å; I616-Y621 WeakPolarHBondContact CA-OH 3.27Å; I616-Y621 HydrophobicContact CG2-CE2 4.3Å; I616-Y621 PolarHBondContact O-OH 3.44Å; I616-Y621 VanDerWaalsContact O-OH 3.12Å; F619-Y621 HydrophobicContact CB-CE1 4.45Å; F619-Y621 HydrophobicContact CB-CE2 4Å; F619-Y621 WeakPolarHBondContact O-CE2 3.44Å; Y621-L629 HydrophobicContact CD1-CB 4.33Å; Y621-L629 HydrophobicContact CD1-CD2 4.26Å; Y621-L629 HydrophobicContact CE1-CB 3.92Å; Y621-L629 HydrophobicContact CE1-CD1 4.47Å; Y621-L629 HydrophobicContact CE1-CD2 3.66Å; Y621-L629 HydrophobicContact CE1-CG 4.21Å; Y621-L662 HydrophobicContact CD2-CD1 4.24Å; Y621-L662 HydrophobicContact CG-CD1 4.34Å; Y621-L695 HydrophobicContact CD2-CB 3.91Å; Y621-L695 HydrophobicContact CE2-CB 4.29Å; Y621-L695 HydrophobicContact CE2-CD1 4.25Å; Y621-L695 PolarHBondContact N-O 2.69Å; Y621-E697 PolarHBondContact O-N 2.9Å
622	N	81.3	Confident	85.8	Confident	22 Å²	22	41.4 Å²	41.4	12%	0.118	21%	0.211	C	C	.	.			trans	-92.1	176.7	159.4	70	7.5	0	0	0	110	F556 P558 Q624 G625 A626	F556-N622 PolarHBondContact O-N 2.88Å; P558-N622 WeakPolarHBondContact CD-OD1 3.4Å; P558-N622 PolarHBondContact O-ND2 2.68Å; N622-Q624 VanDerWaalsContact C-N 3.32Å; N622-Q624 PolarHBondContact O-N 3.1Å; N622-Q624 PolarHBondContact OD1-N 3.46Å; N622-G625 PolarHBondContact O-N 3.45Å; N622-G625 PolarHBondContact OD1-N 3.06Å; N622-A626 WeakPolarHBondContact O-CB 3.29Å; N622-A626 PolarHBondContact O-N 2.99Å
623	S	77.8	Confident	85.8	Confident	82 Å²	82	41.3 Å²	41.3	57%	0.573	21%	0.21	S	C	*	.	H	α-helix	trans	-60.5	-39.4	-175.9	56.5	0	0	0	0	112.9	V627	S623-V627 WeakPolarHBondContact O-CG2 3.35Å; S623-V627 PolarHBondContact O-N 3.29Å
624	Q	80.3	Confident	86.1	Confident	104 Å²	104	41.9 Å²	41.9	49%	0.486	22%	0.215	S	C	.	.	H	α-helix	trans	-70	-44.1	177.5	-66.3	-175.2	-4.5	0	0	112.1	P558 N622 A626 V627 H628	P558-Q624 HydrophobicContact CG-CB 3.82Å; N622-Q624 VanDerWaalsContact C-N 3.32Å; N622-Q624 PolarHBondContact O-N 3.1Å; N622-Q624 PolarHBondContact OD1-N 3.46Å; Q624-A626 VanDerWaalsContact C-N 3.32Å; Q624-A626 PolarHBondContact O-N 3.3Å; Q624-V627 WeakPolarHBondContact O-CB 3.38Å; Q624-V627 PolarHBondContact O-N 3.08Å; Q624-V627 VanDerWaalsContact O-N 3.14Å; Q624-H628 PolarHBondContact O-N 2.93Å
625	G	84.6	Confident	86.4	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-65.6	-31.6	176.4	0	0	0	0	0	113.5	F556 N622 V627 H628 L629	F556-G625 WeakPolarHBondContact O-CA 3.34Å; N622-G625 PolarHBondContact O-N 3.45Å; N622-G625 PolarHBondContact OD1-N 3.06Å; G625-V627 VanDerWaalsContact C-N 3.34Å; G625-H628 WeakPolarHBondContact O-CB 3.35Å; G625-H628 PolarHBondContact O-N 3.34Å; G625-L629 PolarHBondContact O-N 3.21Å
626	A	84.4	Confident	86.6	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-66	-35.6	171.7	0	0	0	0	0	112.2	N622 Q624 L630 L662 I663	N622-A626 WeakPolarHBondContact O-CB 3.29Å; N622-A626 PolarHBondContact O-N 2.99Å; Q624-A626 VanDerWaalsContact C-N 3.32Å; Q624-A626 PolarHBondContact O-N 3.3Å; A626-L630 PolarHBondContact O-N 3.46Å; A626-L662 HydrophobicContact CB-CB 3.74Å; A626-I663 HydrophobicContact CB-CG1 3.68Å
627	V	86.3	Confident	86.8	Confident	48 Å²	48	45.1 Å²	45.1	29%	0.291	22%	0.224	S	C	.	.	H	α-helix	trans	-67.9	-40.3	172.6	176.5	0	0	0	0	110.8	P568 S623 Q624 G625 L630 C631 I663	P568-V627 HydrophobicContact CB-CG1 3.91Å; P568-V627 HydrophobicContact CG-CG1 3.89Å; S623-V627 WeakPolarHBondContact O-CG2 3.35Å; S623-V627 PolarHBondContact O-N 3.29Å; Q624-V627 WeakPolarHBondContact O-CB 3.38Å; Q624-V627 PolarHBondContact O-N 3.08Å; Q624-V627 VanDerWaalsContact O-N 3.14Å; G625-V627 VanDerWaalsContact C-N 3.34Å; V627-L630 WeakPolarHBondContact O-CB 3.4Å; V627-L630 PolarHBondContact O-N 3.31Å; V627-L630 VanDerWaalsContact O-N 3.15Å; V627-C631 PolarHBondContact O-N 2.79Å; V627-C631 VanDerWaalsContact O-N 3.09Å; V627-C631 PolarHBondContact O-SG 2.94Å; V627-I663 HydrophobicContact CG2-CD1 4Å; V627-I663 HydrophobicContact CG2-CG1 4.28Å
628	H	86.9	Confident	87.1	Confident	70 Å²	70	47.1 Å²	47.1	32%	0.324	23%	0.234	S	C	.	.	H	α-helix	trans	-60.2	-45.4	173.3	-83.9	-147.8	0	0	0	112.4	F556 Q624 G625 L630 C631 D632	F556-H628 HydrophobicContact CD1-CB 4.5Å; Q624-H628 PolarHBondContact O-N 2.93Å; G625-H628 WeakPolarHBondContact O-CB 3.35Å; G625-H628 PolarHBondContact O-N 3.34Å; H628-L630 PolarHBondContact O-N 3.25Å; H628-C631 WeakPolarHBondContact O-CB 3.33Å; H628-C631 PolarHBondContact O-N 3.21Å; H628-D632 PolarHBondContact O-N 3.32Å; H628-D632 VanDerWaalsContact O-N 3.13Å
629	L	90	Very high	87.3	Confident	4 Å²	4	42.1 Å²	42.1	2%	0.021	21%	0.211	C	C	.	.	H	α-helix	trans	-58.9	-38.4	173.6	174.9	65.3	0	0	0	111.9	F556 I616 Y621 G625 C631 D632 V633 L662	F556-L629 HydrophobicContact CD1-CB 4.29Å; F556-L629 HydrophobicContact CE1-CB 3.99Å; F556-L629 HydrophobicContact CE1-CD1 4.35Å; F556-L629 HydrophobicContact CZ-CD1 4.25Å; I616-L629 HydrophobicContact CD1-CD1 4Å; I616-L629 HydrophobicContact CG1-CD1 3.78Å; I616-L629 HydrophobicContact CG1-CD2 4.39Å; I616-L629 HydrophobicContact CG2-CD2 4.16Å; Y621-L629 HydrophobicContact CD1-CB 4.33Å; Y621-L629 HydrophobicContact CD1-CD2 4.26Å; Y621-L629 HydrophobicContact CE1-CB 3.92Å; Y621-L629 HydrophobicContact CE1-CD1 4.47Å; Y621-L629 HydrophobicContact CE1-CD2 3.66Å; Y621-L629 HydrophobicContact CE1-CG 4.21Å; G625-L629 PolarHBondContact O-N 3.21Å; L629-C631 VanDerWaalsContact C-N 3.32Å; L629-C631 PolarHBondContact O-N 2.89Å; L629-D632 PolarHBondContact O-N 3.28Å; L629-V633 HydrophobicContact CD1-CG2 3.98Å; L629-V633 HydrophobicContact CG-CG2 4.25Å; L629-V633 WeakPolarHBondContact O-CG2 3.27Å; L629-V633 PolarHBondContact O-N 3.05Å; L629-L662 HydrophobicContact CD2-CD1 3.59Å
630	L	88.8	Confident	87.4	Confident	33 Å²	33	41 Å²	41	17%	0.173	21%	0.207	C	C	.	.	H	α-helix	trans	-64.5	-38.9	178.9	-168.1	66.9	0	0	0	111.7	A626 V627 H628 S634 N660 I663	A626-L630 PolarHBondContact O-N 3.46Å; V627-L630 WeakPolarHBondContact O-CB 3.4Å; V627-L630 PolarHBondContact O-N 3.31Å; V627-L630 VanDerWaalsContact O-N 3.15Å; H628-L630 PolarHBondContact O-N 3.25Å; L630-S634 VanDerWaalsContact O-CB 3.29Å; L630-S634 WeakPolarHBondContact O-CB 3.27Å; L630-S634 PolarHBondContact O-N 3.24Å; L630-N660 WeakPolarHBondContact CD1-OD1 3.36Å; L630-N660 WeakPolarHBondContact CD2-OD1 3.46Å; L630-I663 HydrophobicContact CB-CD1 4.35Å; L630-I663 HydrophobicContact CD2-CD1 3.82Å
631	C	90.6	Very high	87.5	Confident	26 Å²	26	38.2 Å²	38.2	18%	0.176	20%	0.201	C	C	.	.	H	α-helix	trans	-58.7	-48.3	171.8	-66.8	0	0	0	0	111	V627 H628 L629 S634 E635	V627-C631 PolarHBondContact O-N 2.79Å; V627-C631 VanDerWaalsContact O-N 3.09Å; V627-C631 PolarHBondContact O-SG 2.94Å; H628-C631 WeakPolarHBondContact O-CB 3.33Å; H628-C631 PolarHBondContact O-N 3.21Å; L629-C631 VanDerWaalsContact C-N 3.32Å; L629-C631 PolarHBondContact O-N 2.89Å; C631-S634 WeakPolarHBondContact O-CB 3.34Å; C631-S634 PolarHBondContact O-N 3.07Å; C631-S634 PolarHBondContact O-OG 3.02Å; C631-E635 PolarHBondContact O-N 3.45Å
632	D	93.2	Very high	87.3	Confident	5 Å²	5	41.4 Å²	41.4	3%	0.027	23%	0.234	C	C	.	.	H	α-helix	trans	-60.6	-49.1	178.4	-73	-1.1	0	0	0	112.3	C570 S571 C574 H628 L629 S634 E635 Y636	C570-D632 VanDerWaalsContact CA-OD1 3.25Å; C570-D632 WeakPolarHBondContact CA-OD1 3.17Å; C570-D632 WeakPolarHBondContact CB-OD1 3.44Å; S571-D632 WeakPolarHBondContact CB-OD2 3.28Å; S571-D632 PolarHBondContact N-OD1 3.49Å; S571-D632 VanDerWaalsContact OG-CG 3.25Å; S571-D632 PolarHBondContact OG-OD1 2.67Å; S571-D632 PolarHBondContact OG-OD2 3.05Å; C574-D632 HydrophobicContact CB-CB 4.05Å; C574-D632 VanDerWaalsContact CB-CG 3.49Å; C574-D632 VanDerWaalsContact CB-OD1 3.31Å; C574-D632 WeakPolarHBondContact CB-OD1 3.48Å; H628-D632 PolarHBondContact O-N 3.32Å; H628-D632 VanDerWaalsContact O-N 3.13Å; L629-D632 PolarHBondContact O-N 3.28Å; D632-S634 PolarHBondContact O-N 3.3Å; D632-E635 PolarHBondContact O-N 3.04Å; D632-E635 VanDerWaalsContact O-N 3.1Å; D632-Y636 HydrophobicContact CB-CE2 4.21Å; D632-Y636 VanDerWaalsContact O-CD2 3.25Å; D632-Y636 WeakPolarHBondContact O-CD2 3.17Å; D632-Y636 PolarHBondContact O-N 3.22Å
633	V	91.8	Very high	87.3	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-63	-33.2	178	173.8	0	0	0	0	111.4	I616 L629 R637 L655 H656	I616-V633 HydrophobicContact CD1-CG2 4.34Å; L629-V633 HydrophobicContact CD1-CG2 3.98Å; L629-V633 HydrophobicContact CG-CG2 4.25Å; L629-V633 WeakPolarHBondContact O-CG2 3.27Å; L629-V633 PolarHBondContact O-N 3.05Å; V633-R637 WeakPolarHBondContact O-CB 3.39Å; V633-R637 PolarHBondContact O-N 3.25Å; V633-L655 HydrophobicContact CG1-CB 4.48Å; V633-L655 HydrophobicContact CG1-CD2 4.33Å; V633-L655 HydrophobicContact CG1-CG 4.1Å; V633-L655 HydrophobicContact CG2-CD2 4.42Å; V633-L655 HydrophobicContact CG2-CG 4.43Å; V633-H656 HydrophobicContact CG1-CB 3.9Å
634	S	90.7	Very high	87.2	Confident	31 Å²	31	40 Å²	40	22%	0.217	23%	0.234	C	C	.	.	H	α-helix	trans	-66.5	-37.7	175	83.6	0	0	0	0	112.1	L630 C631 D632 R637 K638	L630-S634 VanDerWaalsContact O-CB 3.29Å; L630-S634 WeakPolarHBondContact O-CB 3.27Å; L630-S634 PolarHBondContact O-N 3.24Å; C631-S634 WeakPolarHBondContact O-CB 3.34Å; C631-S634 PolarHBondContact O-N 3.07Å; C631-S634 PolarHBondContact O-OG 3.02Å; D632-S634 PolarHBondContact O-N 3.3Å; S634-R637 WeakPolarHBondContact O-CB 3.48Å; S634-R637 PolarHBondContact O-N 3.22Å; S634-K638 WeakPolarHBondContact O-CG 3.4Å; S634-K638 PolarHBondContact O-N 2.9Å
635	E	91	Very high	87.1	Confident	59 Å²	59	35.7 Å²	35.7	28%	0.276	21%	0.214	S	C	.	.	H	α-helix	trans	-73.3	-43	179	-134.4	59.8	-162.3	0	0	111.7	C631 D632 R637 K638 I639	C631-E635 PolarHBondContact O-N 3.45Å; D632-E635 PolarHBondContact O-N 3.04Å; D632-E635 VanDerWaalsContact O-N 3.1Å; E635-R637 VanDerWaalsContact C-N 3.28Å; E635-R637 PolarHBondContact O-N 3.47Å; E635-K638 WeakPolarHBondContact O-CB 3.46Å; E635-K638 PolarHBondContact O-N 3.31Å; E635-K638 VanDerWaalsContact O-N 3.14Å; E635-K638 IonicContact OE1-NZ 3.58Å; E635-K638 PolarHBondContact OE1-NZ 3.07Å; E635-K638 WeakPolarHBondContact OE2-CE 3.44Å; E635-K638 IonicContact OE2-NZ 2.99Å; E635-K638 PolarHBondContact OE2-NZ 3.06Å; E635-I639 PolarHBondContact O-N 3.25Å
636	Y	93.5	Very high	86.7	Confident	7 Å²	7	40.2 Å²	40.2	3%	0.027	24%	0.244	C	C	.	.	H	α-helix	trans	-58.1	-42.9	170.9	-62.7	-37.8	0	0	0	111.7	C574 V577 F608 I612 D632 K638 I639 V640	C574-Y636 WeakPolarHBondContact CA-OH 3.22Å; C574-Y636 HydrophobicContact CB-CE1 4.26Å; V577-Y636 HydrophobicContact CB-CE1 4.01Å; V577-Y636 HydrophobicContact CG1-CD1 4.4Å; V577-Y636 HydrophobicContact CG1-CE1 3.65Å; F608-Y636 HydrophobicContact CE1-CD1 4.35Å; F608-Y636 HydrophobicContact CE1-CG 4.36Å; F608-Y636 AromaticContact CZ-CD1 3.66Å; F608-Y636 HydrophobicContact CZ-CD1 3.66Å; F608-Y636 HydrophobicContact CZ-CE1 4.08Å; F608-Y636 AromaticContact CZ-CG 3.96Å; F608-Y636 HydrophobicContact CZ-CG 3.96Å; I612-Y636 HydrophobicContact CD1-CD2 4.06Å; I612-Y636 HydrophobicContact CD1-CE1 4.4Å; I612-Y636 HydrophobicContact CD1-CE2 3.56Å; I612-Y636 HydrophobicContact CG1-CD2 4.31Å; I612-Y636 HydrophobicContact CG1-CE2 4.29Å; I612-Y636 HydrophobicContact CG2-CD2 4.24Å; I612-Y636 HydrophobicContact CG2-CE2 4.29Å; D632-Y636 HydrophobicContact CB-CE2 4.21Å; D632-Y636 VanDerWaalsContact O-CD2 3.25Å; D632-Y636 WeakPolarHBondContact O-CD2 3.17Å; D632-Y636 PolarHBondContact O-N 3.22Å; Y636-K638 VanDerWaalsContact C-N 3.32Å; Y636-K638 PolarHBondContact O-N 2.91Å; Y636-I639 PolarHBondContact O-N 3.14Å; Y636-V640 WeakPolarHBondContact O-CB 3.35Å; Y636-V640 WeakPolarHBondContact O-CG2 3.42Å; Y636-V640 PolarHBondContact O-N 2.66Å
637	R	90.9	Very high	86.2	Confident	89 Å²	89	43.2 Å²	43.2	34%	0.336	26%	0.259	S	S	.	.	H	α-helix	trans	-61.6	-37.9	176.6	-179.8	178.6	176.2	-129.9	-1	112.1	V633 S634 E635 S641 F652 D653	V633-R637 WeakPolarHBondContact O-CB 3.39Å; V633-R637 PolarHBondContact O-N 3.25Å; S634-R637 WeakPolarHBondContact O-CB 3.48Å; S634-R637 PolarHBondContact O-N 3.22Å; E635-R637 VanDerWaalsContact C-N 3.28Å; E635-R637 PolarHBondContact O-N 3.47Å; R637-S641 WeakPolarHBondContact O-CB 3.36Å; R637-S641 PolarHBondContact O-N 3.09Å; R637-S641 PolarHBondContact O-OG 3.32Å; R637-F652 HydrophobicContact CB-CB 4.04Å; R637-F652 HydrophobicContact CB-CD1 4.5Å; R637-F652 HydrophobicContact CG-CB 4.06Å; R637-D653 IonicContact CZ-OD1 2.68Å; R637-D653 IonicContact NE-OD1 2.64Å; R637-D653 PolarHBondContact NE-OD1 3.4Å; R637-D653 IonicContact NH2-OD1 3.64Å; R637-D653 PolarHBondContact NH2-OD1 2.91Å; R637-D653 IonicContact NH2-OD2 3Å
638	K	89.7	Confident	85.8	Confident	117 Å²	117	40.9 Å²	40.9	51%	0.509	25%	0.246	S	C	.	.	H	α-helix	trans	-60.1	-52.2	176.9	-74.3	171.4	-170.8	166.5	0	111.1	S634 E635 Y636 V640 S641 G642	S634-K638 WeakPolarHBondContact O-CG 3.4Å; S634-K638 PolarHBondContact O-N 2.9Å; E635-K638 WeakPolarHBondContact O-CB 3.46Å; E635-K638 PolarHBondContact O-N 3.31Å; E635-K638 VanDerWaalsContact O-N 3.14Å; E635-K638 IonicContact OE1-NZ 3.58Å; E635-K638 PolarHBondContact OE1-NZ 3.07Å; E635-K638 WeakPolarHBondContact OE2-CE 3.44Å; E635-K638 IonicContact OE2-NZ 2.99Å; E635-K638 PolarHBondContact OE2-NZ 3.06Å; Y636-K638 VanDerWaalsContact C-N 3.32Å; Y636-K638 PolarHBondContact O-N 2.91Å; K638-V640 PolarHBondContact O-N 2.63Å; K638-S641 PolarHBondContact O-N 2.94Å; K638-S641 PolarHBondContact O-OG 3.08Å; K638-G642 PolarHBondContact O-N 3.07Å
639	I	89.7	Confident	85.4	Confident	35 Å²	35	43.5 Å²	43.5	18%	0.179	26%	0.256	C	S	.	.	H	α-helix	trans	-59.3	-49.7	179.4	-64.5	178.3	0	0	0	110.4	C578 L581 I585 E635 Y636 S641 G642	C578-I639 HydrophobicContact CB-CD1 3.31Å; C578-I639 WeakPolarHBondContact O-CD1 3.2Å; C578-I639 WeakPolarHBondContact SG-CD1 3.04Å; L581-I639 HydrophobicContact CD2-CG2 4.17Å; I585-I639 HydrophobicContact CD1-CG2 3.96Å; E635-I639 PolarHBondContact O-N 3.25Å; Y636-I639 PolarHBondContact O-N 3.14Å; I639-S641 VanDerWaalsContact C-N 3.27Å; I639-S641 PolarHBondContact O-N 3.4Å; I639-G642 PolarHBondContact O-N 3.3Å
640	V	87.8	Confident	84.9	Confident	1 Å²	1	51 Å²	51	1%	0.006	28%	0.284	C	S	.	.	H	α-helix	trans	-65.8	-31.2	-176.5	176	0	0	0	0	112.1	V605 F608 Y636 K638 G642 I643 A648 F652	V605-V640 HydrophobicContact CG1-CG1 3.68Å; V605-V640 HydrophobicContact CG2-CG1 4.03Å; F608-V640 HydrophobicContact CD1-CG2 4.06Å; F608-V640 HydrophobicContact CE1-CG2 3.99Å; Y636-V640 WeakPolarHBondContact O-CB 3.35Å; Y636-V640 WeakPolarHBondContact O-CG2 3.42Å; Y636-V640 PolarHBondContact O-N 2.66Å; K638-V640 PolarHBondContact O-N 2.63Å; V640-G642 VanDerWaalsContact C-N 3.31Å; V640-I643 PolarHBondContact O-N 2.6Å; V640-A648 HydrophobicContact CG1-CB 3.48Å; V640-A648 VanDerWaalsContact CG1-CB 3.48Å; V640-F652 HydrophobicContact CB-CD2 4.03Å; V640-F652 HydrophobicContact CB-CE2 4.26Å; V640-F652 HydrophobicContact CB-CG 4.39Å; V640-F652 HydrophobicContact CG1-CD2 3.59Å; V640-F652 HydrophobicContact CG1-CE2 3.93Å; V640-F652 HydrophobicContact CG1-CG 4.32Å; V640-F652 HydrophobicContact CG2-CD2 4.02Å; V640-F652 HydrophobicContact CG2-CE1 4.49Å; V640-F652 HydrophobicContact CG2-CE2 3.74Å; V640-F652 HydrophobicContact CG2-CZ 4Å
641	S	83.6	Confident	84.6	Confident	68 Å²	68	51.2 Å²	51.2	48%	0.476	29%	0.285	S	S	.	.	H	α-helix	trans	-70	-26.7	174.1	74	0	0	0	0	113.6	R637 K638 I639 I643	R637-S641 WeakPolarHBondContact O-CB 3.36Å; R637-S641 PolarHBondContact O-N 3.09Å; R637-S641 PolarHBondContact O-OG 3.32Å; K638-S641 PolarHBondContact O-N 2.94Å; K638-S641 PolarHBondContact O-OG 3.08Å; I639-S641 VanDerWaalsContact C-N 3.27Å; I639-S641 PolarHBondContact O-N 3.4Å; S641-I643 VanDerWaalsContact C-N 3.3Å; S641-I643 PolarHBondContact O-N 3.17Å
642	G	80.6	Confident	84.4	Confident	68 Å²	68	50 Å²	50	70%	0.701	28%	0.277	S	S	*	.	H	α-helix	trans	-72.4	-18.6	176.2	0	0	0	0	0	114.4	K638 I639 V640 G644	K638-G642 PolarHBondContact O-N 3.07Å; I639-G642 PolarHBondContact O-N 3.3Å; V640-G642 VanDerWaalsContact C-N 3.31Å; G642-G644 VanDerWaalsContact C-N 3.3Å; G642-G644 PolarHBondContact O-N 3.32Å
643	I	81.8	Confident	84	Confident	18 Å²	18	50.6 Å²	50.6	9%	0.092	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-22.5	-177.2	-56.2	178.1	0	0	0	112.2	I585 L601 V605 V640 S641 V645	I585-I643 HydrophobicContact CD1-CD1 3.55Å; I585-I643 HydrophobicContact CD1-CG1 3.94Å; I585-I643 HydrophobicContact CG1-CD1 4.38Å; L601-I643 HydrophobicContact CB-CG2 3.66Å; L601-I643 HydrophobicContact CD1-CG2 3.74Å; L601-I643 HydrophobicContact CD2-CG2 4.27Å; L601-I643 HydrophobicContact CG-CG2 4.09Å; V605-I643 HydrophobicContact CG2-CD1 3.59Å; V640-I643 PolarHBondContact O-N 2.6Å; S641-I643 VanDerWaalsContact C-N 3.3Å; S641-I643 PolarHBondContact O-N 3.17Å; I643-V645 HydrophobicContact CG2-CG2 3.9Å; I643-V645 PolarHBondContact O-N 3Å
644	G	75.9	Confident	83.4	Confident	58 Å²	58	52 Å²	52	60%	0.598	29%	0.289	S	S	*	.			trans	81.2	5.7	179.5	0	0	0	0	0	115.6	G642 P646	G642-G644 VanDerWaalsContact C-N 3.3Å; G642-G644 PolarHBondContact O-N 3.32Å; G644-P646 WeakPolarHBondContact O-CD 3.25Å
645	V	78	Confident	83.1	Confident	12 Å²	12	50.6 Å²	50.6	7%	0.073	28%	0.279	C	S	.	.			trans	-84	122.5	178.3	175.9	0	0	0	0	111	M598 L601 I643 L647 A648 K649	M598-V645 HydrophobicContact SD-CG2 4.39Å; L601-V645 HydrophobicContact CB-CG2 4.31Å; I643-V645 HydrophobicContact CG2-CG2 3.9Å; I643-V645 PolarHBondContact O-N 3Å; V645-L647 VanDerWaalsContact C-N 3.32Å; V645-L647 HydrophobicContact CG1-CB 4.1Å; V645-L647 PolarHBondContact O-N 2.81Å; V645-A648 HydrophobicContact CB-CB 3.73Å; V645-A648 HydrophobicContact CG1-CB 3.96Å; V645-A648 WeakPolarHBondContact O-CB 3.36Å; V645-A648 PolarHBondContact O-N 3.19Å; V645-A648 VanDerWaalsContact O-N 3.17Å; V645-K649 PolarHBondContact O-N 3.43Å
646	P	75	Confident	82.9	Confident	95 Å²	95	49.6 Å²	49.6	62%	0.617	27%	0.274	S	S	*	.	H	α-helix	trans	-66.8	-28.5	-177.1	-22.3	32.5	0	0	0	114.7	G644 R650	G644-P646 WeakPolarHBondContact O-CD 3.25Å; P646-R650 PolarHBondContact O-NE 3.01Å
647	L	74.6	Confident	82.2	Confident	63 Å²	63	50 Å²	50	33%	0.33	28%	0.278	S	S	.	.	H	α-helix	trans	-67.3	-41.1	174.6	-179	63.3	0	0	0	110.8	V606 V645 K649 R650 L651	V606-L647 HydrophobicContact CG2-CD2 3.84Å; V645-L647 VanDerWaalsContact C-N 3.32Å; V645-L647 HydrophobicContact CG1-CB 4.1Å; V645-L647 PolarHBondContact O-N 2.81Å; L647-K649 PolarHBondContact O-N 3.26Å; L647-R650 PolarHBondContact O-N 3.09Å; L647-R650 VanDerWaalsContact O-N 3.14Å; L647-L651 HydrophobicContact CD1-CD1 4.45Å; L647-L651 HydrophobicContact CD1-CG 4.36Å; L647-L651 HydrophobicContact CG-CD1 4.06Å; L647-L651 HydrophobicContact CG-CG 4.39Å; L647-L651 WeakPolarHBondContact O-CG 3.39Å; L647-L651 PolarHBondContact O-N 2.98Å
648	A	77.5	Confident	81.7	Confident	0 Å²	0	46 Å²	46	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-58.6	-48.9	-178.1	0	0	0	0	0	112.2	V605 V640 V645 R650 L651 F652	V605-A648 HydrophobicContact CB-CB 4.18Å; V605-A648 HydrophobicContact CG1-CB 3.6Å; V605-A648 HydrophobicContact CG2-CB 4.04Å; V640-A648 HydrophobicContact CG1-CB 3.48Å; V640-A648 VanDerWaalsContact CG1-CB 3.48Å; V645-A648 HydrophobicContact CB-CB 3.73Å; V645-A648 HydrophobicContact CG1-CB 3.96Å; V645-A648 WeakPolarHBondContact O-CB 3.36Å; V645-A648 PolarHBondContact O-N 3.19Å; V645-A648 VanDerWaalsContact O-N 3.17Å; A648-R650 VanDerWaalsContact C-N 3.33Å; A648-R650 PolarHBondContact O-N 3.36Å; A648-L651 PolarHBondContact O-N 3.4Å; A648-F652 PolarHBondContact O-N 3.2Å
649	K	79.6	Confident	81.4	Confident	125 Å²	125	40.5 Å²	40.5	54%	0.543	24%	0.24	S	C	.	.	H	α-helix	trans	-58.9	-43.2	174.9	-173.8	174.9	-177.3	173.9	0	112.1	V645 L647 D653	V645-K649 PolarHBondContact O-N 3.43Å; L647-K649 PolarHBondContact O-N 3.26Å; K649-D653 WeakPolarHBondContact O-CB 3.03Å; K649-D653 PolarHBondContact O-N 3.36Å
650	R	79.7	Confident	81	Confident	161 Å²	161	41.9 Å²	41.9	61%	0.608	25%	0.248	S	C	*	.	H	α-helix	trans	-64.6	-44.5	-179.4	-76	-177.7	-79.3	173.2	-3.4	112.2	P646 L647 A648 T654	P646-R650 PolarHBondContact O-NE 3.01Å; L647-R650 PolarHBondContact O-N 3.09Å; L647-R650 VanDerWaalsContact O-N 3.14Å; A648-R650 VanDerWaalsContact C-N 3.33Å; A648-R650 PolarHBondContact O-N 3.36Å; R650-T654 WeakPolarHBondContact O-CG2 3.44Å; R650-T654 PolarHBondContact O-N 2.91Å; R650-T654 PolarHBondContact O-OG1 3.02Å; R650-T654 VanDerWaalsContact O-OG1 3.13Å
651	L	81.7	Confident	80.5	Confident	38 Å²	38	42 Å²	42	20%	0.199	25%	0.248	C	C	.	.	H	α-helix	trans	-62.2	-51.2	179.8	-70.9	174.6	0	0	0	112	V606 H609 L647 A648 D653 T654 L655	V606-L651 HydrophobicContact CG2-CD1 4.06Å; H609-L651 HydrophobicContact CB-CD1 4.48Å; L647-L651 HydrophobicContact CD1-CD1 4.45Å; L647-L651 HydrophobicContact CD1-CG 4.36Å; L647-L651 HydrophobicContact CG-CD1 4.06Å; L647-L651 HydrophobicContact CG-CG 4.39Å; L647-L651 WeakPolarHBondContact O-CG 3.39Å; L647-L651 PolarHBondContact O-N 2.98Å; A648-L651 PolarHBondContact O-N 3.4Å; L651-D653 PolarHBondContact O-N 3.36Å; L651-T654 WeakPolarHBondContact CA-OG1 3.39Å; L651-T654 PolarHBondContact O-N 3.25Å; L651-T654 PolarHBondContact O-OG1 3.41Å; L651-L655 PolarHBondContact O-N 3.37Å
652	F	87.1	Confident	80.2	Confident	1 Å²	1	38.9 Å²	38.9	0%	0.004	23%	0.226	C	C	.	.	H	α-helix	trans	-73.6	-28.2	-179.5	-81	-93.4	0	0	0	113.3	V605 F608 H609 R637 V640 A648 T654 L655 H656	V605-F652 HydrophobicContact CG1-CD2 4.39Å; V605-F652 HydrophobicContact CG1-CE2 3.99Å; F608-F652 HydrophobicContact CD1-CE1 4.43Å; F608-F652 HydrophobicContact CD1-CE2 4.1Å; F608-F652 AromaticContact CD1-CZ 3.49Å; F608-F652 HydrophobicContact CD1-CZ 3.49Å; F608-F652 VanDerWaalsContact CD1-CZ 3.49Å; F608-F652 AromaticContact CE1-CE1 4Å; F608-F652 HydrophobicContact CE1-CE1 4Å; F608-F652 HydrophobicContact CE1-CE2 4.41Å; F608-F652 AromaticContact CE1-CZ 3.49Å; F608-F652 HydrophobicContact CE1-CZ 3.49Å; F608-F652 VanDerWaalsContact CE1-CZ 3.49Å; H609-F652 HydrophobicContact CB-CE2 3.86Å; H609-F652 HydrophobicContact CB-CZ 4.16Å; R637-F652 HydrophobicContact CB-CB 4.04Å; R637-F652 HydrophobicContact CB-CD1 4.5Å; R637-F652 HydrophobicContact CG-CB 4.06Å; V640-F652 HydrophobicContact CB-CD2 4.03Å; V640-F652 HydrophobicContact CB-CE2 4.26Å; V640-F652 HydrophobicContact CB-CG 4.39Å; V640-F652 HydrophobicContact CG1-CD2 3.59Å; V640-F652 HydrophobicContact CG1-CE2 3.93Å; V640-F652 HydrophobicContact CG1-CG 4.32Å; V640-F652 HydrophobicContact CG2-CD2 4.02Å; V640-F652 HydrophobicContact CG2-CE1 4.49Å; V640-F652 HydrophobicContact CG2-CE2 3.74Å; V640-F652 HydrophobicContact CG2-CZ 4Å; A648-F652 PolarHBondContact O-N 3.2Å; F652-T654 VanDerWaalsContact C-N 3.34Å; F652-L655 HydrophobicContact CD1-CD2 4.34Å; F652-L655 HydrophobicContact CE1-CD2 4.27Å; F652-L655 PolarHBondContact O-N 3.47Å; F652-H656 VanDerWaalsContact O-CB 3.28Å; F652-H656 WeakPolarHBondContact O-CB 3.34Å; F652-H656 PolarHBondContact O-N 2.88Å
653	D	83.8	Confident	80.1	Confident	17 Å²	17	38.7 Å²	38.7	9%	0.091	21%	0.208	C	C	.	.	H	α-helix	trans	-62.4	-40.2	167.8	-91.3	17.9	0	0	0	111.9	R637 K649 L651 A657 R681	R637-D653 IonicContact CZ-OD1 2.68Å; R637-D653 IonicContact NE-OD1 2.64Å; R637-D653 PolarHBondContact NE-OD1 3.4Å; R637-D653 IonicContact NH2-OD1 3.64Å; R637-D653 PolarHBondContact NH2-OD1 2.91Å; R637-D653 IonicContact NH2-OD2 3Å; K649-D653 WeakPolarHBondContact O-CB 3.03Å; K649-D653 PolarHBondContact O-N 3.36Å; L651-D653 PolarHBondContact O-N 3.36Å; D653-A657 WeakPolarHBondContact O-CB 3.45Å; D653-A657 PolarHBondContact O-N 3.49Å; D653-R681 VanDerWaalsContact CB-NH1 3.34Å; D653-R681 IonicContact OD2-CZ 2.77Å; D653-R681 IonicContact OD2-NH1 3.7Å; D653-R681 PolarHBondContact OD2-NH1 2.91Å; D653-R681 IonicContact OD2-NH2 3.65Å
654	T	78.7	Confident	79.7	Confident	30 Å²	30	39.6 Å²	39.6	18%	0.184	22%	0.215	C	C	.	.	H	α-helix	trans	-69.8	-40.6	175.6	48	0	0	0	0	111.9	R650 L651 F652 A657 L658 R681	R650-T654 WeakPolarHBondContact O-CG2 3.44Å; R650-T654 PolarHBondContact O-N 2.91Å; R650-T654 PolarHBondContact O-OG1 3.02Å; R650-T654 VanDerWaalsContact O-OG1 3.13Å; L651-T654 WeakPolarHBondContact CA-OG1 3.39Å; L651-T654 PolarHBondContact O-N 3.25Å; L651-T654 PolarHBondContact O-OG1 3.41Å; F652-T654 VanDerWaalsContact C-N 3.34Å; T654-A657 PolarHBondContact O-N 3.01Å; T654-L658 WeakPolarHBondContact O-CG 3.29Å; T654-L658 PolarHBondContact O-N 2.87Å; T654-R681 HydrophobicContact CG2-CB 4.2Å
655	L	84.6	Confident	79.4	Confident	1 Å²	1	39.2 Å²	39.2	1%	0.005	21%	0.206	C	C	.	.	H	α-helix	trans	-64	-45.4	177.8	-174.9	59.6	0	0	0	111.6	I612 V613 I616 V633 L651 F652 A657 L658 S659 F692	I612-L655 HydrophobicContact CG2-CD2 3.79Å; V613-L655 HydrophobicContact CG2-CD1 3.9Å; V613-L655 HydrophobicContact CG2-CD2 4.45Å; I616-L655 HydrophobicContact CD1-CD1 3.93Å; I616-L655 HydrophobicContact CD1-CD2 4.31Å; I616-L655 HydrophobicContact CD1-CG 4.43Å; V633-L655 HydrophobicContact CG1-CB 4.48Å; V633-L655 HydrophobicContact CG1-CD2 4.33Å; V633-L655 HydrophobicContact CG1-CG 4.1Å; V633-L655 HydrophobicContact CG2-CD2 4.42Å; V633-L655 HydrophobicContact CG2-CG 4.43Å; L651-L655 PolarHBondContact O-N 3.37Å; F652-L655 HydrophobicContact CD1-CD2 4.34Å; F652-L655 HydrophobicContact CE1-CD2 4.27Å; F652-L655 PolarHBondContact O-N 3.47Å; L655-A657 VanDerWaalsContact C-N 3.26Å; L655-A657 PolarHBondContact O-N 3.39Å; L655-L658 WeakPolarHBondContact O-CB 3.45Å; L655-L658 PolarHBondContact O-N 3.35Å; L655-L658 VanDerWaalsContact O-N 3.08Å; L655-S659 PolarHBondContact O-N 3.49Å; L655-S659 PolarHBondContact O-OG 2.85Å; L655-F692 HydrophobicContact CD1-CZ 3.91Å
656	H	87.4	Confident	78.9	Confident	38 Å²	38	41.5 Å²	41.5	18%	0.176	22%	0.221	C	C	.	.	H	α-helix	trans	-59.9	-37.8	174.8	-172.5	-60	0	0	0	112.1	V633 F652 N660	V633-H656 HydrophobicContact CG1-CB 3.9Å; F652-H656 VanDerWaalsContact O-CB 3.28Å; F652-H656 WeakPolarHBondContact O-CB 3.34Å; F652-H656 PolarHBondContact O-N 2.88Å; H656-N660 PolarHBondContact O-N 3.4Å; H656-N660 VanDerWaalsContact O-N 3.15Å
657	A	79.2	Confident	78.6	Confident	14 Å²	14	44 Å²	44	12%	0.116	23%	0.23	C	C	.	.	H	α-helix	trans	-69.6	-33.6	175.8	0	0	0	0	0	112.5	D653 T654 L655 L678	D653-A657 WeakPolarHBondContact O-CB 3.45Å; D653-A657 PolarHBondContact O-N 3.49Å; T654-A657 PolarHBondContact O-N 3.01Å; L655-A657 VanDerWaalsContact C-N 3.26Å; L655-A657 PolarHBondContact O-N 3.39Å; A657-L678 HydrophobicContact CB-CD2 3.67Å
658	L	78.9	Confident	78.4	Confident	7 Å²	7	46.6 Å²	46.6	4%	0.037	24%	0.24	C	C	.	.	H	α-helix	trans	-70.2	-44.2	173.6	-73.3	171.3	0	0	0	111.9	T654 L655 N660 L661 L682 L688 F692	T654-L658 WeakPolarHBondContact O-CG 3.29Å; T654-L658 PolarHBondContact O-N 2.87Å; L655-L658 WeakPolarHBondContact O-CB 3.45Å; L655-L658 PolarHBondContact O-N 3.35Å; L655-L658 VanDerWaalsContact O-N 3.08Å; L658-N660 VanDerWaalsContact C-N 3.27Å; L658-N660 PolarHBondContact O-N 3.33Å; L658-L661 HydrophobicContact CD2-CD1 4.21Å; L658-L661 VanDerWaalsContact O-CB 3.27Å; L658-L661 WeakPolarHBondContact O-CB 3.41Å; L658-L661 PolarHBondContact O-N 2.98Å; L658-L682 HydrophobicContact CD1-CD2 4.35Å; L658-L682 HydrophobicContact CD2-CD2 3.85Å; L658-L682 HydrophobicContact CG-CD2 4.3Å; L658-L688 HydrophobicContact CD1-CB 4.48Å; L658-L688 HydrophobicContact CD1-CD1 4.38Å; L658-F692 HydrophobicContact CB-CD1 3.99Å; L658-F692 HydrophobicContact CB-CD2 4.37Å; L658-F692 HydrophobicContact CB-CE1 3.96Å; L658-F692 HydrophobicContact CB-CE2 4.35Å; L658-F692 HydrophobicContact CB-CG 4.2Å; L658-F692 HydrophobicContact CB-CZ 4.15Å; L658-F692 HydrophobicContact CD1-CD2 4.42Å; L658-F692 HydrophobicContact CD1-CE2 4.2Å
659	S	83.7	Confident	78	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-62.5	-33.9	177	-58.9	0	0	0	0	112.4	L655 L661 L662	L655-S659 PolarHBondContact O-N 3.49Å; L655-S659 PolarHBondContact O-OG 2.85Å; S659-L661 PolarHBondContact O-N 3.31Å; S659-L662 WeakPolarHBondContact O-CB 3.41Å; S659-L662 PolarHBondContact O-N 3.46Å; S659-L662 VanDerWaalsContact O-N 3.09Å
660	N	82.5	Confident	77.3	Confident	65 Å²	65	44.9 Å²	44.9	35%	0.348	24%	0.236	S	C	.	.	G	3₁₀ helix	trans	-58.8	-27.8	172.8	-85.5	-14.9	0	0	0	113.3	L630 H656 L658 L662 I663	L630-N660 WeakPolarHBondContact CD1-OD1 3.36Å; L630-N660 WeakPolarHBondContact CD2-OD1 3.46Å; H656-N660 PolarHBondContact O-N 3.4Å; H656-N660 VanDerWaalsContact O-N 3.15Å; L658-N660 VanDerWaalsContact C-N 3.27Å; L658-N660 PolarHBondContact O-N 3.33Å; N660-L662 PolarHBondContact O-N 2.91Å; N660-I663 PolarHBondContact O-N 3.47Å
661	L	76.8	Confident	76.8	Confident	3 Å²	3	40.6 Å²	40.6	2%	0.016	23%	0.231	C	C	.	.	G	3₁₀ helix	trans	-67	-23.9	177.9	-65.1	174.5	0	0	0	112.7	L658 S659 I663 V664 A672 L678	L658-L661 HydrophobicContact CD2-CD1 4.21Å; L658-L661 VanDerWaalsContact O-CB 3.27Å; L658-L661 WeakPolarHBondContact O-CB 3.41Å; L658-L661 PolarHBondContact O-N 2.98Å; S659-L661 PolarHBondContact O-N 3.31Å; L661-I663 PolarHBondContact O-N 2.71Å; L661-V664 PolarHBondContact O-N 3.33Å; L661-A672 HydrophobicContact CD2-CB 3.97Å; L661-L678 HydrophobicContact CD1-CD1 4.26Å; L661-L678 HydrophobicContact CD2-CD1 3.71Å; L661-L678 HydrophobicContact CG-CD1 4.2Å
662	L	76.6	Confident	76.1	Confident	3 Å²	3	39.8 Å²	39.8	2%	0.016	23%	0.229	C	C	.	.	G	3₁₀ helix	trans	-71.9	-18.2	178.8	-62	168.7	0	0	0	113	Y621 A626 L629 S659 N660 F692 L695 Q696	Y621-L662 HydrophobicContact CD2-CD1 4.24Å; Y621-L662 HydrophobicContact CG-CD1 4.34Å; A626-L662 HydrophobicContact CB-CB 3.74Å; L629-L662 HydrophobicContact CD2-CD1 3.59Å; S659-L662 WeakPolarHBondContact O-CB 3.41Å; S659-L662 PolarHBondContact O-N 3.46Å; S659-L662 VanDerWaalsContact O-N 3.09Å; N660-L662 PolarHBondContact O-N 2.91Å; L662-F692 HydrophobicContact CD1-CD1 4.07Å; L662-F692 HydrophobicContact CD1-CE1 4.35Å; L662-F692 HydrophobicContact CD2-CD1 4.43Å; L662-F692 WeakPolarHBondContact CD2-O 3.36Å; L662-F692 HydrophobicContact CG-CD1 4.2Å; L662-L695 HydrophobicContact CD2-CB 3.9Å; L662-Q696 HydrophobicContact CD2-CG 4.38Å; L662-Q696 PolarHBondContact O-NE2 2.93Å
663	I	78.2	Confident	75	Confident	63 Å²	63	40 Å²	40	32%	0.323	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91	-24.7	-179.4	-58.1	168.8	0	0	0	111.1	A626 V627 L630 N660 L661 A665	A626-I663 HydrophobicContact CB-CG1 3.68Å; V627-I663 HydrophobicContact CG2-CD1 4Å; V627-I663 HydrophobicContact CG2-CG1 4.28Å; L630-I663 HydrophobicContact CB-CD1 4.35Å; L630-I663 HydrophobicContact CD2-CD1 3.82Å; N660-I663 PolarHBondContact O-N 3.47Å; L661-I663 PolarHBondContact O-N 2.71Å; I663-A665 PolarHBondContact O-N 3.22Å
664	V	74	Confident	74	Confident	37 Å²	37	43.4 Å²	43.4	22%	0.224	25%	0.253	C	S	.	.	S	Bend	trans	-70.6	130.5	-173.7	-177.3	0	0	0	0	110.2	L661 H668 A672 Q696	L661-V664 PolarHBondContact O-N 3.33Å; V664-H668 HydrophobicContact CG1-CB 3.67Å; V664-A672 HydrophobicContact CG1-CB 4.16Å; V664-A672 HydrophobicContact CG2-CB 4.19Å; V664-Q696 PolarHBondContact O-NE2 3.17Å
665	A	70.2	Confident	73.3	Confident	50 Å²	50	44 Å²	44	41%	0.413	26%	0.258	S	S	.	.			trans	-59.7	147.9	174.1	0	0	0	0	0	111.1	I663 D667 H668 L669	I663-A665 PolarHBondContact O-N 3.22Å; A665-D667 PolarHBondContact O-N 3.49Å; A665-D667 VanDerWaalsContact O-N 3.07Å; A665-H668 PolarHBondContact O-N 2.92Å; A665-L669 PolarHBondContact O-N 3.49Å
666	P	66.7	Low	71.8	Confident	61 Å²	61	50 Å²	50	40%	0.396	29%	0.29	S	S	.	.	H	α-helix	trans	-51.2	-38.9	-174.9	-26.7	33.2	0	0	0	113.8	H668 L669	P666-H668 PolarHBondContact O-N 3.4Å; P666-L669 WeakPolarHBondContact O-CB 3.37Å; P666-L669 PolarHBondContact O-N 2.82Å
667	D	68.2	Low	70.3	Confident	148 Å²	148	52.5 Å²	52.5	79%	0.791	31%	0.308	S	S	*	.	H	α-helix	trans	-63.9	-25.5	-177.9	-56	-33.4	0	0	0	113.7	A665	A665-D667 PolarHBondContact O-N 3.49Å; A665-D667 VanDerWaalsContact O-N 3.07Å
668	H	72.2	Confident	69.2	Low	117 Å²	117	52.3 Å²	52.3	54%	0.542	31%	0.305	S	S	.	.	H	α-helix	trans	-106	0.5	-177.9	-62.4	-55.7	0	0	0	113.2	V664 A665 P666 L670 S671 A672	V664-H668 HydrophobicContact CG1-CB 3.67Å; A665-H668 PolarHBondContact O-N 2.92Å; P666-H668 PolarHBondContact O-N 3.4Å; H668-L670 PolarHBondContact O-N 3.22Å; H668-S671 PolarHBondContact O-N 3.05Å; H668-S671 PolarHBondContact O-OG 2.83Å; H668-A672 WeakPolarHBondContact O-CB 3.47Å; H668-A672 PolarHBondContact O-N 3.15Å
669	L	67.9	Low	68	Low	2 Å²	2	55 Å²	55	1%	0.01	32%	0.321	C	S	.	.	H	α-helix	trans	-69.5	-36.8	-171.5	-164.4	130.6	0	0	0	112.5	A665 P666 A672 C673 V693 V703 F707	A665-L669 PolarHBondContact O-N 3.49Å; P666-L669 WeakPolarHBondContact O-CB 3.37Å; P666-L669 PolarHBondContact O-N 2.82Å; L669-A672 PolarHBondContact O-N 3.18Å; L669-C673 WeakPolarHBondContact O-CB 3.48Å; L669-C673 PolarHBondContact O-N 2.94Å; L669-C673 PolarHBondContact O-SG 3.41Å; L669-V693 HydrophobicContact CD1-CG1 3.84Å; L669-V693 HydrophobicContact CD1-CG2 4.09Å; L669-V693 HydrophobicContact CD2-CB 4.35Å; L669-V693 HydrophobicContact CD2-CG1 3.7Å; L669-V693 HydrophobicContact CD2-CG2 3.64Å; L669-V693 HydrophobicContact CG-CG1 4.42Å; L669-V693 HydrophobicContact CG-CG2 4.31Å; L669-V703 HydrophobicContact CD2-CG1 3.82Å; L669-F707 HydrophobicContact CD2-CE2 4.23Å
670	L	66	Low	66.4	Low	86 Å²	86	65.2 Å²	65.2	45%	0.45	36%	0.36	S	S	.	.	H	α-helix	trans	-63.6	-44.9	175	-162	80.4	0	0	0	111	H668 C673 T674 F707	H668-L670 PolarHBondContact O-N 3.22Å; L670-C673 PolarHBondContact O-N 3.03Å; L670-T674 WeakPolarHBondContact O-CG2 3.23Å; L670-T674 PolarHBondContact O-N 3.22Å; L670-T674 PolarHBondContact O-OG1 3.24Å; L670-T674 VanDerWaalsContact O-OG1 3.1Å; L670-F707 HydrophobicContact CD1-CE2 4.46Å
671	S	68.3	Low	64.9	Low	72 Å²	72	68.2 Å²	68.2	50%	0.503	37%	0.366	S	S	.	.	H	α-helix	trans	-65.4	-43	179.4	79.2	0	0	0	0	111.2	H668 C673 T674 S675	H668-S671 PolarHBondContact O-N 3.05Å; H668-S671 PolarHBondContact O-OG 2.83Å; S671-C673 VanDerWaalsContact C-N 3.35Å; S671-C673 PolarHBondContact O-N 3.44Å; S671-T674 WeakPolarHBondContact CA-OG1 3.36Å; S671-T674 PolarHBondContact O-N 3.01Å; S671-T674 PolarHBondContact O-OG1 3.44Å; S671-S675 PolarHBondContact O-N 3.29Å; S671-S675 VanDerWaalsContact O-N 3.09Å
672	A	67.4	Low	63.6	Low	21 Å²	21	68.6 Å²	68.6	17%	0.174	37%	0.368	C	S	.	.	H	α-helix	trans	-58.6	-45.4	175.2	0	0	0	0	0	111.5	L661 V664 H668 L669 T674 S675 L678	L661-A672 HydrophobicContact CD2-CB 3.97Å; V664-A672 HydrophobicContact CG1-CB 4.16Å; V664-A672 HydrophobicContact CG2-CB 4.19Å; H668-A672 WeakPolarHBondContact O-CB 3.47Å; H668-A672 PolarHBondContact O-N 3.15Å; L669-A672 PolarHBondContact O-N 3.18Å; A672-T674 VanDerWaalsContact C-N 3.34Å; A672-T674 PolarHBondContact O-N 2.83Å; A672-S675 VanDerWaalsContact O-CB 3.28Å; A672-S675 WeakPolarHBondContact O-CB 3.36Å; A672-S675 PolarHBondContact O-N 3.24Å; A672-S675 PolarHBondContact O-OG 2.87Å; A672-L678 WeakPolarHBondContact O-CD1 3.48Å
673	C	62.9	Low	61.9	Low	4 Å²	4	74 Å²	74	3%	0.027	40%	0.401	C	S	.	.	H	α-helix	trans	-70.8	-25.3	-179.1	-70	0	0	0	0	115.1	L669 L670 S671 K689 F707	L669-C673 WeakPolarHBondContact O-CB 3.48Å; L669-C673 PolarHBondContact O-N 2.94Å; L669-C673 PolarHBondContact O-SG 3.41Å; L670-C673 PolarHBondContact O-N 3.03Å; S671-C673 VanDerWaalsContact C-N 3.35Å; S671-C673 PolarHBondContact O-N 3.44Å; C673-K689 PolarHBondContact O-NZ 2.88Å; C673-K689 VanDerWaalsContact O-NZ 3.17Å; C673-F707 HydrophobicContact CB-CE1 4.21Å; C673-F707 HydrophobicContact CB-CE2 4.43Å; C673-F707 HydrophobicContact CB-CZ 3.47Å; C673-F707 VanDerWaalsContact CB-CZ 3.47Å; C673-F707 VanDerWaalsContact SG-CZ 3.6Å
674	T	64.1	Low	60.2	Low	90 Å²	90	78.6 Å²	78.6	55%	0.552	43%	0.425	S	S	*	.	H	α-helix	trans	-87.2	-6.5	173.7	59.3	0	0	0	0	113.8	L670 S671 A672	L670-T674 WeakPolarHBondContact O-CG2 3.23Å; L670-T674 PolarHBondContact O-N 3.22Å; L670-T674 PolarHBondContact O-OG1 3.24Å; L670-T674 VanDerWaalsContact O-OG1 3.1Å; S671-T674 WeakPolarHBondContact CA-OG1 3.36Å; S671-T674 PolarHBondContact O-N 3.01Å; S671-T674 PolarHBondContact O-OG1 3.44Å; A672-T674 VanDerWaalsContact C-N 3.34Å; A672-T674 PolarHBondContact O-N 2.83Å
675	S	63.6	Low	59.1	Low	42 Å²	42	79.4 Å²	79.4	29%	0.294	43%	0.43	S	S	.	.	S	Bend	trans	-59.9	140.7	178.1	71.2	0	0	0	0	111.6	S671 A672 V677 L678 V679	S671-S675 PolarHBondContact O-N 3.29Å; S671-S675 VanDerWaalsContact O-N 3.09Å; A672-S675 VanDerWaalsContact O-CB 3.28Å; A672-S675 WeakPolarHBondContact O-CB 3.36Å; A672-S675 PolarHBondContact O-N 3.24Å; A672-S675 PolarHBondContact O-OG 2.87Å; S675-V677 PolarHBondContact O-N 3.36Å; S675-L678 PolarHBondContact O-N 3.23Å; S675-V679 WeakPolarHBondContact O-CG2 3.45Å; S675-V679 PolarHBondContact O-N 3.26Å; S675-V679 VanDerWaalsContact O-N 3.11Å
676	N	53.4	Low	58	Low	126 Å²	126	80.1 Å²	80.1	67%	0.674	44%	0.435	S	S	*	.	H	α-helix	trans	-54.7	-22.1	-179.2	-80.5	-35.8	0	0	0	113.7	R680	N676-R680 WeakPolarHBondContact O-CB 3.32Å; N676-R680 PolarHBondContact O-N 3.28Å; N676-R680 VanDerWaalsContact O-N 3.15Å
677	V	54.9	Low	57.3	Low	92 Å²	92	81.1 Å²	81.1	56%	0.558	44%	0.442	S	S	*	.	H	α-helix	trans	-70.5	-42.8	179.6	-176.2	0	0	0	0	111.5	S675 R681	S675-V677 PolarHBondContact O-N 3.36Å; V677-R681 WeakPolarHBondContact O-CB 3.38Å; V677-R681 WeakPolarHBondContact O-CD 3.35Å; V677-R681 VanDerWaalsContact O-CG 3.31Å; V677-R681 WeakPolarHBondContact O-CG 3.5Å
678	L	57.4	Low	56.7	Low	10 Å²	10	76.5 Å²	76.5	5%	0.052	42%	0.417	C	S	.	.	H	α-helix	trans	-83.6	-32.2	178.1	-75.3	161.3	0	0	0	111.6	A657 L661 A672 S675 L682	A657-L678 HydrophobicContact CB-CD2 3.67Å; L661-L678 HydrophobicContact CD1-CD1 4.26Å; L661-L678 HydrophobicContact CD2-CD1 3.71Å; L661-L678 HydrophobicContact CG-CD1 4.2Å; A672-L678 WeakPolarHBondContact O-CD1 3.48Å; S675-L678 PolarHBondContact O-N 3.23Å; L678-L682 HydrophobicContact CB-CD1 4.38Å; L678-L682 HydrophobicContact CD2-CD1 3.47Å; L678-L682 VanDerWaalsContact CD2-CD1 3.47Å; L678-L682 VanDerWaalsContact O-CB 3.32Å; L678-L682 WeakPolarHBondContact O-CB 3.36Å; L678-L682 PolarHBondContact O-N 2.93Å
679	V	53.7	Low	55.8	Low	62 Å²	62	72.3 Å²	72.3	38%	0.376	40%	0.397	S	S	.	.	H	α-helix	trans	-70	-41.2	179.3	177.6	0	0	0	0	112.4	S675 R681	S675-V679 WeakPolarHBondContact O-CG2 3.45Å; S675-V679 PolarHBondContact O-N 3.26Å; S675-V679 VanDerWaalsContact O-N 3.11Å; V679-R681 VanDerWaalsContact C-N 3.34Å; V679-R681 PolarHBondContact O-N 3.38Å
680	R	50.2	Low	55.2	Low	216 Å²	216	73.1 Å²	73.1	82%	0.815	41%	0.406	S	S	*	.	H	α-helix	trans	-73.6	-21.7	176.5	-82.1	-177.5	170.7	173	-1.9	114.2	N676	N676-R680 WeakPolarHBondContact O-CB 3.32Å; N676-R680 PolarHBondContact O-N 3.28Å; N676-R680 VanDerWaalsContact O-N 3.15Å
681	R	50.1	Low	54.8	Low	128 Å²	128	70.8 Å²	70.8	48%	0.483	40%	0.399	S	S	.	.	H	α-helix	trans	-100.5	-24.1	-175.8	-67.4	-177.9	178.6	-146.1	-4.9	113.9	D653 T654 V677 V679	D653-R681 VanDerWaalsContact CB-NH1 3.34Å; D653-R681 IonicContact OD2-CZ 2.77Å; D653-R681 IonicContact OD2-NH1 3.7Å; D653-R681 PolarHBondContact OD2-NH1 2.91Å; D653-R681 IonicContact OD2-NH2 3.65Å; T654-R681 HydrophobicContact CG2-CB 4.2Å; V677-R681 WeakPolarHBondContact O-CB 3.38Å; V677-R681 WeakPolarHBondContact O-CD 3.35Å; V677-R681 VanDerWaalsContact O-CG 3.31Å; V677-R681 WeakPolarHBondContact O-CG 3.5Å; V679-R681 VanDerWaalsContact C-N 3.34Å; V679-R681 PolarHBondContact O-N 3.38Å
682	L	50.5	Low	54.6	Low	11 Å²	11	67.3 Å²	67.3	6%	0.058	38%	0.375	C	S	.	.			trans	-114.5	22.2	-176.9	-80.1	105.7	0	0	0	115.1	L658 L678 I684 V685 K689	L658-L682 HydrophobicContact CD1-CD2 4.35Å; L658-L682 HydrophobicContact CD2-CD2 3.85Å; L658-L682 HydrophobicContact CG-CD2 4.3Å; L678-L682 HydrophobicContact CB-CD1 4.38Å; L678-L682 HydrophobicContact CD2-CD1 3.47Å; L678-L682 VanDerWaalsContact CD2-CD1 3.47Å; L678-L682 VanDerWaalsContact O-CB 3.32Å; L678-L682 WeakPolarHBondContact O-CB 3.36Å; L678-L682 PolarHBondContact O-N 2.93Å; L682-I684 PolarHBondContact O-N 2.67Å; L682-V685 PolarHBondContact O-N 2.63Å; L682-K689 HydrophobicContact CD2-CG 4.44Å
683	T	40.6	Very low	54.3	Low	116 Å²	116	66.5 Å²	66.5	71%	0.712	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.9	-13.3	178.1	6	0	0	0	0	114.3
684	I	42	Very low	54.5	Low	160 Å²	160	70.2 Å²	70.2	82%	0.821	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.5	-9.8	-176.6	-54.8	172.2	0	0	0	112.4	L682	L682-I684 PolarHBondContact O-N 2.67Å
685	V	50.8	Low	54.5	Low	54 Å²	54	66.8 Å²	66.8	33%	0.327	37%	0.369	S	S	.	.			trans	-139.3	57.8	-172.8	-145.7	0	0	0	0	114.6	L682 P687 L688	L682-V685 PolarHBondContact O-N 2.63Å; V685-P687 HydrophobicContact CG1-CG 4.31Å; V685-L688 HydrophobicContact CB-CD1 3.78Å; V685-L688 HydrophobicContact CB-CG 4.27Å; V685-L688 HydrophobicContact CG1-CB 4.08Å; V685-L688 HydrophobicContact CG1-CD1 3.29Å; V685-L688 HydrophobicContact CG1-CG 3.47Å; V685-L688 VanDerWaalsContact CG1-CG 3.47Å; V685-L688 HydrophobicContact CG2-CD1 4.34Å; V685-L688 PolarHBondContact O-N 3.01Å
686	A	46.9	Very low	54.6	Low	64 Å²	64	66.2 Å²	66.2	53%	0.529	36%	0.361	S	S	.	.	H	α-helix	trans	-53.7	-34.1	172.1	0	0	0	0	0	116.3	L688 K689	A686-L688 VanDerWaalsContact C-N 3.29Å; A686-L688 PolarHBondContact O-N 2.91Å; A686-K689 PolarHBondContact O-N 3.12Å
687	P	52	Low	54.9	Low	83 Å²	83	64.5 Å²	64.5	54%	0.539	35%	0.349	S	S	.	.	H	α-helix	trans	-68.5	-23.6	179.5	23.8	-31.9	0	0	0	114.1	V685 K689 A691	V685-P687 HydrophobicContact CG1-CG 4.31Å; P687-K689 VanDerWaalsContact C-N 3.33Å; P687-K689 PolarHBondContact O-N 3.18Å; P687-A691 PolarHBondContact O-N 3.28Å
688	L	56.1	Low	55.1	Low	50 Å²	50	66.7 Å²	66.7	26%	0.262	36%	0.358	S	S	.	.	H	α-helix	trans	-68.7	-30	178.5	-77.9	174.4	0	0	0	112.7	Y617 L658 V685 A686 A691 F692	Y617-L688 HydrophobicContact CE2-CD2 4.46Å; Y617-L688 WeakPolarHBondContact OH-CD2 3.18Å; L658-L688 HydrophobicContact CD1-CB 4.48Å; L658-L688 HydrophobicContact CD1-CD1 4.38Å; V685-L688 HydrophobicContact CB-CD1 3.78Å; V685-L688 HydrophobicContact CB-CG 4.27Å; V685-L688 HydrophobicContact CG1-CB 4.08Å; V685-L688 HydrophobicContact CG1-CD1 3.29Å; V685-L688 HydrophobicContact CG1-CG 3.47Å; V685-L688 VanDerWaalsContact CG1-CG 3.47Å; V685-L688 HydrophobicContact CG2-CD1 4.34Å; V685-L688 PolarHBondContact O-N 3.01Å; A686-L688 VanDerWaalsContact C-N 3.29Å; A686-L688 PolarHBondContact O-N 2.91Å; L688-A691 PolarHBondContact O-N 2.63Å; L688-F692 PolarHBondContact O-N 3.42Å
689	K	54.1	Low	55.1	Low	29 Å²	29	69.1 Å²	69.1	13%	0.126	37%	0.368	C	S	.	.	H	α-helix	trans	-62.7	-45.5	-179	-67.2	-171.3	179.3	-172.3	0	111.8	C673 L682 A686 P687 V693 F707	C673-K689 PolarHBondContact O-NZ 2.88Å; C673-K689 VanDerWaalsContact O-NZ 3.17Å; L682-K689 HydrophobicContact CD2-CG 4.44Å; A686-K689 PolarHBondContact O-N 3.12Å; P687-K689 VanDerWaalsContact C-N 3.33Å; P687-K689 PolarHBondContact O-N 3.18Å; K689-V693 WeakPolarHBondContact O-CG2 3.32Å; K689-F707 HydrophobicContact CB-CE1 4.24Å; K689-F707 HydrophobicContact CD-CE1 4.32Å
690	G	54.8	Low	55.3	Low	19 Å²	19	70.6 Å²	70.6	20%	0.196	37%	0.374	C	S	.	.	H	α-helix	trans	-70.7	-32.5	177.6	0	0	0	0	0	112.9	V694	G690-V694 WeakPolarHBondContact O-CG2 3.45Å; G690-V694 PolarHBondContact O-N 3.12Å
691	A	57.9	Low	55.6	Low	37 Å²	37	70.1 Å²	70.1	31%	0.306	37%	0.372	S	S	.	.	H	α-helix	trans	-71.1	-38.8	-176.8	0	0	0	0	0	113.3	Y617 P687 L688	Y617-A691 HydrophobicContact CE1-CB 3.82Å; Y617-A691 WeakPolarHBondContact OH-CB 3.32Å; P687-A691 PolarHBondContact O-N 3.28Å; L688-A691 PolarHBondContact O-N 2.63Å
692	F	63.7	Low	55.9	Low	0 Å²	0	67.1 Å²	67.1	0%	0	37%	0.37	C	S	.	.	H	α-helix	trans	-68.1	-37.4	176.2	-98.9	-108.4	0	0	0	112.4	I616 Y617 L655 L658 L662 L688 V694 L695	I616-F692 HydrophobicContact CG2-CE1 3.88Å; I616-F692 HydrophobicContact CG2-CZ 3.83Å; Y617-F692 HydrophobicContact CE1-CD2 4.28Å; Y617-F692 HydrophobicContact CE1-CE2 4.41Å; Y617-F692 HydrophobicContact CE2-CE2 4.29Å; Y617-F692 AromaticContact CZ-CD2 3.98Å; Y617-F692 AromaticContact CZ-CE2 3.85Å; Y617-F692 WeakPolarHBondContact OH-CD2 3.39Å; L655-F692 HydrophobicContact CD1-CZ 3.91Å; L658-F692 HydrophobicContact CB-CD1 3.99Å; L658-F692 HydrophobicContact CB-CD2 4.37Å; L658-F692 HydrophobicContact CB-CE1 3.96Å; L658-F692 HydrophobicContact CB-CE2 4.35Å; L658-F692 HydrophobicContact CB-CG 4.2Å; L658-F692 HydrophobicContact CB-CZ 4.15Å; L658-F692 HydrophobicContact CD1-CD2 4.42Å; L658-F692 HydrophobicContact CD1-CE2 4.2Å; L662-F692 HydrophobicContact CD1-CD1 4.07Å; L662-F692 HydrophobicContact CD1-CE1 4.35Å; L662-F692 HydrophobicContact CD2-CD1 4.43Å; L662-F692 WeakPolarHBondContact CD2-O 3.36Å; L662-F692 HydrophobicContact CG-CD1 4.2Å; L688-F692 PolarHBondContact O-N 3.42Å; F692-V694 PolarHBondContact O-N 3.01Å; F692-L695 HydrophobicContact CD1-CD1 4.48Å; F692-L695 HydrophobicContact CG-CD1 4.47Å; F692-L695 VanDerWaalsContact O-CB 3.31Å; F692-L695 WeakPolarHBondContact O-CB 3.37Å; F692-L695 PolarHBondContact O-N 3.02Å
693	V	61.4	Low	56.2	Low	4 Å²	4	67.9 Å²	67.9	2%	0.024	38%	0.376	C	S	.	.	H	α-helix	trans	-65.6	-29.5	-178.2	177.6	0	0	0	0	112	L669 K689 L695 Q696 F699	L669-V693 HydrophobicContact CD1-CG1 3.84Å; L669-V693 HydrophobicContact CD1-CG2 4.09Å; L669-V693 HydrophobicContact CD2-CB 4.35Å; L669-V693 HydrophobicContact CD2-CG1 3.7Å; L669-V693 HydrophobicContact CD2-CG2 3.64Å; L669-V693 HydrophobicContact CG-CG1 4.42Å; L669-V693 HydrophobicContact CG-CG2 4.31Å; K689-V693 WeakPolarHBondContact O-CG2 3.32Å; V693-L695 PolarHBondContact O-N 3.1Å; V693-Q696 PolarHBondContact O-N 2.75Å; V693-F699 HydrophobicContact CG1-CD2 3.97Å; V693-F699 HydrophobicContact CG1-CE2 3.89Å
694	V	65.3	Low	56.9	Low	81 Å²	81	64.5 Å²	64.5	49%	0.491	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-13.6	176.3	174.5	0	0	0	0	112.5	G690 F692 Q696 F699 V704	G690-V694 WeakPolarHBondContact O-CG2 3.45Å; G690-V694 PolarHBondContact O-N 3.12Å; F692-V694 PolarHBondContact O-N 3.01Å; V694-Q696 VanDerWaalsContact C-N 3.34Å; V694-F699 HydrophobicContact CG2-CE2 4.39Å; V694-F699 HydrophobicContact CG2-CZ 4.32Å; V694-V704 HydrophobicContact CG2-CG2 4.13Å
695	L	65.3	Low	57.4	Low	19 Å²	19	60.5 Å²	60.5	10%	0.099	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.5	-8.9	179.3	-54.7	173.3	0	0	0	113.5	I616 Y617 Y621 L662 F692 V693	I616-L695 HydrophobicContact CG2-CD1 4.14Å; Y617-L695 HydrophobicContact CD1-CD1 4.07Å; Y617-L695 HydrophobicContact CD1-CD2 4.2Å; Y617-L695 HydrophobicContact CE1-CD1 4.25Å; Y621-L695 HydrophobicContact CD2-CB 3.91Å; Y621-L695 HydrophobicContact CE2-CB 4.29Å; Y621-L695 HydrophobicContact CE2-CD1 4.25Å; Y621-L695 PolarHBondContact N-O 2.69Å; L662-L695 HydrophobicContact CD2-CB 3.9Å; F692-L695 HydrophobicContact CD1-CD1 4.48Å; F692-L695 HydrophobicContact CG-CD1 4.47Å; F692-L695 VanDerWaalsContact O-CB 3.31Å; F692-L695 WeakPolarHBondContact O-CB 3.37Å; F692-L695 PolarHBondContact O-N 3.02Å; V693-L695 PolarHBondContact O-N 3.1Å
696	Q	65.5	Low	57.6	Low	30 Å²	30	59.6 Å²	59.6	14%	0.14	34%	0.336	C	S	.	.	B	Isolated β-bridge	trans	-74.9	138.5	173.8	-80	-174.4	-31.6	0	0	111.7	L662 V664 V693 V694 N698	L662-Q696 HydrophobicContact CD2-CG 4.38Å; L662-Q696 PolarHBondContact O-NE2 2.93Å; V664-Q696 PolarHBondContact O-NE2 3.17Å; V693-Q696 PolarHBondContact O-N 2.75Å; V694-Q696 VanDerWaalsContact C-N 3.34Å; Q696-N698 VanDerWaalsContact C-N 3.35Å; Q696-N698 PolarHBondContact O-N 3.31Å
697	E	60	Low	57.9	Low	90 Å²	90	58.5 Å²	58.5	42%	0.421	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-36.1	178.8	-173	167	-164.9	0	0	113.8	K557 Y621 F699	K557-E697 VanDerWaalsContact CE-CD 3.45Å; K557-E697 WeakPolarHBondContact CE-OE1 2.93Å; K557-E697 VanDerWaalsContact CE-OE2 3.24Å; K557-E697 WeakPolarHBondContact CE-OE2 3.24Å; K557-E697 VanDerWaalsContact NZ-CD 3.33Å; K557-E697 IonicContact NZ-OE1 3.77Å; K557-E697 PolarHBondContact NZ-OE1 3.4Å; K557-E697 IonicContact NZ-OE2 2.61Å; Y621-E697 PolarHBondContact O-N 2.9Å; E697-F699 PolarHBondContact O-N 3.42Å
698	N	57.7	Low	57.8	Low	138 Å²	138	58.4 Å²	58.4	74%	0.738	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.5	40.2	-175	-66.3	-28.7	0	0	0	113.4	Q696 D700	Q696-N698 VanDerWaalsContact C-N 3.35Å; Q696-N698 PolarHBondContact O-N 3.31Å; N698-D700 PolarHBondContact O-N 2.69Å
699	F	59.2	Low	57.3	Low	60 Å²	60	62.7 Å²	62.7	26%	0.263	34%	0.335	S	S	.	.			trans	-72.9	124.2	-172.5	172.9	-101.1	0	0	0	113.6	V693 V694 E697 R701 V704	V693-F699 HydrophobicContact CG1-CD2 3.97Å; V693-F699 HydrophobicContact CG1-CE2 3.89Å; V694-F699 HydrophobicContact CG2-CE2 4.39Å; V694-F699 HydrophobicContact CG2-CZ 4.32Å; E697-F699 PolarHBondContact O-N 3.42Å; F699-R701 HydrophobicContact CE1-CB 4.47Å; F699-R701 HydrophobicContact CE1-CG 4.06Å; F699-V704 HydrophobicContact CE1-CG2 4.36Å; F699-V704 HydrophobicContact CE2-CB 4.49Å; F699-V704 HydrophobicContact CE2-CG2 3.58Å; F699-V704 HydrophobicContact CZ-CB 3.8Å; F699-V704 HydrophobicContact CZ-CG2 3.23Å
700	D	56.3	Low	57	Low	93 Å²	93	66.1 Å²	66.1	50%	0.497	36%	0.355	S	S	.	.			trans	-91.6	121.4	170.7	-170	2.7	0	0	0	111.2	N698 S702 V703	N698-D700 PolarHBondContact O-N 2.69Å; D700-S702 PolarHBondContact O-N 3.01Å; D700-S702 VanDerWaalsContact O-N 3.08Å; D700-S702 PolarHBondContact OD1-N 3.07Å; D700-S702 PolarHBondContact OD1-OG 3.45Å; D700-S702 PolarHBondContact OD2-OG 3.33Å; D700-V703 PolarHBondContact O-N 3.38Å
701	R	57.8	Low	56.3	Low	206 Å²	206	72.2 Å²	72.2	78%	0.777	37%	0.372	S	S	*	.	H	α-helix	trans	-57.6	-25.4	-179.6	-78.2	-177.7	176.9	179.3	0.2	112.8	F699 V703 V704 V705	F699-R701 HydrophobicContact CE1-CB 4.47Å; F699-R701 HydrophobicContact CE1-CG 4.06Å; R701-V703 PolarHBondContact O-N 3.31Å; R701-V704 PolarHBondContact O-N 2.74Å; R701-V705 PolarHBondContact O-N 3.18Å
702	S	55.8	Low	55.2	Low	65 Å²	65	78.4 Å²	78.4	46%	0.455	39%	0.392	S	S	.	.	H	α-helix	trans	-57.4	-33.6	179.1	68.9	0	0	0	0	112.9	D700 V705 A706	D700-S702 PolarHBondContact O-N 3.01Å; D700-S702 VanDerWaalsContact O-N 3.08Å; D700-S702 PolarHBondContact OD1-N 3.07Å; D700-S702 PolarHBondContact OD1-OG 3.45Å; D700-S702 PolarHBondContact OD2-OG 3.33Å; S702-V705 PolarHBondContact O-N 3.41Å; S702-A706 PolarHBondContact O-N 2.92Å
703	V	56.8	Low	53.8	Low	28 Å²	28	80.6 Å²	80.6	17%	0.17	42%	0.415	C	S	.	.	H	α-helix	trans	-74.5	-37.9	-175.2	-175.3	0	0	0	0	112.2	L669 D700 R701 V705 A706 F707	L669-V703 HydrophobicContact CD2-CG1 3.82Å; D700-V703 PolarHBondContact O-N 3.38Å; R701-V703 PolarHBondContact O-N 3.31Å; V703-V705 VanDerWaalsContact C-N 3.33Å; V703-A706 WeakPolarHBondContact O-CB 2.99Å; V703-A706 PolarHBondContact O-N 3.38Å; V703-F707 HydrophobicContact CG1-CD2 4.35Å; V703-F707 HydrophobicContact CG1-CE2 4.39Å; V703-F707 WeakPolarHBondContact O-CD2 3.4Å; V703-F707 PolarHBondContact O-N 2.89Å; V703-F707 VanDerWaalsContact O-N 3.15Å
704	V	55.5	Low	52.7	Low	44 Å²	44	86.9 Å²	86.9	27%	0.267	44%	0.444	S	S	.	.	H	α-helix	trans	-68.7	-34.4	175.1	163.4	0	0	0	0	111.5	V694 F699 R701 A706 F707 V708	V694-V704 HydrophobicContact CG2-CG2 4.13Å; F699-V704 HydrophobicContact CE1-CG2 4.36Å; F699-V704 HydrophobicContact CE2-CB 4.49Å; F699-V704 HydrophobicContact CE2-CG2 3.58Å; F699-V704 HydrophobicContact CZ-CB 3.8Å; F699-V704 HydrophobicContact CZ-CG2 3.23Å; R701-V704 PolarHBondContact O-N 2.74Å; V704-A706 VanDerWaalsContact C-N 3.31Å; V704-A706 PolarHBondContact O-N 3.42Å; V704-F707 PolarHBondContact O-N 3.45Å; V704-V708 HydrophobicContact CG1-CG2 4.27Å; V704-V708 VanDerWaalsContact O-CG2 3.3Å; V704-V708 WeakPolarHBondContact O-CG2 3.42Å; V704-V708 PolarHBondContact O-N 3.43Å
705	V	52.9	Low	51.2	Low	77 Å²	77	89.2 Å²	89.2	47%	0.467	45%	0.453	S	S	.	.	H	α-helix	trans	-62.8	-40.6	174	177.4	0	0	0	0	110.6	R701 S702 V703 F707 V708 Q709	R701-V705 PolarHBondContact O-N 3.18Å; S702-V705 PolarHBondContact O-N 3.41Å; V703-V705 VanDerWaalsContact C-N 3.33Å; V705-F707 PolarHBondContact O-N 3.36Å; V705-V708 PolarHBondContact O-N 2.79Å; V705-Q709 HydrophobicContact CG1-CG 4.19Å; V705-Q709 WeakPolarHBondContact O-CB 3.41Å; V705-Q709 WeakPolarHBondContact O-CG 3.43Å; V705-Q709 PolarHBondContact O-N 3.11Å
706	A	53.8	Low	49.6	Very low	34 Å²	34	96.5 Å²	96.5	28%	0.281	49%	0.486	S	S	.	.	H	α-helix	trans	-62.1	-39.8	174.4	0	0	0	0	0	112.6	S702 V703 V704 Q709 L710	S702-A706 PolarHBondContact O-N 2.92Å; V703-A706 WeakPolarHBondContact O-CB 2.99Å; V703-A706 PolarHBondContact O-N 3.38Å; V704-A706 VanDerWaalsContact C-N 3.31Å; V704-A706 PolarHBondContact O-N 3.42Å; A706-Q709 PolarHBondContact O-N 2.92Å; A706-L710 PolarHBondContact O-N 2.98Å; A706-L710 VanDerWaalsContact O-N 3.07Å
707	F	54.4	Low	48.1	Very low	42 Å²	42	105.7 Å²	105.7	18%	0.184	52%	0.52	C	S	.	.	H	α-helix	trans	-66.2	-35.1	174.2	-94.4	-81.7	0	0	0	113.7	L669 L670 C673 K689 V703 V704 V705	L669-F707 HydrophobicContact CD2-CE2 4.23Å; L670-F707 HydrophobicContact CD1-CE2 4.46Å; C673-F707 HydrophobicContact CB-CE1 4.21Å; C673-F707 HydrophobicContact CB-CE2 4.43Å; C673-F707 HydrophobicContact CB-CZ 3.47Å; C673-F707 VanDerWaalsContact CB-CZ 3.47Å; C673-F707 VanDerWaalsContact SG-CZ 3.6Å; K689-F707 HydrophobicContact CB-CE1 4.24Å; K689-F707 HydrophobicContact CD-CE1 4.32Å; V703-F707 HydrophobicContact CG1-CD2 4.35Å; V703-F707 HydrophobicContact CG1-CE2 4.39Å; V703-F707 WeakPolarHBondContact O-CD2 3.4Å; V703-F707 PolarHBondContact O-N 2.89Å; V703-F707 VanDerWaalsContact O-N 3.15Å; V704-F707 PolarHBondContact O-N 3.45Å; V705-F707 PolarHBondContact O-N 3.36Å
708	V	49.3	Very low	46.7	Very low	81 Å²	81	108.2 Å²	108.2	49%	0.491	53%	0.533	S	S	.	.	H	α-helix	trans	-77.4	-33.1	177.2	174.5	0	0	0	0	111.2	V704 V705 R711	V704-V708 HydrophobicContact CG1-CG2 4.27Å; V704-V708 VanDerWaalsContact O-CG2 3.3Å; V704-V708 WeakPolarHBondContact O-CG2 3.42Å; V704-V708 PolarHBondContact O-N 3.43Å; V705-V708 PolarHBondContact O-N 2.79Å; V708-R711 WeakPolarHBondContact O-CB 3.49Å; V708-R711 PolarHBondContact O-N 3.15Å
709	Q	45.9	Very low	45.3	Very low	139 Å²	139	104.8 Å²	104.8	65%	0.65	53%	0.531	S	S	*	.	H	α-helix	trans	-74.2	-33.1	177.6	-77.9	178.5	-36.4	0	0	113.1	V705 A706 R711 F712	V705-Q709 HydrophobicContact CG1-CG 4.19Å; V705-Q709 WeakPolarHBondContact O-CB 3.41Å; V705-Q709 WeakPolarHBondContact O-CG 3.43Å; V705-Q709 PolarHBondContact O-N 3.11Å; A706-Q709 PolarHBondContact O-N 2.92Å; Q709-R711 PolarHBondContact O-N 3.49Å; Q709-R711 VanDerWaalsContact O-N 3.15Å; Q709-F712 PolarHBondContact O-N 3.26Å
710	L	47.1	Very low	43.8	Very low	101 Å²	101	108.3 Å²	108.3	53%	0.529	56%	0.557	S	S	.	*	H	α-helix	trans	-59.1	-23.1	171.5	-86.4	158.2	0	0	0	113	A706 F712	A706-L710 PolarHBondContact O-N 2.98Å; A706-L710 VanDerWaalsContact O-N 3.07Å; L710-F712 VanDerWaalsContact C-N 3.34Å; L710-F712 PolarHBondContact O-N 3.13Å
711	R	41.3	Very low	42.3	Very low	147 Å²	147	112 Å²	112	56%	0.555	57%	0.574	S	S	*	*	H	α-helix	trans	-66.8	-25.2	177.3	-80.6	-162.1	-175.3	-161.8	7.4	115	V708 Q709 L715	V708-R711 WeakPolarHBondContact O-CB 3.49Å; V708-R711 PolarHBondContact O-N 3.15Å; Q709-R711 PolarHBondContact O-N 3.49Å; Q709-R711 VanDerWaalsContact O-N 3.15Å; R711-L715 WeakPolarHBondContact O-CD1 3.15Å
712	F	35.1	Very low	40.7	Very low	168 Å²	168	108.2 Å²	108.2	74%	0.737	58%	0.578	S	S	*	*	H	α-helix	trans	-89.4	-21.2	-173.3	-88.3	-85.9	0	0	0	113.4	Q709 L710	Q709-F712 PolarHBondContact O-N 3.26Å; L710-F712 VanDerWaalsContact C-N 3.34Å; L710-F712 PolarHBondContact O-N 3.13Å
713	G	34.4	Very low	39.3	Very low	46 Å²	46	112.8 Å²	112.8	47%	0.474	60%	0.595	S	S	.	*	H	α-helix	trans	-86.4	-27.1	-175.7	0	0	0	0	0	116.3
714	E	36.7	Very low	37.7	Very low	136 Å²	136	116.9 Å²	116.9	64%	0.636	62%	0.624	S	S	*	*	H	α-helix	trans	-97.4	-19.9	-177.4	-70.2	-172.9	154.4	0	0	113.6	R717	E714-R717 PolarHBondContact O-N 3.41Å
715	L	33.5	Very low	36.3	Very low	129 Å²	129	122.4 Å²	122.4	68%	0.675	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.6	-19.7	179.8	-99.2	151.1	0	0	0	113.7	R711	R711-L715 WeakPolarHBondContact O-CD1 3.15Å
716	E	33.3	Very low	35	Very low	172 Å²	172	126.5 Å²	126.5	80%	0.804	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.5	-15.6	174.2	-75.7	-174.7	156.9	0	0	114
717	R	33.3	Very low	33.6	Very low	224 Å²	224	127.9 Å²	127.9	85%	0.845	69%	0.69	S	S	*	*	S	Bend	trans	-95	-7.7	-179.6	-68.2	-172.8	-162.9	166.1	6.6	115	E714	E714-R717 PolarHBondContact O-N 3.41Å
718	M	30.7	Very low	32.2	Very low	142 Å²	142	132.2 Å²	132.2	70%	0.7	72%	0.724	S	S	*	*	S	Bend	trans	-101.2	13.2	179.6	-73.6	-170.8	-79.6	0	0	114	T720	M718-T720 VanDerWaalsContact C-N 3.3Å; M718-T720 PolarHBondContact O-N 2.98Å
719	G	27.7	Very low	30.9	Very low	67 Å²	67	140.3 Å²	140.3	69%	0.691	75%	0.746	S	S	*	*	S	Bend	trans	-74.1	-0.1	-175.9	0	0	0	0	0	117.2
720	T	27.7	Very low	29.9	Very low	133 Å²	133	140.6 Å²	140.6	82%	0.816	75%	0.747	S	S	*	*	S	Bend	trans	-147.5	65.6	-175.9	57.8	0	0	0	0	112.8	M718	M718-T720 VanDerWaalsContact C-N 3.3Å; M718-T720 PolarHBondContact O-N 2.98Å
721	M	25.6	Very low	28.9	Very low	171 Å²	171	143.2 Å²	143.2	84%	0.842	75%	0.75	S	S	*	*			trans	-152.8	109.2	160.2	-109	167.8	84.1	0	0	108.5	M723	M721-M723 PolarHBondContact O-N 2.82Å
722	S	24.1	Very low	28.1	Very low	126 Å²	126	141.3 Å²	141.3	88%	0.881	76%	0.759	S	S	*	*			trans	-64.8	96	175.9	63	0	0	0	0	109.3
723	M	25.4	Very low	27.7	Very low	161 Å²	161	137.5 Å²	137.5	79%	0.793	75%	0.751	S	S	*	*			trans	-81.2	122.5	163.4	-72.4	-152.6	75	0	0	108.3	M721 N725	M721-M723 PolarHBondContact O-N 2.82Å; M723-N725 PolarHBondContact O-N 3.2Å
724	S	25	Very low	27.4	Very low	114 Å²	114	139.4 Å²	139.4	80%	0.797	75%	0.753	S	S	*	*			trans	-40.5	105.4	169	-28.1	0	0	0	0	110.5	D726	S724-D726 PolarHBondContact O-N 2.82Å
725	N	25.7	Very low	27	Very low	161 Å²	161	137.6 Å²	137.6	86%	0.861	76%	0.755	S	S	*	*			trans	-78	75.1	173.4	-96.8	-18.5	0	0	0	109	M723	M723-N725 PolarHBondContact O-N 3.2Å
726	D	24.1	Very low	26.9	Very low	162 Å²	162	134.1 Å²	134.1	87%	0.866	74%	0.738	S	S	*	*			trans	-129.4	92.3	162.3	-89.6	-30.2	0	0	0	107.2	S724	S724-D726 PolarHBondContact O-N 2.82Å
727	G	25.1	Very low	27	Very low	64 Å²	64	127.4 Å²	127.4	66%	0.66	71%	0.706	S	S	*	*	S	Bend	trans	144.4	121.3	178.1	0	0	0	0	0	112
728	C	24.2	Very low	27.1	Very low	133 Å²	133	117.3 Å²	117.3	90%	0.899	67%	0.668	S	S	*	*			trans	76.9	62.4	169.2	-53.8	0	0	0	0	116.3
729	R	22.7	Very low	27.3	Very low	251 Å²	251	117.6 Å²	117.6	95%	0.947	66%	0.662	S	S	*	*			trans	-152.6	66.7	149.6	-111.5	179.1	-169.9	-176.5	3.7	111.1
730	E	25.6	Very low	27.5	Very low	144 Å²	144	123 Å²	123	67%	0.673	66%	0.661	S	S	*	*			trans	-120.9	124.3	156.7	-81.2	-173.5	161.6	0	0	108.8	R1154	E730-R1154 IonicContact OE1-CZ 3.17Å; E730-R1154 IonicContact OE1-NH1 2.84Å; E730-R1154 PolarHBondContact OE1-NH1 2.94Å; E730-R1154 IonicContact OE1-NH2 3.74Å; E730-R1154 PolarHBondContact OE1-NH2 3.14Å
731	R	26.5	Very low	27.7	Very low	157 Å²	157	118.4 Å²	118.4	59%	0.592	63%	0.634	S	S	*	*			trans	-54.6	151.3	168.3	-70.5	169.8	172.7	176.5	-6.4	109.2	P733	R731-P733 WeakPolarHBondContact O-CD 3.38Å
732	S	23.1	Very low	28	Very low	107 Å²	107	112 Å²	112	75%	0.748	60%	0.602	S	S	*	*			trans	-45.2	124.5	-176.4	54.6	0	0	0	0	113.4
733	P	27.7	Very low	28.3	Very low	88 Å²	88	111.9 Å²	111.9	57%	0.571	59%	0.591	S	S	*	*			trans	-97.2	101.5	158.8	32.2	-19.4	0	0	0	107.7	R731 C735	R731-P733 WeakPolarHBondContact O-CD 3.38Å; P733-C735 PolarHBondContact O-N 3.39Å
734	V	27.8	Very low	28.5	Very low	85 Å²	85	107.2 Å²	107.2	52%	0.515	58%	0.577	S	S	.	*	S	Bend	trans	-70.8	22.7	156.1	179.3	0	0	0	0	109.7
735	C	28.4	Very low	28.7	Very low	99 Å²	99	104.7 Å²	104.7	67%	0.669	56%	0.56	S	S	*	*			trans	-133.2	24	-159.6	-75	0	0	0	0	116.2	P733	P733-C735 PolarHBondContact O-N 3.39Å
736	T	30.7	Very low	28.9	Very low	55 Å²	55	102.3 Å²	102.3	34%	0.337	55%	0.551	S	S	.	*			trans	-146.1	66	171.6	50.1	0	0	0	0	111.7	R739	T736-R739 HydrophobicContact CG2-CB 4.11Å
737	Y	36.8	Very low	29.1	Very low	32 Å²	32	100.5 Å²	100.5	13%	0.125	54%	0.541	C	S	.	.	S	Bend	trans	-86.5	-38.6	177.4	-111.8	-79.3	0	0	0	112.5	D529 L532 N596 N599 T600 E603	D529-Y737 VanDerWaalsContact CG-CB 3.49Å; D529-Y737 WeakPolarHBondContact OD1-CB 3.25Å; D529-Y737 PolarHBondContact OD2-N 3.42Å; L532-Y737 HydrophobicContact CD2-CD1 3.51Å; L532-Y737 HydrophobicContact CD2-CE1 3.81Å; L532-Y737 HydrophobicContact CD2-CG 4.02Å; N596-Y737 PolarHBondContact OD1-O 2.9Å; N599-Y737 VanDerWaalsContact C-OH 3.3Å; N599-Y737 HydrophobicContact CB-CD1 4.16Å; N599-Y737 HydrophobicContact CB-CE1 3.71Å; N599-Y737 PolarHBondContact O-OH 3.38Å; T600-Y737 VanDerWaalsContact CA-CE1 3.47Å; T600-Y737 WeakPolarHBondContact CA-OH 3.39Å; T600-Y737 WeakPolarHBondContact OG1-CE1 3.44Å; E603-Y737 HydrophobicContact CB-CE2 4.39Å; E603-Y737 WeakPolarHBondContact CB-OH 3.43Å; E603-Y737 HydrophobicContact CG-CE2 4.4Å; E603-Y737 WeakPolarHBondContact CG-OH 3.28Å
738	F	34.7	Very low	29.2	Very low	12 Å²	12	107.9 Å²	107.9	5%	0.053	55%	0.549	C	S	.	.	S	Bend	trans	-97.3	-19.7	176.5	-87.2	-98.2	0	0	0	115.2	L482 A486 E525 L528 D529 N596 R740 S741	L482-F738 HydrophobicContact CD1-CE2 3.78Å; L482-F738 HydrophobicContact CD1-CZ 3.59Å; L482-F738 HydrophobicContact CG-CZ 4.19Å; A486-F738 HydrophobicContact CB-CE1 4.14Å; E525-F738 HydrophobicContact CB-CB 4.2Å; E525-F738 HydrophobicContact CG-CB 4.02Å; L528-F738 HydrophobicContact CB-CE2 4.18Å; L528-F738 HydrophobicContact CD1-CZ 4.38Å; D529-F738 VanDerWaalsContact OD1-CD2 3.28Å; D529-F738 WeakPolarHBondContact OD1-CD2 2.98Å; N596-F738 WeakPolarHBondContact ND2-CE1 3.47Å; F738-R740 VanDerWaalsContact C-N 3.26Å; F738-R740 PolarHBondContact O-N 2.87Å; F738-S741 PolarHBondContact O-N 3.44Å; F738-S741 PolarHBondContact O-OG 3.4Å
739	R	35.4	Very low	29.4	Very low	147 Å²	147	103.8 Å²	103.8	56%	0.555	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.1	-8.3	-169.7	-140.6	177.3	-158.7	-173.4	4.9	116.4	T736	T736-R739 HydrophobicContact CG2-CB 4.11Å
740	R	31.6	Very low	29.8	Very low	182 Å²	182	96.2 Å²	96.2	69%	0.687	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.1	-9	-178.2	-90.8	-176.4	177.7	175.1	1.8	114.9	F738	F738-R740 VanDerWaalsContact C-N 3.26Å; F738-R740 PolarHBondContact O-N 2.87Å
741	S	32.4	Very low	30.2	Very low	35 Å²	35	100.4 Å²	100.4	25%	0.245	52%	0.518	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.6	-34.8	172.2	63.9	0	0	0	0	112.6	F738 A744 S745	F738-S741 PolarHBondContact O-N 3.44Å; F738-S741 PolarHBondContact O-OG 3.4Å; S741-A744 PolarHBondContact O-N 3.04Å; S741-S745 PolarHBondContact O-N 2.91Å
742	H	31.2	Very low	30.7	Very low	37 Å²	37	95.4 Å²	95.4	17%	0.171	51%	0.51	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.5	-18.5	-174.8	-95	-86.1	0	0	0	116.1	E493 S745	E493-H742 IonicContact OE1-CE1 3.27Å; E493-H742 IonicContact OE1-CG 2.69Å; E493-H742 IonicContact OE1-ND1 3.54Å; E493-H742 PolarHBondContact OE1-ND1 2.82Å; E493-H742 IonicContact OE2-CE1 3.61Å; E493-H742 PolarHBondContact OE2-CE1 3.09Å; E493-H742 IonicContact OE2-CG 2.71Å; E493-H742 IonicContact OE2-ND1 3.46Å; E493-H742 PolarHBondContact OE2-ND1 3.37Å; H742-S745 PolarHBondContact O-OG 3.29Å
743	I	30.8	Very low	31.3	Very low	124 Å²	124	94.1 Å²	94.1	64%	0.636	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.1	-9.9	170.3	-60.4	175.7	0	0	0	111.3
744	A	29.8	Very low	31.9	Very low	62 Å²	62	99.9 Å²	99.9	51%	0.512	51%	0.505	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.3	-19.4	175.4	0	0	0	0	0	113.4	S741	S741-A744 PolarHBondContact O-N 3.04Å
745	S	27.9	Very low	32.6	Very low	62 Å²	62	101.3 Å²	101.3	43%	0.434	51%	0.508	S	S	.	.	S	Bend	trans	-84.8	-18.2	178.6	59.3	0	0	0	0	114.5	S741 H742 N747	S741-S745 PolarHBondContact O-N 2.91Å; H742-S745 PolarHBondContact O-OG 3.29Å; S745-N747 VanDerWaalsContact C-N 3.31Å
746	V	30.9	Very low	33.2	Very low	110 Å²	110	102.4 Å²	102.4	67%	0.667	50%	0.502	S	S	*	.	S	Bend	trans	-85.7	-4.5	169.3	-179.6	0	0	0	0	112.3
747	N	26.8	Very low	33.7	Very low	124 Å²	124	104.7 Å²	104.7	66%	0.663	51%	0.512	S	S	*	.			trans	-110.6	74.1	164.1	-81.1	-42.4	0	0	0	109.7	S745 A749	S745-N747 VanDerWaalsContact C-N 3.31Å; N747-A749 PolarHBondContact O-N 3.35Å
748	R	27.9	Very low	34.1	Very low	219 Å²	219	106 Å²	106	83%	0.826	53%	0.53	S	S	*	.			trans	-62.2	73.9	151.2	-82.7	-173.2	-171.3	177.8	2.6	108.3	P750	R748-P750 WeakPolarHBondContact O-CD 3.33Å
749	A	27.8	Very low	34.6	Very low	47 Å²	47	108.1 Å²	108.1	39%	0.388	54%	0.544	S	S	.	.			trans	-83.4	111.8	158.7	0	0	0	0	0	106.3	N747 N753	N747-A749 PolarHBondContact O-N 3.35Å; A749-N753 HydrophobicContact CB-CB 3.99Å; A749-N753 VanDerWaalsContact CB-ND2 3.32Å; A749-N753 WeakPolarHBondContact CB-ND2 3.47Å
750	P	32.7	Very low	35	Very low	92 Å²	92	103.7 Å²	103.7	60%	0.597	54%	0.535	S	S	*	.			trans	-62.3	167.4	176.5	9.4	-0.2	0	0	0	109	R748 A752 N753	R748-P750 WeakPolarHBondContact O-CD 3.33Å; P750-A752 HydrophobicContact CB-CB 4.37Å; P750-A752 HydrophobicContact CG-CB 4.18Å; P750-A752 CarbonylContact O-C 3.53Å; P750-A752 WeakPolarHBondContact O-CA 3.38Å; P750-A752 PolarHBondContact O-N 3.41Å; P750-N753 PolarHBondContact O-N 3.29Å
751	R	33.8	Very low	35.8	Very low	232 Å²	232	97.4 Å²	97.4	88%	0.875	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	-36.9	-20.1	167	-95.8	171.9	164.4	157.3	-4.8	115.2	N753 R754 I755	R751-N753 VanDerWaalsContact C-N 3.28Å; R751-N753 PolarHBondContact O-N 3.12Å; R751-R754 PolarHBondContact O-N 3.45Å; R751-I755 PolarHBondContact O-N 3.2Å
752	A	35.7	Very low	36.8	Very low	52 Å²	52	98.8 Å²	98.8	43%	0.43	53%	0.531	S	S	.	.	H	α-helix	trans	-46	-39	163.4	0	0	0	0	0	114.8	P750 R754 I755 F756	P750-A752 HydrophobicContact CB-CB 4.37Å; P750-A752 HydrophobicContact CG-CB 4.18Å; P750-A752 CarbonylContact O-C 3.53Å; P750-A752 WeakPolarHBondContact O-CA 3.38Å; P750-A752 PolarHBondContact O-N 3.41Å; A752-R754 PolarHBondContact O-N 2.84Å; A752-I755 CarbonylContact O-C 3.54Å; A752-I755 PolarHBondContact O-N 3.34Å; A752-F756 WeakPolarHBondContact O-CB 3.43Å; A752-F756 PolarHBondContact O-N 3.21Å
753	N	37.6	Very low	37.7	Very low	81 Å²	81	102.4 Å²	102.4	43%	0.433	55%	0.551	S	S	.	*	H	α-helix	trans	-70	-27	-178.3	-99.5	15.2	0	0	0	114	A749 P750 R751 F756 D757	A749-N753 HydrophobicContact CB-CB 3.99Å; A749-N753 VanDerWaalsContact CB-ND2 3.32Å; A749-N753 WeakPolarHBondContact CB-ND2 3.47Å; P750-N753 PolarHBondContact O-N 3.29Å; R751-N753 VanDerWaalsContact C-N 3.28Å; R751-N753 PolarHBondContact O-N 3.12Å; N753-F756 PolarHBondContact O-N 3.47Å; N753-D757 WeakPolarHBondContact O-CB 3.49Å; N753-D757 PolarHBondContact O-N 3.47Å
754	R	38.7	Very low	38.7	Very low	209 Å²	209	98.5 Å²	98.5	79%	0.789	54%	0.535	S	S	*	.	H	α-helix	trans	-76.1	-33.3	171.9	-68.6	-170.7	-152.9	177.1	6.7	112.1	R751 A752 A758	R751-R754 PolarHBondContact O-N 3.45Å; A752-R754 PolarHBondContact O-N 2.84Å; R754-A758 WeakPolarHBondContact O-CB 3.39Å; R754-A758 PolarHBondContact O-N 3.24Å
755	I	43.5	Very low	39.9	Very low	114 Å²	114	99.2 Å²	99.2	59%	0.585	53%	0.533	S	S	*	.	H	α-helix	trans	-71	-36.9	171.7	-60.7	174.4	0	0	0	109.4	R751 A752 T759	R751-I755 PolarHBondContact O-N 3.2Å; A752-I755 CarbonylContact O-C 3.54Å; A752-I755 PolarHBondContact O-N 3.34Å; I755-T759 HydrophobicContact CG2-CG2 4.38Å; I755-T759 WeakPolarHBondContact O-CA 3.45Å; I755-T759 VanDerWaalsContact O-CB 3.25Å; I755-T759 WeakPolarHBondContact O-CB 3.45Å; I755-T759 WeakPolarHBondContact O-CG2 3.34Å; I755-T759 PolarHBondContact O-N 2.97Å; I755-T759 PolarHBondContact O-OG1 3.34Å
756	F	40.9	Very low	41.2	Very low	123 Å²	123	103.1 Å²	103.1	54%	0.539	55%	0.547	S	S	.	.	H	α-helix	trans	-70.8	-38.5	176.4	-163.6	-95.8	0	0	0	111.7	A752 N753 T759 C760	A752-F756 WeakPolarHBondContact O-CB 3.43Å; A752-F756 PolarHBondContact O-N 3.21Å; N753-F756 PolarHBondContact O-N 3.47Å; F756-T759 VanDerWaalsContact CA-OG1 3.23Å; F756-T759 WeakPolarHBondContact CA-OG1 3.32Å; F756-T759 PolarHBondContact O-OG1 3.23Å; F756-C760 WeakPolarHBondContact CE1-SG 3.28Å; F756-C760 WeakPolarHBondContact O-CA 3.37Å; F756-C760 WeakPolarHBondContact O-CB 3.3Å; F756-C760 PolarHBondContact O-N 3.19Å; F756-C760 PolarHBondContact O-SG 3.14Å
757	D	41.8	Very low	42.3	Very low	102 Å²	102	99.9 Å²	99.9	55%	0.545	53%	0.529	S	S	.	.	H	α-helix	trans	-72	-38.3	173.2	-74.8	-23.3	0	0	0	111.1	N753 C760 A761	N753-D757 WeakPolarHBondContact O-CB 3.49Å; N753-D757 PolarHBondContact O-N 3.47Å; D757-C760 PolarHBondContact O-N 3.16Å; D757-A761 WeakPolarHBondContact O-CB 3.34Å; D757-A761 PolarHBondContact O-N 3.21Å
758	A	44.5	Very low	43.6	Very low	60 Å²	60	100.9 Å²	100.9	50%	0.496	53%	0.527	S	S	.	.	H	α-helix	trans	-70.5	-37.5	174.2	0	0	0	0	0	112.3	R754 S762	R754-A758 WeakPolarHBondContact O-CB 3.39Å; R754-A758 PolarHBondContact O-N 3.24Å; A758-S762 WeakPolarHBondContact O-CB 3.39Å; A758-S762 PolarHBondContact O-N 2.66Å; A758-S762 PolarHBondContact O-OG 2.95Å
759	T	45.4	Very low	45.1	Very low	56 Å²	56	98.5 Å²	98.5	34%	0.344	52%	0.519	S	S	.	.	H	α-helix	trans	-73.1	-35.8	171.8	46.2	0	0	0	0	111.3	I755 F756 S762 L763	I755-T759 HydrophobicContact CG2-CG2 4.38Å; I755-T759 WeakPolarHBondContact O-CA 3.45Å; I755-T759 VanDerWaalsContact O-CB 3.25Å; I755-T759 WeakPolarHBondContact O-CB 3.45Å; I755-T759 WeakPolarHBondContact O-CG2 3.34Å; I755-T759 PolarHBondContact O-N 2.97Å; I755-T759 PolarHBondContact O-OG1 3.34Å; F756-T759 VanDerWaalsContact CA-OG1 3.23Å; F756-T759 WeakPolarHBondContact CA-OG1 3.32Å; F756-T759 PolarHBondContact O-OG1 3.23Å; T759-S762 WeakPolarHBondContact CA-OG 3.28Å; T759-S762 PolarHBondContact O-N 3.28Å; T759-S762 PolarHBondContact O-OG 3.31Å; T759-S762 VanDerWaalsContact O-OG 3.08Å; T759-L763 WeakPolarHBondContact O-CA 3.45Å; T759-L763 WeakPolarHBondContact O-CB 3.49Å; T759-L763 VanDerWaalsContact O-CD1 3.3Å; T759-L763 WeakPolarHBondContact O-CD1 3.49Å; T759-L763 WeakPolarHBondContact O-CG 3.38Å; T759-L763 PolarHBondContact O-N 3.31Å
760	C	43.1	Very low	46.4	Very low	54 Å²	54	101.5 Å²	101.5	37%	0.365	53%	0.528	S	S	.	.	H	α-helix	trans	-67.3	-35.7	171.3	-80.6	0	0	0	0	111.3	F756 D757 S764	F756-C760 WeakPolarHBondContact CE1-SG 3.28Å; F756-C760 WeakPolarHBondContact O-CA 3.37Å; F756-C760 WeakPolarHBondContact O-CB 3.3Å; F756-C760 PolarHBondContact O-N 3.19Å; F756-C760 PolarHBondContact O-SG 3.14Å; D757-C760 PolarHBondContact O-N 3.16Å; C760-S764 WeakPolarHBondContact O-CA 3.36Å; C760-S764 WeakPolarHBondContact O-CB 3.31Å; C760-S764 PolarHBondContact O-N 2.62Å
761	A	49	Very low	47.5	Very low	51 Å²	51	101.8 Å²	101.8	42%	0.421	52%	0.52	S	S	.	.	H	α-helix	trans	-69.8	-42.3	173.7	0	0	0	0	0	111.2	D757 S764 T765	D757-A761 WeakPolarHBondContact O-CB 3.34Å; D757-A761 PolarHBondContact O-N 3.21Å; A761-S764 WeakPolarHBondContact O-CB 3.5Å; A761-S764 PolarHBondContact O-N 2.91Å; A761-T765 WeakPolarHBondContact O-CB 3.36Å; A761-T765 PolarHBondContact O-N 2.71Å; A761-T765 PolarHBondContact O-OG1 3.26Å
762	S	52.1	Low	48.6	Very low	63 Å²	63	93.8 Å²	93.8	44%	0.441	50%	0.5	S	S	.	.	H	α-helix	trans	-70.9	-38.1	176.2	72.9	0	0	0	0	112.3	A758 T759 T765 M766	A758-S762 WeakPolarHBondContact O-CB 3.39Å; A758-S762 PolarHBondContact O-N 2.66Å; A758-S762 PolarHBondContact O-OG 2.95Å; T759-S762 WeakPolarHBondContact CA-OG 3.28Å; T759-S762 PolarHBondContact O-N 3.28Å; T759-S762 PolarHBondContact O-OG 3.31Å; T759-S762 VanDerWaalsContact O-OG 3.08Å; S762-T765 PolarHBondContact O-N 3.27Å; S762-M766 WeakPolarHBondContact O-CB 3.4Å; S762-M766 PolarHBondContact O-N 3.04Å
763	L	50.6	Low	49.6	Very low	113 Å²	113	96.7 Å²	96.7	59%	0.592	51%	0.507	S	S	*	.	H	α-helix	trans	-65.8	-36.7	167.9	-84.9	146.5	0	0	0	111.1	T759 T765 S767	T759-L763 WeakPolarHBondContact O-CA 3.45Å; T759-L763 WeakPolarHBondContact O-CB 3.49Å; T759-L763 VanDerWaalsContact O-CD1 3.3Å; T759-L763 WeakPolarHBondContact O-CD1 3.49Å; T759-L763 WeakPolarHBondContact O-CG 3.38Å; T759-L763 PolarHBondContact O-N 3.31Å; L763-T765 VanDerWaalsContact C-N 3.3Å; L763-T765 PolarHBondContact O-N 2.96Å; L763-S767 WeakPolarHBondContact O-CA 3.35Å; L763-S767 WeakPolarHBondContact O-CB 3.39Å; L763-S767 PolarHBondContact O-N 2.94Å; L763-S767 PolarHBondContact O-OG 2.66Å
764	S	51.8	Low	50.5	Low	43 Å²	43	94.1 Å²	94.1	30%	0.301	49%	0.493	S	S	.	.	H	α-helix	trans	-62.2	-42.1	171.8	131.1	0	0	0	0	110	C760 A761 S767 K768	C760-S764 WeakPolarHBondContact O-CA 3.36Å; C760-S764 WeakPolarHBondContact O-CB 3.31Å; C760-S764 PolarHBondContact O-N 2.62Å; A761-S764 WeakPolarHBondContact O-CB 3.5Å; A761-S764 PolarHBondContact O-N 2.91Å; S764-S767 WeakPolarHBondContact CA-OG 3.05Å; S764-S767 PolarHBondContact O-N 3.33Å; S764-S767 PolarHBondContact O-OG 2.89Å; S764-K768 WeakPolarHBondContact O-CB 3.41Å; S764-K768 VanDerWaalsContact O-CG 3.25Å; S764-K768 WeakPolarHBondContact O-CG 3.32Å; S764-K768 PolarHBondContact O-N 3.44Å
765	T	56.1	Low	51.4	Low	77 Å²	77	88.4 Å²	88.4	47%	0.472	48%	0.479	S	S	.	.	H	α-helix	trans	-75.4	-42.8	-177.8	-44.2	0	0	0	0	111.3	A761 S762 L763 S767 K768 Y769	A761-T765 WeakPolarHBondContact O-CB 3.36Å; A761-T765 PolarHBondContact O-N 2.71Å; A761-T765 PolarHBondContact O-OG1 3.26Å; S762-T765 PolarHBondContact O-N 3.27Å; L763-T765 VanDerWaalsContact C-N 3.3Å; L763-T765 PolarHBondContact O-N 2.96Å; T765-S767 VanDerWaalsContact C-N 3.34Å; T765-K768 PolarHBondContact O-N 3.15Å; T765-Y769 PolarHBondContact O-N 3.11Å
766	M	54.9	Low	52.3	Low	144 Å²	144	93 Å²	93	71%	0.709	49%	0.489	S	S	*	.	H	α-helix	trans	-61.3	-42.8	169.9	-93.1	-134.7	-170	0	0	110.8	S762 Y769 L770	S762-M766 WeakPolarHBondContact O-CB 3.4Å; S762-M766 PolarHBondContact O-N 3.04Å; M766-Y769 PolarHBondContact O-N 2.79Å; M766-L770 VanDerWaalsContact O-CB 3.3Å; M766-L770 WeakPolarHBondContact O-CB 3.49Å; M766-L770 PolarHBondContact O-N 2.82Å
767	S	52.8	Low	53.5	Low	41 Å²	41	95.8 Å²	95.8	29%	0.287	50%	0.496	S	S	.	.	H	α-helix	trans	-60.5	-53.1	174.8	82.6	0	0	0	0	108.4	L763 S764 T765 Y769 L770 F771	L763-S767 WeakPolarHBondContact O-CA 3.35Å; L763-S767 WeakPolarHBondContact O-CB 3.39Å; L763-S767 PolarHBondContact O-N 2.94Å; L763-S767 PolarHBondContact O-OG 2.66Å; S764-S767 WeakPolarHBondContact CA-OG 3.05Å; S764-S767 PolarHBondContact O-N 3.33Å; S764-S767 PolarHBondContact O-OG 2.89Å; T765-S767 VanDerWaalsContact C-N 3.34Å; S767-Y769 PolarHBondContact O-N 2.99Å; S767-Y769 VanDerWaalsContact O-N 3.12Å; S767-L770 CarbonylContact O-C 3.55Å; S767-L770 PolarHBondContact O-N 3.25Å; S767-F771 WeakPolarHBondContact O-CA 3.47Å; S767-F771 WeakPolarHBondContact O-CB 3.45Å; S767-F771 WeakPolarHBondContact O-CD2 3.26Å; S767-F771 PolarHBondContact O-N 3.46Å
768	K	55.7	Low	54.6	Low	146 Å²	146	97.1 Å²	97.1	64%	0.635	49%	0.493	S	S	*	.	H	α-helix	trans	-54.9	-37.5	177.7	-76.1	172.2	-175.6	176.9	0	112.3	S764 T765 S772	S764-K768 WeakPolarHBondContact O-CB 3.41Å; S764-K768 VanDerWaalsContact O-CG 3.25Å; S764-K768 WeakPolarHBondContact O-CG 3.32Å; S764-K768 PolarHBondContact O-N 3.44Å; T765-K768 PolarHBondContact O-N 3.15Å; K768-S772 WeakPolarHBondContact O-CB 3.45Å; K768-S772 PolarHBondContact O-N 3.29Å; K768-S772 PolarHBondContact O-OG 3.46Å
769	Y	58	Low	55.9	Low	168 Å²	168	99.8 Å²	99.8	66%	0.659	50%	0.499	S	S	*	.	H	α-helix	trans	-68.7	-48.6	173.8	-107.7	-85.8	0	0	0	112.8	T765 M766 S767 S772 L773	T765-Y769 PolarHBondContact O-N 3.11Å; M766-Y769 PolarHBondContact O-N 2.79Å; S767-Y769 PolarHBondContact O-N 2.99Å; S767-Y769 VanDerWaalsContact O-N 3.12Å; Y769-S772 PolarHBondContact O-N 3.49Å; Y769-S772 PolarHBondContact O-OG 2.69Å; Y769-L773 PolarHBondContact O-N 3.43Å
770	L	55.8	Low	57.2	Low	111 Å²	111	100.4 Å²	100.4	58%	0.581	50%	0.499	S	S	*	.	H	α-helix	trans	-62.4	-46	178.1	-146	95.3	0	0	0	110.7	M766 S767 L773 L774	M766-L770 VanDerWaalsContact O-CB 3.3Å; M766-L770 WeakPolarHBondContact O-CB 3.49Å; M766-L770 PolarHBondContact O-N 2.82Å; S767-L770 CarbonylContact O-C 3.55Å; S767-L770 PolarHBondContact O-N 3.25Å; L770-L773 WeakPolarHBondContact O-CB 3.41Å; L770-L773 PolarHBondContact O-N 2.81Å; L770-L774 HydrophobicContact CD2-CD1 4.12Å; L770-L774 HydrophobicContact CG-CD1 4.33Å; L770-L774 WeakPolarHBondContact O-CB 3.17Å; L770-L774 WeakPolarHBondContact O-CD1 3.46Å; L770-L774 VanDerWaalsContact O-CG 3.23Å; L770-L774 WeakPolarHBondContact O-CG 3.39Å; L770-L774 PolarHBondContact O-N 2.91Å
771	F	55.3	Low	58.6	Low	98 Å²	98	98.1 Å²	98.1	43%	0.43	48%	0.484	S	S	.	.	H	α-helix	trans	-60.9	-41.6	172.2	-82.8	-85.2	0	0	0	110.9	S767 L773 L774 D775 Y940	S767-F771 WeakPolarHBondContact O-CA 3.47Å; S767-F771 WeakPolarHBondContact O-CB 3.45Å; S767-F771 WeakPolarHBondContact O-CD2 3.26Å; S767-F771 PolarHBondContact O-N 3.46Å; F771-L773 VanDerWaalsContact C-N 3.28Å; F771-L773 PolarHBondContact O-N 3.5Å; F771-L774 PolarHBondContact O-N 3.42Å; F771-D775 VanDerWaalsContact O-CB 3.28Å; F771-D775 WeakPolarHBondContact O-CB 3.44Å; F771-D775 PolarHBondContact O-N 2.86Å; F771-Y940 HydrophobicContact CD1-CD2 4.1Å; F771-Y940 AromaticContact CD1-CE2 3.38Å; F771-Y940 HydrophobicContact CD1-CE2 3.38Å; F771-Y940 AromaticContact CD1-CZ 3.87Å; F771-Y940 AromaticContact CE1-CD2 3.3Å; F771-Y940 HydrophobicContact CE1-CD2 3.3Å; F771-Y940 AromaticContact CE1-CE2 3.03Å; F771-Y940 HydrophobicContact CE1-CE2 3.03Å; F771-Y940 HydrophobicContact CE1-CG 4.4Å; F771-Y940 AromaticContact CE1-CZ 3.94Å; F771-Y940 AromaticContact CZ-CD2 3.94Å; F771-Y940 HydrophobicContact CZ-CD2 3.94Å; F771-Y940 HydrophobicContact CZ-CE2 4.07Å
772	S	57.3	Low	59.7	Low	63 Å²	63	98 Å²	98	44%	0.441	48%	0.476	S	S	.	.	H	α-helix	trans	-66.9	-29	175.5	79	0	0	0	0	113.3	K768 Y769	K768-S772 WeakPolarHBondContact O-CB 3.45Å; K768-S772 PolarHBondContact O-N 3.29Å; K768-S772 PolarHBondContact O-OG 3.46Å; Y769-S772 PolarHBondContact O-N 3.49Å; Y769-S772 PolarHBondContact O-OG 2.69Å
773	L	57.5	Low	61.1	Low	113 Å²	113	100 Å²	100	59%	0.592	48%	0.481	S	S	*	.	H	α-helix	trans	-74.8	-38.5	173.1	-109.8	137.8	0	0	0	111.2	Y769 L770 F771	Y769-L773 PolarHBondContact O-N 3.43Å; L770-L773 WeakPolarHBondContact O-CB 3.41Å; L770-L773 PolarHBondContact O-N 2.81Å; F771-L773 VanDerWaalsContact C-N 3.28Å; F771-L773 PolarHBondContact O-N 3.5Å
774	L	55.1	Low	62.6	Low	27 Å²	27	97.3 Å²	97.3	14%	0.141	47%	0.471	C	S	.	.	H	α-helix	trans	-73.9	-36	178.1	-71.1	157.1	0	0	0	112.6	L770 F771 R776 W777 L780 P781 Y940	L770-L774 HydrophobicContact CD2-CD1 4.12Å; L770-L774 HydrophobicContact CG-CD1 4.33Å; L770-L774 WeakPolarHBondContact O-CB 3.17Å; L770-L774 WeakPolarHBondContact O-CD1 3.46Å; L770-L774 VanDerWaalsContact O-CG 3.23Å; L770-L774 WeakPolarHBondContact O-CG 3.39Å; L770-L774 PolarHBondContact O-N 2.91Å; F771-L774 PolarHBondContact O-N 3.42Å; L774-R776 PolarHBondContact O-N 3.22Å; L774-W777 CarbonylContact O-C 3.24Å; L774-W777 VanDerWaalsContact O-C 3.24Å; L774-W777 PolarHBondContact O-N 3.29Å; L774-L780 HydrophobicContact CD2-CD2 4.12Å; L774-P781 HydrophobicContact CD2-CB 4.37Å; L774-P781 HydrophobicContact CD2-CG 3.69Å; L774-Y940 HydrophobicContact CB-CE1 4.22Å; L774-Y940 WeakPolarHBondContact CB-OH 3.47Å; L774-Y940 HydrophobicContact CD1-CE1 3.96Å; L774-Y940 HydrophobicContact CD2-CE1 4.48Å; L774-Y940 HydrophobicContact CG-CE1 4.45Å
775	D	59.1	Low	63.9	Low	90 Å²	90	95.7 Å²	95.7	48%	0.481	46%	0.459	S	S	.	.	H	α-helix	trans	-66.6	-28	179.6	-166.1	18.4	0	0	0	111.8	F771 W777	F771-D775 VanDerWaalsContact O-CB 3.28Å; F771-D775 WeakPolarHBondContact O-CB 3.44Å; F771-D775 PolarHBondContact O-N 2.86Å; D775-W777 VanDerWaalsContact C-N 3.31Å; D775-W777 PolarHBondContact O-N 3.24Å
776	R	61.5	Low	65.1	Low	211 Å²	211	95.8 Å²	95.8	80%	0.796	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.1	-24.7	177.4	-152.3	177.8	-72.8	-143.8	0.7	113	L774	L774-R776 PolarHBondContact O-N 3.22Å
777	W	65.9	Low	66.6	Low	180 Å²	180	95.5 Å²	95.5	68%	0.682	45%	0.454	S	S	*	.			trans	-132.7	79.1	178.7	-65.8	97.2	0	0	0	110.2	L774 D775 L779 L780 P781	L774-W777 CarbonylContact O-C 3.24Å; L774-W777 VanDerWaalsContact O-C 3.24Å; L774-W777 PolarHBondContact O-N 3.29Å; D775-W777 VanDerWaalsContact C-N 3.31Å; D775-W777 PolarHBondContact O-N 3.24Å; W777-L779 PolarHBondContact O-N 3.49Å; W777-L780 HydrophobicContact CB-CB 3.77Å; W777-L780 WeakPolarHBondContact O-CB 3.41Å; W777-L780 PolarHBondContact O-N 3.22Å; W777-P781 WeakPolarHBondContact O-CD 3.43Å
778	R	65.7	Low	68.2	Low	130 Å²	130	95.8 Å²	95.8	49%	0.491	45%	0.449	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.9	-20.3	-176.6	-65.2	-175.3	176.6	-171	-0.1	115.7
779	L	70.3	Confident	69.5	Low	117 Å²	117	89.5 Å²	89.5	61%	0.613	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88	-18.4	175.6	-72.5	166.1	0	0	0	113.5	W777 P781 L782 I783	W777-L779 PolarHBondContact O-N 3.49Å; L779-P781 VanDerWaalsContact C-CD 3.49Å; L779-L782 HydrophobicContact CD2-CD2 4.47Å; L779-L782 WeakPolarHBondContact O-CB 3.42Å; L779-L782 PolarHBondContact O-N 3.4Å; L779-I783 HydrophobicContact CB-CD1 4.29Å; L779-I783 WeakPolarHBondContact O-CG1 3.39Å; L779-I783 PolarHBondContact O-N 2.97Å
780	L	74.3	Confident	70.8	Confident	68 Å²	68	85.5 Å²	85.5	36%	0.356	41%	0.413	S	S	.	.	H	α-helix	trans	-57.3	-45.6	-178	-170	79.1	0	0	0	112.7	L774 W777 L782 I783 C784	L774-L780 HydrophobicContact CD2-CD2 4.12Å; W777-L780 HydrophobicContact CB-CB 3.77Å; W777-L780 WeakPolarHBondContact O-CB 3.41Å; W777-L780 PolarHBondContact O-N 3.22Å; L780-L782 VanDerWaalsContact C-N 3.29Å; L780-L782 PolarHBondContact O-N 2.9Å; L780-I783 PolarHBondContact O-N 3.44Å; L780-C784 WeakPolarHBondContact O-CB 3.36Å; L780-C784 PolarHBondContact O-N 3.36Å; L780-C784 PolarHBondContact O-SG 2.98Å
781	P	71.5	Confident	72.3	Confident	7 Å²	7	82.3 Å²	82.3	5%	0.045	40%	0.399	C	S	.	.	H	α-helix	trans	-59.9	-39.8	177.9	-19.2	29.8	0	0	0	112.5	L774 W777 L779 C784 L785 Y940 I941	L774-P781 HydrophobicContact CD2-CB 4.37Å; L774-P781 HydrophobicContact CD2-CG 3.69Å; W777-P781 WeakPolarHBondContact O-CD 3.43Å; L779-P781 VanDerWaalsContact C-CD 3.49Å; P781-C784 PolarHBondContact O-N 3.02Å; P781-L785 WeakPolarHBondContact O-CB 3.37Å; P781-L785 PolarHBondContact O-N 3.28Å; P781-Y940 HydrophobicContact CB-CD1 4.31Å; P781-Y940 HydrophobicContact CB-CE1 4.11Å; P781-Y940 HydrophobicContact CG-CD1 4.44Å; P781-Y940 HydrophobicContact CG-CE1 3.75Å; P781-I941 HydrophobicContact CB-CD1 4.04Å; P781-I941 HydrophobicContact CB-CG1 3.62Å; P781-I941 WeakPolarHBondContact O-CD1 3.46Å
782	L	73.4	Confident	73.7	Confident	48 Å²	48	77.6 Å²	77.6	25%	0.251	38%	0.379	S	S	.	.	H	α-helix	trans	-65.5	-45.7	177.1	-174.4	80.7	0	0	0	110.9	L779 L780 C784 L785 V786 W945	L779-L782 HydrophobicContact CD2-CD2 4.47Å; L779-L782 WeakPolarHBondContact O-CB 3.42Å; L779-L782 PolarHBondContact O-N 3.4Å; L780-L782 VanDerWaalsContact C-N 3.29Å; L780-L782 PolarHBondContact O-N 2.9Å; L782-C784 VanDerWaalsContact C-N 3.29Å; L782-C784 PolarHBondContact O-N 2.9Å; L782-L785 PolarHBondContact O-N 3.42Å; L782-L785 VanDerWaalsContact O-N 3.17Å; L782-V786 VanDerWaalsContact O-CG2 3.27Å; L782-V786 WeakPolarHBondContact O-CG2 3.45Å; L782-V786 PolarHBondContact O-N 2.88Å; L782-W945 HydrophobicContact CD1-CH2 4.1Å; L782-W945 HydrophobicContact CD1-CZ2 3.72Å; L782-W945 HydrophobicContact CD2-CH2 4.33Å; L782-W945 HydrophobicContact CD2-CZ2 3.94Å; L782-W945 HydrophobicContact CG-CZ2 4.27Å
783	I	80.2	Confident	74.8	Confident	105 Å²	105	74.6 Å²	74.6	54%	0.538	36%	0.358	S	S	.	.	H	α-helix	trans	-60.6	-43.3	177.1	-66	165	0	0	0	109.9	L779 L780 V786 F787	L779-I783 HydrophobicContact CB-CD1 4.29Å; L779-I783 WeakPolarHBondContact O-CG1 3.39Å; L779-I783 PolarHBondContact O-N 2.97Å; L780-I783 PolarHBondContact O-N 3.44Å; I783-V786 PolarHBondContact O-N 3.22Å; I783-F787 WeakPolarHBondContact O-CB 3.42Å; I783-F787 PolarHBondContact O-N 3.36Å
784	C	81.8	Confident	76.1	Confident	57 Å²	57	73.5 Å²	73.5	39%	0.385	35%	0.352	S	S	.	.	H	α-helix	trans	-61.1	-43.4	174.3	-69.8	0	0	0	0	111.9	L780 P781 L782 F787 Y788	L780-C784 WeakPolarHBondContact O-CB 3.36Å; L780-C784 PolarHBondContact O-N 3.36Å; L780-C784 PolarHBondContact O-SG 2.98Å; P781-C784 PolarHBondContact O-N 3.02Å; L782-C784 VanDerWaalsContact C-N 3.29Å; L782-C784 PolarHBondContact O-N 2.9Å; C784-F787 PolarHBondContact O-N 3.14Å; C784-Y788 WeakPolarHBondContact O-CB 3.29Å; C784-Y788 PolarHBondContact O-N 3.37Å
785	L	79.9	Confident	77.4	Confident	9 Å²	9	75.6 Å²	75.6	5%	0.047	36%	0.362	C	S	.	.	H	α-helix	trans	-66.1	-40.6	178.2	-175.3	71	0	0	0	112.1	P781 L782 Y788 S789 C894 L937 L938 I941	P781-L785 WeakPolarHBondContact O-CB 3.37Å; P781-L785 PolarHBondContact O-N 3.28Å; L782-L785 PolarHBondContact O-N 3.42Å; L782-L785 VanDerWaalsContact O-N 3.17Å; L785-Y788 PolarHBondContact O-N 3.14Å; L785-S789 WeakPolarHBondContact O-CB 3.33Å; L785-S789 PolarHBondContact O-N 3.27Å; L785-S789 PolarHBondContact O-OG 2.93Å; L785-C894 HydrophobicContact CD1-CB 4.41Å; L785-L937 HydrophobicContact CB-CD2 4.31Å; L785-L937 HydrophobicContact CD1-CD2 4.15Å; L785-L937 HydrophobicContact CD1-CG 4.49Å; L785-L938 HydrophobicContact CD2-CD1 4.04Å; L785-I941 HydrophobicContact CB-CD1 3.66Å; L785-I941 HydrophobicContact CD2-CD1 3.76Å; L785-I941 HydrophobicContact CG-CD1 4.17Å
786	V	81.5	Confident	78.5	Confident	78 Å²	78	71.3 Å²	71.3	47%	0.473	34%	0.34	S	S	.	.	H	α-helix	trans	-62.3	-49.3	175.7	172.6	0	0	0	0	109.6	L782 I783 Y788 S789 L790	L782-V786 VanDerWaalsContact O-CG2 3.27Å; L782-V786 WeakPolarHBondContact O-CG2 3.45Å; L782-V786 PolarHBondContact O-N 2.88Å; I783-V786 PolarHBondContact O-N 3.22Å; V786-Y788 VanDerWaalsContact C-N 3.34Å; V786-Y788 PolarHBondContact O-N 3.44Å; V786-S789 PolarHBondContact O-N 3.41Å; V786-L790 HydrophobicContact CG1-CD1 4.11Å; V786-L790 HydrophobicContact CG1-CG 4.5Å; V786-L790 VanDerWaalsContact O-CG 3.29Å; V786-L790 WeakPolarHBondContact O-CG 3.34Å; V786-L790 PolarHBondContact O-N 3.01Å
787	F	85.8	Confident	79.2	Confident	139 Å²	139	63.6 Å²	63.6	61%	0.61	31%	0.314	S	S	*	.	H	α-helix	trans	-62.2	-42	177	-171.7	-100.3	0	0	0	112.1	I783 C784 S789 L790 C791	I783-F787 WeakPolarHBondContact O-CB 3.42Å; I783-F787 PolarHBondContact O-N 3.36Å; C784-F787 PolarHBondContact O-N 3.14Å; F787-S789 VanDerWaalsContact C-N 3.31Å; F787-S789 PolarHBondContact O-N 3.4Å; F787-L790 PolarHBondContact O-N 2.94Å; F787-C791 WeakPolarHBondContact CE1-SG 3.4Å; F787-C791 WeakPolarHBondContact O-CB 3.49Å; F787-C791 PolarHBondContact O-N 2.9Å; F787-C791 PolarHBondContact O-SG 3.24Å; F787-C791 VanDerWaalsContact O-SG 3.34Å
788	Y	86.8	Confident	79.8	Confident	47 Å²	47	60.9 Å²	60.9	18%	0.184	31%	0.312	C	S	.	.	H	α-helix	trans	-61.1	-39.8	175.9	-171.2	-105	0	0	0	112.1	C784 L785 V786 G792 Y930 L933	C784-Y788 WeakPolarHBondContact O-CB 3.29Å; C784-Y788 PolarHBondContact O-N 3.37Å; L785-Y788 PolarHBondContact O-N 3.14Å; V786-Y788 VanDerWaalsContact C-N 3.34Å; V786-Y788 PolarHBondContact O-N 3.44Å; Y788-G792 PolarHBondContact O-N 3.18Å; Y788-Y930 VanDerWaalsContact C-OH 3.25Å; Y788-Y930 HydrophobicContact CD1-CE1 4.24Å; Y788-Y930 AromaticContact CD1-CE2 3.65Å; Y788-Y930 HydrophobicContact CD1-CE2 3.65Å; Y788-Y930 AromaticContact CD1-CZ 3.45Å; Y788-Y930 VanDerWaalsContact CD1-CZ 3.45Å; Y788-Y930 WeakPolarHBondContact CD1-OH 3.44Å; Y788-Y930 HydrophobicContact CD2-CE2 4.27Å; Y788-Y930 HydrophobicContact CE1-CD1 4.1Å; Y788-Y930 AromaticContact CE1-CD2 3.71Å; Y788-Y930 HydrophobicContact CE1-CD2 3.71Å; Y788-Y930 AromaticContact CE1-CE1 3.65Å; Y788-Y930 HydrophobicContact CE1-CE1 3.65Å; Y788-Y930 AromaticContact CE1-CE2 3.2Å; Y788-Y930 HydrophobicContact CE1-CE2 3.2Å; Y788-Y930 HydrophobicContact CE1-CG 4.12Å; Y788-Y930 AromaticContact CE1-CZ 3.15Å; Y788-Y930 WeakPolarHBondContact CE1-OH 3.32Å; Y788-Y930 HydrophobicContact CE2-CD2 4.14Å; Y788-Y930 AromaticContact CE2-CE2 3.88Å; Y788-Y930 HydrophobicContact CE2-CE2 3.88Å; Y788-Y930 HydrophobicContact CG-CE2 4.15Å; Y788-Y930 AromaticContact CZ-CD2 3.45Å; Y788-Y930 VanDerWaalsContact CZ-CD2 3.45Å; Y788-Y930 AromaticContact CZ-CE2 3.31Å; Y788-Y930 AromaticContact CZ-CZ 3.81Å; Y788-Y930 WeakPolarHBondContact O-CE2 3.44Å; Y788-Y930 PolarHBondContact O-OH 3.33Å; Y788-Y930 WeakPolarHBondContact OH-CA 3.47Å; Y788-Y930 VanDerWaalsContact OH-CD2 3.23Å; Y788-Y930 WeakPolarHBondContact OH-CD2 3.28Å; Y788-Y930 PolarHBondContact OH-O 2.68Å; Y788-L933 HydrophobicContact CE2-CB 4.39Å
789	S	83	Confident	80.2	Confident	13 Å²	13	55.7 Å²	55.7	9%	0.091	30%	0.296	C	S	.	.	H	α-helix	trans	-69	-41.4	176.2	-57.3	0	0	0	0	112.1	L785 V786 F787 G792 G793 Y930	L785-S789 WeakPolarHBondContact O-CB 3.33Å; L785-S789 PolarHBondContact O-N 3.27Å; L785-S789 PolarHBondContact O-OG 2.93Å; V786-S789 PolarHBondContact O-N 3.41Å; F787-S789 VanDerWaalsContact C-N 3.31Å; F787-S789 PolarHBondContact O-N 3.4Å; S789-G792 PolarHBondContact O-N 2.62Å; S789-G793 PolarHBondContact O-N 3.47Å; S789-Y930 VanDerWaalsContact CA-OH 3.28Å; S789-Y930 WeakPolarHBondContact CA-OH 3.31Å; S789-Y930 PolarHBondContact N-OH 3.36Å
790	L	85.6	Confident	80.2	Confident	84 Å²	84	50.6 Å²	50.6	44%	0.44	27%	0.269	S	S	.	.	H	α-helix	trans	-62.8	-49.1	175.4	-69.7	171.9	0	0	0	111.6	V786 F787 G793 L794 L887	V786-L790 HydrophobicContact CG1-CD1 4.11Å; V786-L790 HydrophobicContact CG1-CG 4.5Å; V786-L790 VanDerWaalsContact O-CG 3.29Å; V786-L790 WeakPolarHBondContact O-CG 3.34Å; V786-L790 PolarHBondContact O-N 3.01Å; F787-L790 PolarHBondContact O-N 2.94Å; L790-G793 PolarHBondContact O-N 2.91Å; L790-L794 WeakPolarHBondContact O-CG 3.45Å; L790-L794 PolarHBondContact O-N 3.29Å; L790-L887 HydrophobicContact CD2-CD2 3.69Å
791	C	87.3	Confident	79.5	Confident	44 Å²	44	48.6 Å²	48.6	30%	0.297	27%	0.265	S	S	.	.	H	α-helix	trans	-62.1	-43.3	176.8	-71.2	0	0	0	0	111.8	F787 L794 I795	F787-C791 WeakPolarHBondContact CE1-SG 3.4Å; F787-C791 WeakPolarHBondContact O-CB 3.49Å; F787-C791 PolarHBondContact O-N 2.9Å; F787-C791 PolarHBondContact O-SG 3.24Å; F787-C791 VanDerWaalsContact O-SG 3.34Å; C791-L794 PolarHBondContact O-N 3.49Å; C791-I795 WeakPolarHBondContact O-CD1 3.39Å; C791-I795 VanDerWaalsContact O-CG1 3.26Å; C791-I795 WeakPolarHBondContact O-CG1 3.03Å; C791-I795 PolarHBondContact O-N 3.49Å
792	G	84	Confident	78.7	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-58.8	-48.3	174.5	0	0	0	0	0	112	Y788 S789 L794 I795 F796	Y788-G792 PolarHBondContact O-N 3.18Å; S789-G792 PolarHBondContact O-N 2.62Å; G792-L794 PolarHBondContact O-N 2.98Å; G792-I795 PolarHBondContact O-N 2.9Å; G792-F796 WeakPolarHBondContact O-CB 3.48Å; G792-F796 WeakPolarHBondContact O-CD2 3.44Å; G792-F796 PolarHBondContact O-N 3.32Å
793	G	80.1	Confident	77.7	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-60	-41.6	177.7	0	0	0	0	0	113.3	S789 L790 D797 S886	S789-G793 PolarHBondContact O-N 3.47Å; L790-G793 PolarHBondContact O-N 2.91Å; G793-D797 WeakPolarHBondContact O-CB 3.45Å; G793-D797 PolarHBondContact O-N 2.9Å; G793-S886 WeakPolarHBondContact O-CB 3.37Å; G793-S886 PolarHBondContact O-OG 3.47Å
794	L	84.5	Confident	76.3	Confident	90 Å²	90	50 Å²	50	47%	0.471	28%	0.282	S	S	.	.	H	α-helix	trans	-65	-44.5	174.9	-74.3	167.9	0	0	0	112.2	L790 C791 G792 D797 I798 L883	L790-L794 WeakPolarHBondContact O-CG 3.45Å; L790-L794 PolarHBondContact O-N 3.29Å; C791-L794 PolarHBondContact O-N 3.49Å; G792-L794 PolarHBondContact O-N 2.98Å; L794-D797 WeakPolarHBondContact O-CB 3.3Å; L794-D797 PolarHBondContact O-N 2.82Å; L794-I798 VanDerWaalsContact O-CG1 3.3Å; L794-I798 WeakPolarHBondContact O-CG1 3.33Å; L794-I798 PolarHBondContact O-N 3.2Å; L794-L883 HydrophobicContact CD2-CD1 3.68Å
795	I	84.3	Confident	74.8	Confident	70 Å²	70	53 Å²	53	36%	0.359	29%	0.293	S	S	.	.	H	α-helix	trans	-67.1	-39.8	179.9	-65.8	163.9	0	0	0	110.8	C791 G792 D797 I798 A799 F926	C791-I795 WeakPolarHBondContact O-CD1 3.39Å; C791-I795 VanDerWaalsContact O-CG1 3.26Å; C791-I795 WeakPolarHBondContact O-CG1 3.03Å; C791-I795 PolarHBondContact O-N 3.49Å; G792-I795 PolarHBondContact O-N 2.9Å; I795-D797 VanDerWaalsContact C-N 3.34Å; I795-I798 PolarHBondContact O-N 3.02Å; I795-A799 WeakPolarHBondContact O-CB 3.2Å; I795-A799 PolarHBondContact O-N 2.91Å; I795-F926 HydrophobicContact CB-CE1 3.79Å; I795-F926 HydrophobicContact CB-CE2 4.33Å; I795-F926 HydrophobicContact CB-CZ 3.69Å; I795-F926 HydrophobicContact CD1-CE1 4.47Å; I795-F926 HydrophobicContact CD1-CE2 3.9Å; I795-F926 HydrophobicContact CD1-CZ 3.54Å; I795-F926 HydrophobicContact CG1-CZ 4.22Å; I795-F926 HydrophobicContact CG2-CD1 3.82Å; I795-F926 HydrophobicContact CG2-CD2 3.95Å; I795-F926 HydrophobicContact CG2-CE1 3.52Å; I795-F926 HydrophobicContact CG2-CE2 3.65Å; I795-F926 HydrophobicContact CG2-CG 4.05Å; I795-F926 HydrophobicContact CG2-CZ 3.44Å; I795-F926 VanDerWaalsContact CG2-CZ 3.44Å
796	F	80.3	Confident	73.3	Confident	1 Å²	1	56.3 Å²	56.3	0%	0.004	32%	0.321	C	S	.	.	H	α-helix	trans	-64.7	-38.1	173.9	-77.2	-58.5	0	0	0	112.4	G792 E800 L881 Y889 A890 F926 T927 Y930	G792-F796 WeakPolarHBondContact O-CB 3.48Å; G792-F796 WeakPolarHBondContact O-CD2 3.44Å; G792-F796 PolarHBondContact O-N 3.32Å; F796-E800 WeakPolarHBondContact O-CB 3.41Å; F796-E800 PolarHBondContact O-N 2.88Å; F796-L881 HydrophobicContact CB-CD2 4.5Å; F796-Y889 HydrophobicContact CD1-CD1 4.21Å; F796-Y889 HydrophobicContact CD1-CE1 4.11Å; F796-Y889 AromaticContact CD2-CD1 3.86Å; F796-Y889 HydrophobicContact CD2-CD1 3.86Å; F796-Y889 HydrophobicContact CD2-CE1 4.3Å; F796-Y889 HydrophobicContact CE1-CD1 4.13Å; F796-Y889 AromaticContact CE1-CE1 3.65Å; F796-Y889 HydrophobicContact CE1-CE1 3.65Å; F796-Y889 AromaticContact CE2-CD1 3.82Å; F796-Y889 HydrophobicContact CE2-CD1 3.82Å; F796-Y889 AromaticContact CE2-CE1 3.89Å; F796-Y889 HydrophobicContact CE2-CE1 3.89Å; F796-Y889 HydrophobicContact CG-CD1 4.09Å; F796-Y889 HydrophobicContact CG-CE1 4.43Å; F796-Y889 AromaticContact CZ-CD1 3.96Å; F796-Y889 HydrophobicContact CZ-CD1 3.96Å; F796-Y889 AromaticContact CZ-CE1 3.55Å; F796-Y889 HydrophobicContact CZ-CE1 3.55Å; F796-A890 HydrophobicContact CD2-CB 4.1Å; F796-A890 HydrophobicContact CE2-CB 4.22Å; F796-F926 AromaticContact CD1-CD1 3.91Å; F796-F926 HydrophobicContact CD1-CD1 3.91Å; F796-F926 HydrophobicContact CD1-CE1 4.42Å; F796-F926 HydrophobicContact CD2-CD1 4.42Å; F796-F926 HydrophobicContact CD2-CE1 4.17Å; F796-F926 AromaticContact CE1-CD1 3.46Å; F796-F926 HydrophobicContact CE1-CD1 3.46Å; F796-F926 VanDerWaalsContact CE1-CD1 3.46Å; F796-F926 HydrophobicContact CE1-CE1 4.13Å; F796-F926 HydrophobicContact CE1-CG 4.49Å; F796-F926 HydrophobicContact CE2-CD1 4.01Å; F796-F926 AromaticContact CE2-CE1 3.84Å; F796-F926 HydrophobicContact CE2-CE1 3.84Å; F796-F926 HydrophobicContact CG-CD1 4.36Å; F796-F926 HydrophobicContact CG-CE1 4.43Å; F796-F926 AromaticContact CZ-CD1 3.49Å; F796-F926 HydrophobicContact CZ-CD1 3.49Å; F796-F926 VanDerWaalsContact CZ-CD1 3.49Å; F796-F926 AromaticContact CZ-CE1 3.8Å; F796-F926 HydrophobicContact CZ-CE1 3.8Å; F796-T927 VanDerWaalsContact CE1-OG1 3.27Å; F796-T927 WeakPolarHBondContact CE1-OG1 3.42Å; F796-T927 WeakPolarHBondContact CZ-OG1 3.47Å; F796-Y930 HydrophobicContact CE2-CD1 4.38Å
797	D	76.6	Confident	71.7	Confident	49 Å²	49	59 Å²	59	26%	0.262	32%	0.323	S	S	.	.	H	α-helix	trans	-63.7	-41.1	174.2	-166.4	46.3	0	0	0	111.4	G793 L794 I795 G801	G793-D797 WeakPolarHBondContact O-CB 3.45Å; G793-D797 PolarHBondContact O-N 2.9Å; L794-D797 WeakPolarHBondContact O-CB 3.3Å; L794-D797 PolarHBondContact O-N 2.82Å; I795-D797 VanDerWaalsContact C-N 3.34Å; D797-G801 WeakPolarHBondContact O-CA 3.47Å; D797-G801 PolarHBondContact O-N 3.26Å
798	I	78.3	Confident	70	Confident	123 Å²	123	62.1 Å²	62.1	63%	0.631	33%	0.331	S	S	*	.	H	α-helix	trans	-69.1	-46.2	176.3	-66.8	164.6	0	0	0	111.3	L794 I795 E800	L794-I798 VanDerWaalsContact O-CG1 3.3Å; L794-I798 WeakPolarHBondContact O-CG1 3.33Å; L794-I798 PolarHBondContact O-N 3.2Å; I795-I798 PolarHBondContact O-N 3.02Å; I798-E800 PolarHBondContact O-N 3.01Å
799	A	74.8	Confident	68	Low	20 Å²	20	65.4 Å²	65.4	17%	0.165	36%	0.359	C	S	.	.	H	α-helix	trans	-65.3	-38.7	-176.4	0	0	0	0	0	112.5	I795 L922	I795-A799 WeakPolarHBondContact O-CB 3.2Å; I795-A799 PolarHBondContact O-N 2.91Å; A799-L922 HydrophobicContact CB-CD2 3.7Å
800	E	70.5	Confident	66.3	Low	10 Å²	10	66.8 Å²	66.8	5%	0.047	37%	0.366	C	S	.	.	H	α-helix	trans	-96.7	-16.3	179.3	-64.3	-74.2	144.9	0	0	112.8	F796 I798 N802 A803 A804 L881 P918 S919 T920	F796-E800 WeakPolarHBondContact O-CB 3.41Å; F796-E800 PolarHBondContact O-N 2.88Å; I798-E800 PolarHBondContact O-N 3.01Å; E800-N802 VanDerWaalsContact C-N 3.3Å; E800-N802 PolarHBondContact O-N 2.83Å; E800-A803 WeakPolarHBondContact O-CA 3.44Å; E800-A803 WeakPolarHBondContact O-CB 3.46Å; E800-A803 PolarHBondContact O-N 3.34Å; E800-A804 PolarHBondContact O-N 2.94Å; E800-L881 HydrophobicContact CB-CD2 3.91Å; E800-L881 HydrophobicContact CG-CD2 3.98Å; E800-P918 WeakPolarHBondContact OE1-CA 3.32Å; E800-P918 WeakPolarHBondContact OE1-CB 3.2Å; E800-S919 VanDerWaalsContact CD-N 3.32Å; E800-S919 PolarHBondContact OE1-N 2.99Å; E800-S919 WeakPolarHBondContact OE2-CB 3.41Å; E800-S919 PolarHBondContact OE2-N 3.39Å; E800-S919 PolarHBondContact OE2-OG 3.42Å; E800-T920 WeakPolarHBondContact OE1-CB 3.47Å; E800-T920 WeakPolarHBondContact OE1-CG2 3.27Å; E800-T920 PolarHBondContact OE1-N 2.8Å; E800-T920 PolarHBondContact OE1-OG1 3.35Å
801	G	60.3	Low	64.6	Low	26 Å²	26	68 Å²	68	27%	0.268	38%	0.378	S	S	.	.	H	α-helix	trans	-61.1	-34.2	-177.2	0	0	0	0	0	113.7	D797 A803 A804 L805	D797-G801 WeakPolarHBondContact O-CA 3.47Å; D797-G801 PolarHBondContact O-N 3.26Å; G801-A803 VanDerWaalsContact C-N 3.3Å; G801-A803 PolarHBondContact O-N 3.47Å; G801-A804 WeakPolarHBondContact O-CB 3.33Å; G801-A804 PolarHBondContact O-N 3.44Å; G801-L805 PolarHBondContact O-N 3.14Å
802	N	54.6	Low	62.7	Low	137 Å²	137	71.6 Å²	71.6	73%	0.733	39%	0.391	S	S	*	.	H	α-helix	trans	-66.7	-30.1	173.5	-80.8	-12.8	0	0	0	112.7	E800 A804	E800-N802 VanDerWaalsContact C-N 3.3Å; E800-N802 PolarHBondContact O-N 2.83Å; N802-A804 VanDerWaalsContact C-N 3.34Å
803	A	52.5	Low	60.9	Low	26 Å²	26	73.9 Å²	73.9	22%	0.215	41%	0.41	C	S	.	.	H	α-helix	trans	-79.6	-15.9	175.6	0	0	0	0	0	113.2	E800 G801 R807 T920	E800-A803 WeakPolarHBondContact O-CA 3.44Å; E800-A803 WeakPolarHBondContact O-CB 3.46Å; E800-A803 PolarHBondContact O-N 3.34Å; G801-A803 VanDerWaalsContact C-N 3.3Å; G801-A803 PolarHBondContact O-N 3.47Å; A803-R807 PolarHBondContact O-NE 3.19Å; A803-T920 HydrophobicContact CB-CG2 4.22Å
804	A	50.9	Low	59.3	Low	28 Å²	28	78.8 Å²	78.8	23%	0.231	44%	0.44	C	S	.	.	H	α-helix	trans	-81.3	-33.2	171.9	0	0	0	0	0	112.1	E800 G801 N802 R807	E800-A804 PolarHBondContact O-N 2.94Å; G801-A804 WeakPolarHBondContact O-CB 3.33Å; G801-A804 PolarHBondContact O-N 3.44Å; N802-A804 VanDerWaalsContact C-N 3.34Å; A804-R807 PolarHBondContact O-N 3.43Å
805	L	49.2	Very low	57.8	Low	119 Å²	119	78.3 Å²	78.3	62%	0.623	45%	0.449	S	S	*	.	H	α-helix	trans	-65	-39.6	174.7	-141.3	90.5	0	0	0	111.7	G801 R807 R808	G801-L805 PolarHBondContact O-N 3.14Å; L805-R807 PolarHBondContact O-N 2.91Å; L805-R808 PolarHBondContact O-N 3.25Å
806	A	47.8	Very low	56.3	Low	78 Å²	78	76.8 Å²	76.8	65%	0.645	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-22.4	178.6	0	0	0	0	0	114.2
807	R	49.4	Very low	54.7	Low	134 Å²	134	84 Å²	84	51%	0.506	47%	0.473	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.6	-14.3	-179.6	-83.4	-178.5	-83	164.2	-7.7	114.6	A803 A804 L805 C809	A803-R807 PolarHBondContact O-NE 3.19Å; A804-R807 PolarHBondContact O-N 3.43Å; L805-R807 PolarHBondContact O-N 2.91Å; R807-C809 PolarHBondContact O-N 3.43Å
808	R	49.1	Very low	53.6	Low	205 Å²	205	85.7 Å²	85.7	77%	0.774	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71	-7.4	180	-79.8	-177.6	178.9	-177.2	1.6	114.5	L805 N810	L805-R808 PolarHBondContact O-N 3.25Å; R808-N810 VanDerWaalsContact C-N 3.29Å; R808-N810 PolarHBondContact O-N 3.24Å
809	C	45.1	Very low	52.9	Low	116 Å²	116	83.7 Å²	83.7	78%	0.784	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81	8.7	-179.4	-66.3	0	0	0	0	115.2	R807	R807-C809 PolarHBondContact O-N 3.43Å
810	N	47.8	Very low	52.1	Low	43 Å²	43	83.9 Å²	83.9	23%	0.23	48%	0.478	C	S	.	.			trans	-125.1	97.3	-176.3	-149.1	-6.4	0	0	0	113.5	R808 E812 S869	R808-N810 VanDerWaalsContact C-N 3.29Å; R808-N810 PolarHBondContact O-N 3.24Å; N810-E812 PolarHBondContact O-N 2.81Å; N810-S869 PolarHBondContact ND2-O 3.04Å; N810-S869 VanDerWaalsContact ND2-O 3.12Å; N810-S869 PolarHBondContact ND2-OG 2.9Å; N810-S869 PolarHBondContact OD1-OG 3.49Å; N810-S869 VanDerWaalsContact OD1-OG 3.06Å
811	P	49	Very low	51.7	Low	108 Å²	108	87 Å²	87	70%	0.701	50%	0.501	S	S	*	.	S	Bend	trans	-76.3	-16.1	-171.4	26.8	-31.8	0	0	0	115.8
812	E	46.8	Very low	52.3	Low	120 Å²	120	91.9 Å²	91.9	56%	0.561	52%	0.515	S	S	*	.	G	3₁₀ helix	trans	-84.1	-23.3	-172	-66.6	-179.4	160.3	0	0	114.3	N810 V814	N810-E812 PolarHBondContact O-N 2.81Å; E812-V814 VanDerWaalsContact C-N 3.25Å; E812-V814 PolarHBondContact O-N 2.62Å
813	A	46	Very low	53.3	Low	48 Å²	48	87.7 Å²	87.7	40%	0.397	49%	0.489	S	S	.	.	G	3₁₀ helix	trans	-72.4	-14.6	-178.9	0	0	0	0	0	114.4
814	V	47.3	Very low	54.2	Low	103 Å²	103	91.5 Å²	91.5	62%	0.624	50%	0.501	S	S	*	.	G	3₁₀ helix	trans	-82.2	-23.1	-173.6	-179.6	0	0	0	0	112.5	E812	E812-V814 VanDerWaalsContact C-N 3.25Å; E812-V814 PolarHBondContact O-N 2.62Å
815	A	52.1	Low	55.3	Low	81 Å²	81	99.3 Å²	99.3	67%	0.669	52%	0.524	S	S	*	.	S	Bend	trans	-78.8	-17.2	-175.8	0	0	0	0	0	114.6
816	F	54.1	Low	56.7	Low	38 Å²	38	97 Å²	97	17%	0.167	51%	0.511	C	S	.	.	S	Bend	trans	-87	-18.6	-170.5	-171.4	-119.5	0	0	0	115.2	G862 W863 C866	F816-G862 VanDerWaalsContact CD2-O 3.24Å; F816-G862 WeakPolarHBondContact CD2-O 3.5Å; F816-G862 WeakPolarHBondContact CE1-O 3.37Å; F816-G862 WeakPolarHBondContact CE2-O 3.41Å; F816-G862 VanDerWaalsContact CZ-O 3.27Å; F816-G862 WeakPolarHBondContact CZ-O 3.36Å; F816-W863 AromaticContact CE1-CD1 3.9Å; F816-W863 HydrophobicContact CE1-CG 4.44Å; F816-C866 WeakPolarHBondContact CB-SG 3.42Å
817	Q	47.3	Very low	58.3	Low	151 Å²	151	94 Å²	94	71%	0.706	48%	0.483	S	S	*	.	H	α-helix	trans	-56.8	-41.6	-174.2	-89.9	179.5	-30.3	0	0	117.2	N819	Q817-N819 PolarHBondContact O-N 2.89Å
818	P	53.7	Low	59.7	Low	85 Å²	85	91.2 Å²	91.2	55%	0.552	48%	0.482	S	S	*	.	H	α-helix	trans	-70.5	-29.4	-173.4	20	-25.5	0	0	0	114.1	S821	P818-S821 PolarHBondContact O-OG 3.31Å
819	N	62.1	Low	61.1	Low	81 Å²	81	87.2 Å²	87.2	43%	0.433	47%	0.473	S	S	.	.	H	α-helix	trans	-75	-29.5	-172.4	-75.7	-16	0	0	0	114.4	Q817 S821 F822 Y823	Q817-N819 PolarHBondContact O-N 2.89Å; N819-S821 VanDerWaalsContact C-N 3.3Å; N819-S821 PolarHBondContact O-N 2.98Å; N819-F822 PolarHBondContact O-N 2.78Å; N819-Y823 HydrophobicContact CB-CE2 4.05Å; N819-Y823 WeakPolarHBondContact O-CD2 3.49Å; N819-Y823 WeakPolarHBondContact O-CE2 3.46Å; N819-Y823 PolarHBondContact O-N 3.2Å
820	S	59.3	Low	63	Low	25 Å²	25	87.8 Å²	87.8	18%	0.175	46%	0.459	C	S	.	.	H	α-helix	trans	-66.2	-32.4	-178.1	78.9	0	0	0	0	113.4	K824	S820-K824 PolarHBondContact O-N 3.38Å
821	S	60.6	Low	64.6	Low	76 Å²	76	88.4 Å²	88.4	53%	0.531	46%	0.462	S	S	.	.	H	α-helix	trans	-68.6	-37.3	179.3	69.8	0	0	0	0	112.1	P818 N819 R825	P818-S821 PolarHBondContact O-OG 3.31Å; N819-S821 VanDerWaalsContact C-N 3.3Å; N819-S821 PolarHBondContact O-N 2.98Å; S821-R825 PolarHBondContact O-N 3.26Å
822	F	73.4	Confident	66.1	Low	128 Å²	128	85.8 Å²	85.8	56%	0.561	45%	0.449	S	S	*	.	H	α-helix	trans	-63.6	-47.4	177.9	177.7	-96.2	0	0	0	111.8	N819 K824 R825 H826	N819-F822 PolarHBondContact O-N 2.78Å; F822-K824 PolarHBondContact O-N 3.35Å; F822-R825 PolarHBondContact O-N 2.91Å; F822-H826 PolarHBondContact O-N 3.49Å; F822-H826 VanDerWaalsContact O-N 3.08Å
823	Y	75.8	Confident	67.9	Low	48 Å²	48	84.3 Å²	84.3	19%	0.188	44%	0.442	C	S	.	.	H	α-helix	trans	-65.2	-40.7	-179.9	-58.8	-50.6	0	0	0	112.7	N819 R825 H826 L827 W854 F855 R858 M859	N819-Y823 HydrophobicContact CB-CE2 4.05Å; N819-Y823 WeakPolarHBondContact O-CD2 3.49Å; N819-Y823 WeakPolarHBondContact O-CE2 3.46Å; N819-Y823 PolarHBondContact O-N 3.2Å; Y823-R825 VanDerWaalsContact C-N 3.35Å; Y823-R825 PolarHBondContact O-N 3.45Å; Y823-H826 PolarHBondContact O-N 3.01Å; Y823-L827 PolarHBondContact O-N 3.02Å; Y823-W854 HydrophobicContact CD1-CH2 4.15Å; Y823-F855 WeakPolarHBondContact O-CD2 3.34Å; Y823-R858 HydrophobicContact CD1-CB 3.75Å; Y823-R858 HydrophobicContact CD1-CG 4.4Å; Y823-R858 HydrophobicContact CD2-CB 4.3Å; Y823-R858 HydrophobicContact CE1-CB 3.71Å; Y823-R858 HydrophobicContact CE1-CG 4.11Å; Y823-R858 HydrophobicContact CE2-CB 4.24Å; Y823-R858 WeakPolarHBondContact CE2-O 3.4Å; Y823-R858 HydrophobicContact CG-CB 4.07Å; Y823-M859 HydrophobicContact CD2-SD 4.4Å
824	K	71.3	Confident	69.7	Low	107 Å²	107	82.8 Å²	82.8	47%	0.465	43%	0.428	S	S	.	.	H	α-helix	trans	-59.6	-45.8	176.2	-76.1	-178	-179.9	-177	0	111.3	S820 F822 H826 L827 T828 F855	S820-K824 PolarHBondContact O-N 3.38Å; F822-K824 PolarHBondContact O-N 3.35Å; K824-H826 VanDerWaalsContact C-N 3.33Å; K824-H826 PolarHBondContact O-N 3.25Å; K824-L827 PolarHBondContact O-N 3.38Å; K824-T828 PolarHBondContact O-N 3.38Å; K824-T828 PolarHBondContact O-OG1 2.9Å; K824-F855 HydrophobicContact CB-CE2 4.28Å; K824-F855 HydrophobicContact CG-CE2 3.71Å; K824-F855 HydrophobicContact CG-CZ 3.85Å
825	R	73.2	Confident	71.1	Confident	191 Å²	191	84 Å²	84	72%	0.721	43%	0.43	S	S	*	.	H	α-helix	trans	-64.7	-35.5	179.6	-166.2	173.2	-175.5	161	2.6	112.6	S821 F822 Y823 T828 M829	S821-R825 PolarHBondContact O-N 3.26Å; F822-R825 PolarHBondContact O-N 2.91Å; Y823-R825 VanDerWaalsContact C-N 3.35Å; Y823-R825 PolarHBondContact O-N 3.45Å; R825-T828 WeakPolarHBondContact CA-OG1 3.46Å; R825-T828 PolarHBondContact O-OG1 3.26Å; R825-M829 VanDerWaalsContact O-CG 3.26Å; R825-M829 WeakPolarHBondContact O-CG 3.4Å; R825-M829 PolarHBondContact O-N 3.31Å
826	H	79.3	Confident	72.4	Confident	72 Å²	72	85.8 Å²	85.8	33%	0.333	43%	0.432	S	S	.	.	H	α-helix	trans	-71.4	-39.2	177.4	-161.2	86.1	0	0	0	112.5	F822 Y823 K824 T828 M829 R830 W854	F822-H826 PolarHBondContact O-N 3.49Å; F822-H826 VanDerWaalsContact O-N 3.08Å; Y823-H826 PolarHBondContact O-N 3.01Å; K824-H826 VanDerWaalsContact C-N 3.33Å; K824-H826 PolarHBondContact O-N 3.25Å; H826-T828 PolarHBondContact O-N 3.1Å; H826-M829 PolarHBondContact O-N 3.36Å; H826-R830 PolarHBondContact O-N 3.21Å; H826-W854 HydrophobicContact CB-CH2 3.49Å; H826-W854 VanDerWaalsContact CB-CH2 3.49Å; H826-W854 HydrophobicContact CB-CZ2 4.45Å; H826-W854 HydrophobicContact CB-CZ3 3.8Å; H826-W854 AromaticContact CD2-CE2 3.92Å; H826-W854 AromaticContact CD2-CH2 3.1Å; H826-W854 WeakPolarHBondContact CD2-CH2 3.4Å; H826-W854 AromaticContact CD2-CZ2 3.3Å; H826-W854 WeakPolarHBondContact CD2-CZ2 3.31Å; H826-W854 AromaticContact CD2-CZ3 3.51Å; H826-W854 AromaticContact CG-CH2 3.43Å; H826-W854 VanDerWaalsContact CG-CH2 3.43Å; H826-W854 AromaticContact CG-CZ2 3.94Å; H826-W854 AromaticContact CG-CZ3 3.97Å; H826-W854 AromaticContact NE2-CZ2 3.82Å
827	L	82.6	Confident	73.6	Confident	14 Å²	14	88 Å²	88	7%	0.073	44%	0.443	C	S	.	.	H	α-helix	trans	-60.5	-45.8	174.5	176.5	64.9	0	0	0	111.5	Y823 K824 M829 R830 L831 A851 W852 F855	Y823-L827 PolarHBondContact O-N 3.02Å; K824-L827 PolarHBondContact O-N 3.38Å; L827-M829 VanDerWaalsContact C-N 3.31Å; L827-M829 PolarHBondContact O-N 3.2Å; L827-R830 PolarHBondContact O-N 3.24Å; L827-L831 HydrophobicContact CD1-CD1 3.96Å; L827-L831 HydrophobicContact CD1-CG 4.12Å; L827-L831 HydrophobicContact CD2-CD1 4.47Å; L827-L831 HydrophobicContact CG-CD1 3.93Å; L827-L831 HydrophobicContact CG-CG 4.47Å; L827-L831 PolarHBondContact O-N 2.75Å; L827-A851 HydrophobicContact CD1-CB 4.19Å; L827-A851 VanDerWaalsContact CD1-O 3.26Å; L827-A851 WeakPolarHBondContact CD1-O 3.25Å; L827-W852 HydrophobicContact CD2-CE3 3.85Å; L827-W852 HydrophobicContact CD2-CZ3 3.88Å; L827-F855 HydrophobicContact CB-CB 4.07Å; L827-F855 HydrophobicContact CB-CD2 3.9Å; L827-F855 HydrophobicContact CB-CG 4.07Å; L827-F855 HydrophobicContact CD1-CB 3.95Å; L827-F855 HydrophobicContact CD2-CB 3.89Å; L827-F855 HydrophobicContact CD2-CD1 3.68Å; L827-F855 HydrophobicContact CD2-CD2 4.03Å; L827-F855 HydrophobicContact CD2-CE1 4.19Å; L827-F855 HydrophobicContact CD2-CG 3.58Å; L827-F855 HydrophobicContact CG-CB 4.17Å; L827-F855 HydrophobicContact CG-CG 4.26Å
828	T	77.1	Confident	75	Confident	76 Å²	76	87.3 Å²	87.3	47%	0.466	45%	0.452	S	S	.	.	H	α-helix	trans	-61.5	-40	179.5	48.4	0	0	0	0	112.1	K824 R825 H826 A832	K824-T828 PolarHBondContact O-N 3.38Å; K824-T828 PolarHBondContact O-OG1 2.9Å; R825-T828 WeakPolarHBondContact CA-OG1 3.46Å; R825-T828 PolarHBondContact O-OG1 3.26Å; H826-T828 PolarHBondContact O-N 3.1Å; T828-A832 WeakPolarHBondContact O-CB 3.41Å; T828-A832 PolarHBondContact O-N 3.33Å; T828-A832 VanDerWaalsContact O-N 3.12Å
829	M	79.9	Confident	76.3	Confident	121 Å²	121	85.2 Å²	85.2	60%	0.596	44%	0.437	S	S	*	.	H	α-helix	trans	-63.7	-44.8	175.8	-70.4	-83.2	-73.7	0	0	111.4	R825 H826 L827 A832 E833	R825-M829 VanDerWaalsContact O-CG 3.26Å; R825-M829 WeakPolarHBondContact O-CG 3.4Å; R825-M829 PolarHBondContact O-N 3.31Å; H826-M829 PolarHBondContact O-N 3.36Å; L827-M829 VanDerWaalsContact C-N 3.31Å; L827-M829 PolarHBondContact O-N 3.2Å; M829-A832 PolarHBondContact O-N 3.25Å; M829-E833 PolarHBondContact O-N 2.67Å; M829-E833 VanDerWaalsContact O-N 3.11Å
830	R	83.4	Confident	77.1	Confident	128 Å²	128	87.8 Å²	87.8	48%	0.483	45%	0.451	S	S	.	.	H	α-helix	trans	-64.8	-41.6	178.6	-84.9	-63.8	-170.3	-175	8.5	113.6	H826 L827 A832 E833 I834 A851	H826-R830 PolarHBondContact O-N 3.21Å; L827-R830 PolarHBondContact O-N 3.24Å; R830-A832 VanDerWaalsContact C-N 3.32Å; R830-A832 PolarHBondContact O-N 3.28Å; R830-E833 WeakPolarHBondContact CD-OE2 3.41Å; R830-E833 IonicContact CZ-OE2 2.67Å; R830-E833 IonicContact NE-OE2 3.05Å; R830-E833 IonicContact NH1-OE2 3.83Å; R830-E833 PolarHBondContact NH1-OE2 3.04Å; R830-E833 PolarHBondContact O-N 2.79Å; R830-I834 WeakPolarHBondContact O-CD1 3.35Å; R830-I834 VanDerWaalsContact O-CG1 3.26Å; R830-I834 WeakPolarHBondContact O-CG1 3.3Å; R830-I834 PolarHBondContact O-N 2.75Å; R830-I834 VanDerWaalsContact O-N 3.14Å; R830-A851 HydrophobicContact CB-CB 4.19Å
831	L	81.5	Confident	78	Confident	55 Å²	55	91.5 Å²	91.5	29%	0.288	48%	0.477	S	S	.	.	H	α-helix	trans	-65.8	-35.6	176.5	-73.1	170.6	0	0	0	112.1	L827 I834 L835 A848 A851	L827-L831 HydrophobicContact CD1-CD1 3.96Å; L827-L831 HydrophobicContact CD1-CG 4.12Å; L827-L831 HydrophobicContact CD2-CD1 4.47Å; L827-L831 HydrophobicContact CG-CD1 3.93Å; L827-L831 HydrophobicContact CG-CG 4.47Å; L827-L831 PolarHBondContact O-N 2.75Å; L831-I834 PolarHBondContact O-N 3.46Å; L831-L835 WeakPolarHBondContact O-CG 3.36Å; L831-L835 PolarHBondContact O-N 2.9Å; L831-L835 VanDerWaalsContact O-N 3.17Å; L831-A848 HydrophobicContact CD2-CB 4.02Å; L831-A851 HydrophobicContact CD2-CB 4.42Å
832	A	81.4	Confident	78.8	Confident	54 Å²	54	92.5 Å²	92.5	45%	0.446	48%	0.484	S	S	.	.	H	α-helix	trans	-64.1	-42.6	174.8	0	0	0	0	0	112.1	T828 M829 R830 L835 T836	T828-A832 WeakPolarHBondContact O-CB 3.41Å; T828-A832 PolarHBondContact O-N 3.33Å; T828-A832 VanDerWaalsContact O-N 3.12Å; M829-A832 PolarHBondContact O-N 3.25Å; R830-A832 VanDerWaalsContact C-N 3.32Å; R830-A832 PolarHBondContact O-N 3.28Å; A832-L835 PolarHBondContact O-N 3.22Å; A832-T836 PolarHBondContact O-N 2.89Å
833	E	83.7	Confident	79.1	Confident	88 Å²	88	92.4 Å²	92.4	41%	0.411	48%	0.483	S	S	.	.	H	α-helix	trans	-58.2	-48.3	173.8	-73	174.5	179.8	0	0	111.5	M829 R830 L835 T836 E837	M829-E833 PolarHBondContact O-N 2.67Å; M829-E833 VanDerWaalsContact O-N 3.11Å; R830-E833 WeakPolarHBondContact CD-OE2 3.41Å; R830-E833 IonicContact CZ-OE2 2.67Å; R830-E833 IonicContact NE-OE2 3.05Å; R830-E833 IonicContact NH1-OE2 3.83Å; R830-E833 PolarHBondContact NH1-OE2 3.04Å; R830-E833 PolarHBondContact O-N 2.79Å; E833-L835 VanDerWaalsContact C-N 3.27Å; E833-L835 PolarHBondContact O-N 3.06Å; E833-T836 PolarHBondContact O-N 3.36Å; E833-T836 PolarHBondContact O-OG1 3.47Å; E833-E837 PolarHBondContact O-N 2.9Å
834	I	84	Confident	79.4	Confident	17 Å²	17	93 Å²	93	9%	0.087	49%	0.487	C	S	.	.	H	α-helix	trans	-61	-34.6	-178.4	-65.8	161.8	0	0	0	112.3	R830 L831 T836 K844 L847 A851	R830-I834 WeakPolarHBondContact O-CD1 3.35Å; R830-I834 VanDerWaalsContact O-CG1 3.26Å; R830-I834 WeakPolarHBondContact O-CG1 3.3Å; R830-I834 PolarHBondContact O-N 2.75Å; R830-I834 VanDerWaalsContact O-N 3.14Å; L831-I834 PolarHBondContact O-N 3.46Å; I834-T836 VanDerWaalsContact C-N 3.31Å; I834-T836 PolarHBondContact O-N 3.35Å; I834-K844 HydrophobicContact CG2-CB 4.47Å; I834-L847 HydrophobicContact CD1-CB 3.91Å; I834-L847 WeakPolarHBondContact CD1-O 3.45Å; I834-L847 HydrophobicContact CG1-CB 3.92Å; I834-L847 HydrophobicContact CG2-CB 3.77Å; I834-L847 HydrophobicContact CG2-CD1 4.42Å; I834-A851 HydrophobicContact CD1-CB 3.87Å
835	L	76.7	Confident	79.7	Confident	129 Å²	129	94.8 Å²	94.8	68%	0.675	50%	0.499	S	S	*	.	H	α-helix	trans	-66.4	-34.5	177	-75.6	165.2	0	0	0	112	L831 A832 E833 K844	L831-L835 WeakPolarHBondContact O-CG 3.36Å; L831-L835 PolarHBondContact O-N 2.9Å; L831-L835 VanDerWaalsContact O-N 3.17Å; A832-L835 PolarHBondContact O-N 3.22Å; E833-L835 VanDerWaalsContact C-N 3.27Å; E833-L835 PolarHBondContact O-N 3.06Å; L835-K844 PolarHBondContact O-NZ 2.72Å
836	T	81	Confident	80.2	Confident	117 Å²	117	90.6 Å²	90.6	72%	0.718	49%	0.49	S	S	*	.	H	α-helix	trans	-81.9	-14.5	-178.7	59	0	0	0	0	114.9	A832 E833 I834	A832-T836 PolarHBondContact O-N 2.89Å; E833-T836 PolarHBondContact O-N 3.36Å; E833-T836 PolarHBondContact O-OG1 3.47Å; I834-T836 VanDerWaalsContact C-N 3.31Å; I834-T836 PolarHBondContact O-N 3.35Å
837	E	78.5	Confident	80.5	Confident	85 Å²	85	89.5 Å²	89.5	40%	0.397	49%	0.486	S	S	.	.	S	Bend	trans	-71.9	139.9	-179.6	-67.8	-170.1	159.2	0	0	112.9	E833 V839 K844 L847	E833-E837 PolarHBondContact O-N 2.9Å; E837-V839 VanDerWaalsContact C-N 3.29Å; E837-V839 HydrophobicContact CB-CG2 3.57Å; E837-V839 PolarHBondContact O-N 3.08Å; E837-K844 WeakPolarHBondContact O-CE 3.2Å; E837-K844 PolarHBondContact O-NZ 3.39Å; E837-L847 WeakPolarHBondContact OE2-CD1 3.49Å
838	P	77.1	Confident	80.5	Confident	137 Å²	137	90.3 Å²	90.3	89%	0.89	50%	0.496	S	S	*	.			trans	-80.9	68.8	179.6	34.4	-35.1	0	0	0	111.4
839	V	79.6	Confident	80.8	Confident	40 Å²	40	94.5 Å²	94.5	24%	0.242	50%	0.503	C	S	.	.			trans	-129.1	149.8	-175.2	-146.3	0	0	0	0	112.4	E837 K843 K844	E837-V839 VanDerWaalsContact C-N 3.29Å; E837-V839 HydrophobicContact CB-CG2 3.57Å; E837-V839 PolarHBondContact O-N 3.08Å; V839-K843 HydrophobicContact CG1-CB 3.68Å; V839-K843 HydrophobicContact CG1-CD 3.45Å; V839-K843 VanDerWaalsContact CG1-CD 3.45Å; V839-K843 HydrophobicContact CG1-CG 3.67Å; V839-K844 HydrophobicContact CB-CG 4.45Å; V839-K844 VanDerWaalsContact O-CE 3.31Å; V839-K844 WeakPolarHBondContact O-CE 3.5Å
840	N	79.5	Confident	81	Confident	135 Å²	135	92.6 Å²	92.6	72%	0.722	50%	0.495	S	S	*	.			trans	-54.4	146.1	176	-70.3	-3.1	0	0	0	112.5	S842 K843 K844	N840-S842 VanDerWaalsContact C-N 3.26Å; N840-S842 PolarHBondContact O-N 3.35Å; N840-S842 VanDerWaalsContact O-N 3.12Å; N840-K843 PolarHBondContact O-N 3.15Å; N840-K844 PolarHBondContact O-N 3.45Å; N840-K844 VanDerWaalsContact O-N 3.09Å
841	S	77.3	Confident	81.1	Confident	104 Å²	104	87.1 Å²	87.1	73%	0.727	48%	0.477	S	S	*	.	H	α-helix	trans	-52.5	-37.8	-175.5	-52.6	0	0	0	0	114.2	K843 K844 M845	S841-K843 VanDerWaalsContact C-N 3.34Å; S841-K843 PolarHBondContact O-N 2.66Å; S841-K844 PolarHBondContact O-N 3.4Å; S841-M845 PolarHBondContact O-N 2.91Å
842	S	78.2	Confident	81	Confident	97 Å²	97	91.6 Å²	91.6	68%	0.678	49%	0.49	S	S	*	.	H	α-helix	trans	-63.5	-38	177	-40.7	0	0	0	0	112.7	N840 M845 L846	N840-S842 VanDerWaalsContact C-N 3.26Å; N840-S842 PolarHBondContact O-N 3.35Å; N840-S842 VanDerWaalsContact O-N 3.12Å; S842-M845 PolarHBondContact O-N 3.16Å; S842-L846 PolarHBondContact O-N 3.07Å; S842-L846 VanDerWaalsContact O-N 3.15Å
843	K	80.6	Confident	80.9	Confident	125 Å²	125	92.8 Å²	92.8	54%	0.543	49%	0.487	S	S	.	.	H	α-helix	trans	-79	-33.2	-179.7	-168.2	163.4	166.4	-169.3	0	111.6	V839 N840 S841 M845 L846 L847	V839-K843 HydrophobicContact CG1-CB 3.68Å; V839-K843 HydrophobicContact CG1-CD 3.45Å; V839-K843 VanDerWaalsContact CG1-CD 3.45Å; V839-K843 HydrophobicContact CG1-CG 3.67Å; N840-K843 PolarHBondContact O-N 3.15Å; S841-K843 VanDerWaalsContact C-N 3.34Å; S841-K843 PolarHBondContact O-N 2.66Å; K843-M845 VanDerWaalsContact C-N 3.3Å; K843-M845 PolarHBondContact O-N 2.97Å; K843-L846 WeakPolarHBondContact O-CB 3.35Å; K843-L846 PolarHBondContact O-N 2.84Å; K843-L847 WeakPolarHBondContact O-CG 3.38Å; K843-L847 PolarHBondContact O-N 3.47Å
844	K	81.2	Confident	80.9	Confident	61 Å²	61	91.7 Å²	91.7	27%	0.265	48%	0.479	S	S	.	.	H	α-helix	trans	-59.3	-41.6	167.3	-70.9	-166.9	177.5	-166.1	0	111.9	I834 L835 E837 V839 N840 S841 L847 A848	I834-K844 HydrophobicContact CG2-CB 4.47Å; L835-K844 PolarHBondContact O-NZ 2.72Å; E837-K844 WeakPolarHBondContact O-CE 3.2Å; E837-K844 PolarHBondContact O-NZ 3.39Å; V839-K844 HydrophobicContact CB-CG 4.45Å; V839-K844 VanDerWaalsContact O-CE 3.31Å; V839-K844 WeakPolarHBondContact O-CE 3.5Å; N840-K844 PolarHBondContact O-N 3.45Å; N840-K844 VanDerWaalsContact O-N 3.09Å; S841-K844 PolarHBondContact O-N 3.4Å; K844-L847 PolarHBondContact O-N 3.49Å; K844-A848 WeakPolarHBondContact O-CB 3.28Å; K844-A848 PolarHBondContact O-N 3.22Å
845	M	76.9	Confident	80.6	Confident	145 Å²	145	92.1 Å²	92.1	71%	0.714	48%	0.48	S	S	*	.	H	α-helix	trans	-66.9	-35.8	178.1	-164.2	158.2	71.8	0	0	112.5	S841 S842 K843 R849	S841-M845 PolarHBondContact O-N 2.91Å; S842-M845 PolarHBondContact O-N 3.16Å; K843-M845 VanDerWaalsContact C-N 3.3Å; K843-M845 PolarHBondContact O-N 2.97Å; M845-R849 WeakPolarHBondContact O-CB 3.39Å; M845-R849 PolarHBondContact O-N 3.42Å; M845-R849 VanDerWaalsContact O-N 3.09Å
846	L	84.3	Confident	80.4	Confident	103 Å²	103	88.3 Å²	88.3	54%	0.539	46%	0.462	S	S	.	.	H	α-helix	trans	-64.3	-50.6	172.9	-164	89.7	0	0	0	111.7	S842 K843 A848 R849 D850	S842-L846 PolarHBondContact O-N 3.07Å; S842-L846 VanDerWaalsContact O-N 3.15Å; K843-L846 WeakPolarHBondContact O-CB 3.35Å; K843-L846 PolarHBondContact O-N 2.84Å; L846-A848 VanDerWaalsContact C-N 3.31Å; L846-A848 PolarHBondContact O-N 3.38Å; L846-R849 WeakPolarHBondContact O-CB 3.39Å; L846-R849 PolarHBondContact O-N 3.09Å; L846-R849 VanDerWaalsContact O-N 3.11Å; L846-D850 PolarHBondContact O-N 3.2Å
847	L	85.5	Confident	80	Confident	48 Å²	48	88.5 Å²	88.5	25%	0.251	46%	0.455	S	S	.	.	H	α-helix	trans	-61.2	-39.6	178.5	-70.9	166.5	0	0	0	112.2	I834 E837 K843 K844 R849 D850 A851	I834-L847 HydrophobicContact CD1-CB 3.91Å; I834-L847 WeakPolarHBondContact CD1-O 3.45Å; I834-L847 HydrophobicContact CG1-CB 3.92Å; I834-L847 HydrophobicContact CG2-CB 3.77Å; I834-L847 HydrophobicContact CG2-CD1 4.42Å; E837-L847 WeakPolarHBondContact OE2-CD1 3.49Å; K843-L847 WeakPolarHBondContact O-CG 3.38Å; K843-L847 PolarHBondContact O-N 3.47Å; K844-L847 PolarHBondContact O-N 3.49Å; L847-R849 VanDerWaalsContact C-N 3.3Å; L847-R849 PolarHBondContact O-N 3.01Å; L847-D850 PolarHBondContact O-N 2.86Å; L847-A851 PolarHBondContact O-N 3.23Å
848	A	82.9	Confident	79.5	Confident	32 Å²	32	88.7 Å²	88.7	26%	0.264	45%	0.452	S	S	.	.	H	α-helix	trans	-64.1	-36.7	176	0	0	0	0	0	112	L831 K844 L846 W852	L831-A848 HydrophobicContact CD2-CB 4.02Å; K844-A848 WeakPolarHBondContact O-CB 3.28Å; K844-A848 PolarHBondContact O-N 3.22Å; L846-A848 VanDerWaalsContact C-N 3.31Å; L846-A848 PolarHBondContact O-N 3.38Å; A848-W852 WeakPolarHBondContact O-CB 3.31Å; A848-W852 PolarHBondContact O-N 2.96Å; A848-W852 VanDerWaalsContact O-N 3.08Å
849	R	82.8	Confident	79	Confident	163 Å²	163	83.8 Å²	83.8	62%	0.615	42%	0.418	S	S	*	.	H	α-helix	trans	-65.3	-42.4	174.3	177.6	-178.9	166.3	158.6	-0.3	111.8	M845 L846 L847 W852 Q853	M845-R849 WeakPolarHBondContact O-CB 3.39Å; M845-R849 PolarHBondContact O-N 3.42Å; M845-R849 VanDerWaalsContact O-N 3.09Å; L846-R849 WeakPolarHBondContact O-CB 3.39Å; L846-R849 PolarHBondContact O-N 3.09Å; L846-R849 VanDerWaalsContact O-N 3.11Å; L847-R849 VanDerWaalsContact C-N 3.3Å; L847-R849 PolarHBondContact O-N 3.01Å; R849-W852 WeakPolarHBondContact O-CB 3.22Å; R849-W852 PolarHBondContact O-N 3.39Å; R849-Q853 PolarHBondContact O-N 2.92Å
850	D	85	Confident	77.9	Confident	81 Å²	81	87.8 Å²	87.8	43%	0.433	43%	0.433	S	S	.	.	H	α-helix	trans	-66	-43.6	178.4	-69.1	-8	0	0	0	111.9	L846 L847 W852 Q853 W854	L846-D850 PolarHBondContact O-N 3.2Å; L847-D850 PolarHBondContact O-N 2.86Å; D850-W852 VanDerWaalsContact C-N 3.28Å; D850-W852 PolarHBondContact O-N 3.37Å; D850-Q853 PolarHBondContact O-N 2.89Å; D850-W854 PolarHBondContact O-N 3.4Å
851	A	84.4	Confident	76.9	Confident	13 Å²	13	86.8 Å²	86.8	11%	0.107	43%	0.432	C	S	.	.	H	α-helix	trans	-60.7	-39.5	174.9	0	0	0	0	0	111.8	L827 R830 L831 I834 L847 F855	L827-A851 HydrophobicContact CD1-CB 4.19Å; L827-A851 VanDerWaalsContact CD1-O 3.26Å; L827-A851 WeakPolarHBondContact CD1-O 3.25Å; R830-A851 HydrophobicContact CB-CB 4.19Å; L831-A851 HydrophobicContact CD2-CB 4.42Å; I834-A851 HydrophobicContact CD1-CB 3.87Å; L847-A851 PolarHBondContact O-N 3.23Å; A851-F855 PolarHBondContact O-N 2.98Å
852	W	79.8	Confident	75.8	Confident	149 Å²	149	82.3 Å²	82.3	56%	0.564	40%	0.402	S	S	*	.	H	α-helix	trans	-64.3	-44.5	175.1	-172.4	-97.4	0	0	0	112.2	L827 A848 R849 D850 W854 F855 T856	L827-W852 HydrophobicContact CD2-CE3 3.85Å; L827-W852 HydrophobicContact CD2-CZ3 3.88Å; A848-W852 WeakPolarHBondContact O-CB 3.31Å; A848-W852 PolarHBondContact O-N 2.96Å; A848-W852 VanDerWaalsContact O-N 3.08Å; R849-W852 WeakPolarHBondContact O-CB 3.22Å; R849-W852 PolarHBondContact O-N 3.39Å; D850-W852 VanDerWaalsContact C-N 3.28Å; D850-W852 PolarHBondContact O-N 3.37Å; W852-W854 PolarHBondContact O-N 3.49Å; W852-F855 PolarHBondContact O-N 3.48Å; W852-T856 PolarHBondContact O-N 3.41Å; W852-T856 PolarHBondContact O-OG1 2.98Å; W852-T856 VanDerWaalsContact O-OG1 3.12Å
853	Q	80.4	Confident	74.4	Confident	80 Å²	80	82.2 Å²	82.2	37%	0.374	39%	0.387	S	S	.	.	H	α-helix	trans	-59.4	-46.7	176.4	-83	-174.9	-42.7	0	0	112.3	R849 D850 F855 T856 E857	R849-Q853 PolarHBondContact O-N 2.92Å; D850-Q853 PolarHBondContact O-N 2.89Å; Q853-F855 PolarHBondContact O-N 3.4Å; Q853-T856 VanDerWaalsContact CA-OG1 3.27Å; Q853-T856 WeakPolarHBondContact CA-OG1 3.39Å; Q853-T856 PolarHBondContact O-N 3.46Å; Q853-T856 VanDerWaalsContact O-N 3.16Å; Q853-T856 PolarHBondContact O-OG1 2.92Å; Q853-E857 WeakPolarHBondContact O-CG 3.5Å; Q853-E857 PolarHBondContact O-N 2.54Å
854	W	82.9	Confident	72.9	Confident	64 Å²	64	81.9 Å²	81.9	24%	0.242	39%	0.391	C	S	.	.	H	α-helix	trans	-53.9	-40.8	176.3	172.9	99.7	0	0	0	112.7	Y823 H826 D850 W852 R858	Y823-W854 HydrophobicContact CD1-CH2 4.15Å; H826-W854 HydrophobicContact CB-CH2 3.49Å; H826-W854 VanDerWaalsContact CB-CH2 3.49Å; H826-W854 HydrophobicContact CB-CZ2 4.45Å; H826-W854 HydrophobicContact CB-CZ3 3.8Å; H826-W854 AromaticContact CD2-CE2 3.92Å; H826-W854 AromaticContact CD2-CH2 3.1Å; H826-W854 WeakPolarHBondContact CD2-CH2 3.4Å; H826-W854 AromaticContact CD2-CZ2 3.3Å; H826-W854 WeakPolarHBondContact CD2-CZ2 3.31Å; H826-W854 AromaticContact CD2-CZ3 3.51Å; H826-W854 AromaticContact CG-CH2 3.43Å; H826-W854 VanDerWaalsContact CG-CH2 3.43Å; H826-W854 AromaticContact CG-CZ2 3.94Å; H826-W854 AromaticContact CG-CZ3 3.97Å; H826-W854 AromaticContact NE2-CZ2 3.82Å; D850-W854 PolarHBondContact O-N 3.4Å; W852-W854 PolarHBondContact O-N 3.49Å; W854-R858 VanDerWaalsContact CE2-NE 3.27Å; W854-R858 VanDerWaalsContact NE1-NE 3.19Å; W854-R858 WeakPolarHBondContact O-CD 3.13Å; W854-R858 PolarHBondContact O-N 3Å; W854-R858 PolarHBondContact O-NH1 3.15Å
855	F	78.8	Confident	71.4	Confident	27 Å²	27	82.2 Å²	82.2	12%	0.118	41%	0.405	C	S	.	.	H	α-helix	trans	-70.8	-43.2	178.9	170	-102.1	0	0	0	112	Y823 K824 L827 A851 W852 Q853 R858 M859	Y823-F855 WeakPolarHBondContact O-CD2 3.34Å; K824-F855 HydrophobicContact CB-CE2 4.28Å; K824-F855 HydrophobicContact CG-CE2 3.71Å; K824-F855 HydrophobicContact CG-CZ 3.85Å; L827-F855 HydrophobicContact CB-CB 4.07Å; L827-F855 HydrophobicContact CB-CD2 3.9Å; L827-F855 HydrophobicContact CB-CG 4.07Å; L827-F855 HydrophobicContact CD1-CB 3.95Å; L827-F855 HydrophobicContact CD2-CB 3.89Å; L827-F855 HydrophobicContact CD2-CD1 3.68Å; L827-F855 HydrophobicContact CD2-CD2 4.03Å; L827-F855 HydrophobicContact CD2-CE1 4.19Å; L827-F855 HydrophobicContact CD2-CG 3.58Å; L827-F855 HydrophobicContact CG-CB 4.17Å; L827-F855 HydrophobicContact CG-CG 4.26Å; A851-F855 PolarHBondContact O-N 2.98Å; W852-F855 PolarHBondContact O-N 3.48Å; Q853-F855 PolarHBondContact O-N 3.4Å; F855-R858 PolarHBondContact O-N 3.39Å; F855-M859 HydrophobicContact CD2-CG 4.29Å; F855-M859 HydrophobicContact CE1-CG 4.12Å; F855-M859 HydrophobicContact CE2-CG 3.79Å; F855-M859 HydrophobicContact CE2-SD 4.32Å; F855-M859 HydrophobicContact CZ-CG 3.71Å; F855-M859 HydrophobicContact CZ-SD 4.29Å; F855-M859 WeakPolarHBondContact O-CG 3.46Å; F855-M859 PolarHBondContact O-N 2.94Å; F855-M859 VanDerWaalsContact O-N 3.09Å
856	T	71.2	Confident	69.9	Low	49 Å²	49	76.5 Å²	76.5	30%	0.301	38%	0.379	S	S	.	.	H	α-helix	trans	-62.9	-43	178.3	40.6	0	0	0	0	112.4	W852 Q853 R858 M859 H860	W852-T856 PolarHBondContact O-N 3.41Å; W852-T856 PolarHBondContact O-OG1 2.98Å; W852-T856 VanDerWaalsContact O-OG1 3.12Å; Q853-T856 VanDerWaalsContact CA-OG1 3.27Å; Q853-T856 WeakPolarHBondContact CA-OG1 3.39Å; Q853-T856 PolarHBondContact O-N 3.46Å; Q853-T856 VanDerWaalsContact O-N 3.16Å; Q853-T856 PolarHBondContact O-OG1 2.92Å; T856-R858 VanDerWaalsContact C-N 3.34Å; T856-R858 PolarHBondContact O-N 2.95Å; T856-M859 PolarHBondContact O-N 2.97Å; T856-H860 PolarHBondContact O-CD2 3.43Å; T856-H860 VanDerWaalsContact O-CD2 3.24Å; T856-H860 PolarHBondContact O-N 3.4Å
857	E	73.4	Confident	67.9	Low	120 Å²	120	75.8 Å²	75.8	56%	0.561	38%	0.382	S	S	*	.	H	α-helix	trans	-58.2	-45.3	177.9	-73.9	176.9	171.3	0	0	112.2	Q853 H860 V861	Q853-E857 WeakPolarHBondContact O-CG 3.5Å; Q853-E857 PolarHBondContact O-N 2.54Å; E857-H860 PolarHBondContact O-N 2.64Å; E857-V861 WeakPolarHBondContact O-CG2 3.43Å; E857-V861 PolarHBondContact O-N 3.32Å
858	R	68.7	Low	65.9	Low	90 Å²	90	78.1 Å²	78.1	34%	0.34	40%	0.402	S	S	.	.	H	α-helix	trans	-76	-27.1	-176.2	-74.9	158.8	174.7	75.4	1.5	113.4	Y823 W854 F855 T856	Y823-R858 HydrophobicContact CD1-CB 3.75Å; Y823-R858 HydrophobicContact CD1-CG 4.4Å; Y823-R858 HydrophobicContact CD2-CB 4.3Å; Y823-R858 HydrophobicContact CE1-CB 3.71Å; Y823-R858 HydrophobicContact CE1-CG 4.11Å; Y823-R858 HydrophobicContact CE2-CB 4.24Å; Y823-R858 WeakPolarHBondContact CE2-O 3.4Å; Y823-R858 HydrophobicContact CG-CB 4.07Å; W854-R858 VanDerWaalsContact CE2-NE 3.27Å; W854-R858 VanDerWaalsContact NE1-NE 3.19Å; W854-R858 WeakPolarHBondContact O-CD 3.13Å; W854-R858 PolarHBondContact O-N 3Å; W854-R858 PolarHBondContact O-NH1 3.15Å; F855-R858 PolarHBondContact O-N 3.39Å; T856-R858 VanDerWaalsContact C-N 3.34Å; T856-R858 PolarHBondContact O-N 2.95Å
859	M	64.6	Low	63.9	Low	34 Å²	34	78 Å²	78	17%	0.167	40%	0.4	C	S	.	.	H	α-helix	trans	-70.3	-40.1	169.5	-78.5	-70.1	-66.9	0	0	111.4	Y823 F855 T856 G862 W863	Y823-M859 HydrophobicContact CD2-SD 4.4Å; F855-M859 HydrophobicContact CD2-CG 4.29Å; F855-M859 HydrophobicContact CE1-CG 4.12Å; F855-M859 HydrophobicContact CE2-CG 3.79Å; F855-M859 HydrophobicContact CE2-SD 4.32Å; F855-M859 HydrophobicContact CZ-CG 3.71Å; F855-M859 HydrophobicContact CZ-SD 4.29Å; F855-M859 WeakPolarHBondContact O-CG 3.46Å; F855-M859 PolarHBondContact O-N 2.94Å; F855-M859 VanDerWaalsContact O-N 3.09Å; T856-M859 PolarHBondContact O-N 2.97Å; M859-G862 PolarHBondContact O-N 3.21Å; M859-W863 VanDerWaalsContact O-CD1 3.24Å; M859-W863 PolarHBondContact O-N 3.39Å; M859-W863 VanDerWaalsContact O-N 3.12Å
860	H	57	Low	61.5	Low	123 Å²	123	75.7 Å²	75.7	57%	0.569	40%	0.404	S	S	*	.	H	α-helix	trans	-62.5	-47.1	179.7	-91.6	-70.7	0	0	0	113.4	T856 E857 G862 W863 D864	T856-H860 PolarHBondContact O-CD2 3.43Å; T856-H860 VanDerWaalsContact O-CD2 3.24Å; T856-H860 PolarHBondContact O-N 3.4Å; E857-H860 PolarHBondContact O-N 2.64Å; H860-G862 PolarHBondContact O-N 2.96Å; H860-G862 VanDerWaalsContact O-N 3.08Å; H860-W863 PolarHBondContact O-N 3.37Å; H860-W863 VanDerWaalsContact O-N 3.08Å; H860-D864 PolarHBondContact O-N 2.83Å; H860-D864 VanDerWaalsContact O-N 3.13Å
861	V	59.1	Low	59.1	Low	114 Å²	114	80.6 Å²	80.6	69%	0.691	42%	0.424	S	S	*	.	H	α-helix	trans	-55.5	-33.1	178.5	173.9	0	0	0	0	112.4	E857	E857-V861 WeakPolarHBondContact O-CG2 3.43Å; E857-V861 PolarHBondContact O-N 3.32Å
862	G	54.5	Low	56.6	Low	10 Å²	10	89 Å²	89	10%	0.103	46%	0.461	C	S	.	.	H	α-helix	trans	-81	-35.7	-179.9	0	0	0	0	0	115.1	F816 M859 H860	F816-G862 VanDerWaalsContact CD2-O 3.24Å; F816-G862 WeakPolarHBondContact CD2-O 3.5Å; F816-G862 WeakPolarHBondContact CE1-O 3.37Å; F816-G862 WeakPolarHBondContact CE2-O 3.41Å; F816-G862 VanDerWaalsContact CZ-O 3.27Å; F816-G862 WeakPolarHBondContact CZ-O 3.36Å; M859-G862 PolarHBondContact O-N 3.21Å; H860-G862 PolarHBondContact O-N 2.96Å; H860-G862 VanDerWaalsContact O-N 3.08Å
863	W	49.1	Very low	54.4	Low	96 Å²	96	85.9 Å²	85.9	36%	0.364	46%	0.458	S	S	.	.	H	α-helix	trans	-69.5	-35.6	178.2	-92	76.4	0	0	0	112.3	F816 M859 H860 A865 C866 C867 I875	F816-W863 AromaticContact CE1-CD1 3.9Å; F816-W863 HydrophobicContact CE1-CG 4.44Å; M859-W863 VanDerWaalsContact O-CD1 3.24Å; M859-W863 PolarHBondContact O-N 3.39Å; M859-W863 VanDerWaalsContact O-N 3.12Å; H860-W863 PolarHBondContact O-N 3.37Å; H860-W863 VanDerWaalsContact O-N 3.08Å; W863-A865 VanDerWaalsContact C-N 3.29Å; W863-A865 PolarHBondContact O-N 3.19Å; W863-C866 PolarHBondContact O-N 3.2Å; W863-C867 PolarHBondContact O-SG 3.35Å; W863-I875 HydrophobicContact CE3-CD1 4.17Å; W863-I875 HydrophobicContact CH2-CB 3.67Å; W863-I875 HydrophobicContact CH2-CD1 4.3Å; W863-I875 HydrophobicContact CH2-CG2 3.52Å; W863-I875 HydrophobicContact CZ2-CG2 3.91Å; W863-I875 HydrophobicContact CZ3-CB 3.94Å; W863-I875 HydrophobicContact CZ3-CD1 3.71Å; W863-I875 HydrophobicContact CZ3-CG1 4.4Å; W863-I875 HydrophobicContact CZ3-CG2 4.06Å
864	D	47.7	Very low	52.3	Low	117 Å²	117	85.3 Å²	85.3	63%	0.626	46%	0.46	S	S	*	.	H	α-helix	trans	-65.2	-29.9	-179.7	-72	-24	0	0	0	113.1	H860 C866	H860-D864 PolarHBondContact O-N 2.83Å; H860-D864 VanDerWaalsContact O-N 3.13Å; D864-C866 VanDerWaalsContact C-N 3.33Å; D864-C866 PolarHBondContact O-N 2.91Å
865	A	50.6	Low	49.9	Very low	68 Å²	68	85.2 Å²	85.2	56%	0.562	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74	-18.2	177.8	0	0	0	0	0	114.2	W863	W863-A865 VanDerWaalsContact C-N 3.29Å; W863-A865 PolarHBondContact O-N 3.19Å
866	C	45.2	Very low	47.8	Very low	26 Å²	26	84.6 Å²	84.6	18%	0.176	47%	0.465	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.2	-11	-179	-102.6	0	0	0	0	114.1	F816 W863 D864	F816-C866 WeakPolarHBondContact CB-SG 3.42Å; W863-C866 PolarHBondContact O-N 3.2Å; D864-C866 VanDerWaalsContact C-N 3.33Å; D864-C866 PolarHBondContact O-N 2.91Å
867	C	42	Very low	46.2	Very low	87 Å²	87	87.9 Å²	87.9	59%	0.588	48%	0.476	S	S	*	.	S	Bend	trans	-94.9	4.6	-167	-76	0	0	0	0	115.2	W863	W863-C867 PolarHBondContact O-SG 3.35Å
868	S	43.8	Very low	44.8	Very low	97 Å²	97	87.5 Å²	87.5	68%	0.678	47%	0.47	S	S	*	.	S	Bend	trans	-91.8	-0.3	-171.5	39	0	0	0	0	117.1
869	S	40.9	Very low	43.6	Very low	30 Å²	30	88.5 Å²	88.5	21%	0.21	47%	0.474	C	S	.	.	S	Bend	trans	-137	108.7	179.8	56.7	0	0	0	0	114.5	N810	N810-S869 PolarHBondContact ND2-O 3.04Å; N810-S869 VanDerWaalsContact ND2-O 3.12Å; N810-S869 PolarHBondContact ND2-OG 2.9Å; N810-S869 PolarHBondContact OD1-OG 3.49Å; N810-S869 VanDerWaalsContact OD1-OG 3.06Å
870	T	31.8	Very low	42.7	Very low	115 Å²	115	92.3 Å²	92.3	71%	0.706	49%	0.494	S	S	*	.			trans	49.8	119.5	155.5	52.1	0	0	0	0	121.8
871	Q	34.3	Very low	42.5	Very low	183 Å²	183	88.4 Å²	88.4	86%	0.855	48%	0.478	S	S	*	.	S	Bend	trans	61.7	107.7	145.4	-129.4	163.5	-13.6	0	0	118.8	V873	Q871-V873 PolarHBondContact O-N 2.92Å
872	E	33.1	Very low	42.6	Very low	190 Å²	190	86.2 Å²	86.2	89%	0.888	47%	0.465	S	S	*	.			trans	43.7	50.7	164.8	-69.1	-167.1	148.9	0	0	117.4	V874	E872-V874 VanDerWaalsContact C-N 3.35Å; E872-V874 PolarHBondContact O-N 2.73Å
873	V	33.9	Very low	43.3	Very low	83 Å²	83	89 Å²	89	50%	0.503	48%	0.477	S	S	.	.			trans	-80.5	88.9	167.3	-163.9	0	0	0	0	108.9	Q871 I875	Q871-V873 PolarHBondContact O-N 2.92Å; V873-I875 HydrophobicContact CB-CG1 4.07Å; V873-I875 HydrophobicContact CG1-CD1 4.26Å; V873-I875 HydrophobicContact CG1-CG1 3.41Å; V873-I875 VanDerWaalsContact CG1-CG1 3.41Å; V873-I875 PolarHBondContact O-N 3.3Å
874	V	36.5	Very low	44.3	Very low	68 Å²	68	88.7 Å²	88.7	41%	0.412	48%	0.478	S	S	.	.			trans	-64.3	80.8	161.4	176.2	0	0	0	0	107.1	E872 G876	E872-V874 VanDerWaalsContact C-N 3.35Å; E872-V874 PolarHBondContact O-N 2.73Å; V874-G876 PolarHBondContact O-N 2.86Å
875	I	31.1	Very low	45	Very low	63 Å²	63	83.4 Å²	83.4	32%	0.323	45%	0.451	S	S	.	.			trans	-70.9	75.3	177.5	-57.3	166.4	0	0	0	108.4	R97 W863 V873	R97-I875 VanDerWaalsContact NH1-C 3.34Å; R97-I875 PolarHBondContact NH1-O 3.46Å; W863-I875 HydrophobicContact CE3-CD1 4.17Å; W863-I875 HydrophobicContact CH2-CB 3.67Å; W863-I875 HydrophobicContact CH2-CD1 4.3Å; W863-I875 HydrophobicContact CH2-CG2 3.52Å; W863-I875 HydrophobicContact CZ2-CG2 3.91Å; W863-I875 HydrophobicContact CZ3-CB 3.94Å; W863-I875 HydrophobicContact CZ3-CD1 3.71Å; W863-I875 HydrophobicContact CZ3-CG1 4.4Å; W863-I875 HydrophobicContact CZ3-CG2 4.06Å; V873-I875 HydrophobicContact CB-CG1 4.07Å; V873-I875 HydrophobicContact CG1-CD1 4.26Å; V873-I875 HydrophobicContact CG1-CG1 3.41Å; V873-I875 VanDerWaalsContact CG1-CG1 3.41Å; V873-I875 PolarHBondContact O-N 3.3Å
876	G	36.1	Very low	45.9	Very low	13 Å²	13	80.1 Å²	80.1	13%	0.134	42%	0.424	C	S	.	.	S	Bend	trans	-138.6	109.5	162.6	0	0	0	0	0	105.5	V874 R878	V874-G876 PolarHBondContact O-N 2.86Å; G876-R878 WeakPolarHBondContact O-CG 3.39Å; G876-R878 PolarHBondContact O-N 3.03Å
877	H	37.8	Very low	47.3	Very low	119 Å²	119	80.5 Å²	80.5	55%	0.551	42%	0.424	S	S	*	.			trans	20.5	32.7	164.5	-86.9	54.6	0	0	0	119.6	R879 D915	H877-R879 VanDerWaalsContact C-N 3.31Å; H877-R879 PolarHBondContact O-N 2.83Å; H877-D915 WeakPolarHBondContact CB-OD2 3.28Å; H877-D915 WeakPolarHBondContact O-CB 3.33Å
878	R	42.3	Very low	48.6	Very low	112 Å²	112	78.3 Å²	78.3	42%	0.423	40%	0.404	S	S	.	.			trans	-73.5	87.4	177.3	-72.4	-161.5	-166.2	-177.4	7.5	108.8	G876 N880	G876-R878 WeakPolarHBondContact O-CG 3.39Å; G876-R878 PolarHBondContact O-N 3.03Å; R878-N880 PolarHBondContact O-N 3.09Å
879	R	44.6	Very low	49.8	Very low	111 Å²	111	75 Å²	75	42%	0.419	38%	0.376	S	S	.	.			trans	-52.4	132.4	161.3	-74.7	-175.9	170.9	108.4	-19.3	107.2	H877 L881 V1050	H877-R879 VanDerWaalsContact C-N 3.31Å; H877-R879 PolarHBondContact O-N 2.83Å; R879-L881 PolarHBondContact O-N 2.88Å; R879-V1050 PolarHBondContact NH2-O 3.35Å
880	N	46.3	Very low	51.5	Low	113 Å²	113	73.6 Å²	73.6	60%	0.604	37%	0.366	S	S	*	.			trans	-44.7	133.3	171.3	-68.7	-38	0	0	0	108.9	R878 T882	R878-N880 PolarHBondContact O-N 3.09Å; N880-T882 PolarHBondContact O-N 3.4Å
881	L	51.2	Low	53.4	Low	41 Å²	41	69.3 Å²	69.3	22%	0.215	34%	0.34	C	S	.	.			trans	-62.6	87.6	162.3	-108.7	78.9	0	0	0	105.8	F796 E800 R879 V916	F796-L881 HydrophobicContact CB-CD2 4.5Å; E800-L881 HydrophobicContact CB-CD2 3.91Å; E800-L881 HydrophobicContact CG-CD2 3.98Å; R879-L881 PolarHBondContact O-N 2.88Å; L881-V916 HydrophobicContact CD1-CG1 3.9Å
882	T	62.5	Low	55	Low	68 Å²	68	63.3 Å²	63.3	42%	0.417	31%	0.312	S	S	.	.			trans	-70.6	157	159.7	54.8	0	0	0	0	106.9	N880 F884 A885 S886	N880-T882 PolarHBondContact O-N 3.4Å; T882-F884 PolarHBondContact O-N 3.4Å; T882-A885 CarbonylContact O-C 3.57Å; T882-A885 WeakPolarHBondContact O-CA 3.27Å; T882-A885 WeakPolarHBondContact O-CB 3.14Å; T882-A885 PolarHBondContact O-N 2.88Å; T882-A885 WeakPolarHBondContact OG1-CB 3.24Å; T882-A885 PolarHBondContact OG1-N 2.98Å; T882-S886 PolarHBondContact O-N 2.89Å
883	L	69.3	Low	56.8	Low	69 Å²	69	55 Å²	55	36%	0.361	27%	0.274	S	S	.	.	H	α-helix	trans	-45.3	-38.5	170.2	-173.8	102.4	0	0	0	112	L794 S886 L887	L794-L883 HydrophobicContact CD2-CD1 3.68Å; L883-S886 WeakPolarHBondContact CA-OG 3.32Å; L883-S886 PolarHBondContact O-OG 3.34Å; L883-L887 HydrophobicContact CD2-CD1 3.88Å; L883-L887 HydrophobicContact CG-CD1 3.98Å; L883-L887 VanDerWaalsContact O-CB 3.24Å; L883-L887 WeakPolarHBondContact O-CB 3.28Å; L883-L887 VanDerWaalsContact O-CD1 3.27Å; L883-L887 WeakPolarHBondContact O-CD1 3.39Å; L883-L887 WeakPolarHBondContact O-CG 3.45Å; L883-L887 PolarHBondContact O-N 2.96Å
884	F	69.1	Low	58.4	Low	89 Å²	89	51 Å²	51	39%	0.39	25%	0.251	S	S	.	.	H	α-helix	trans	-69.7	-36.8	177	-65.5	-74.2	0	0	0	113.5	T882 Y888 P1054	T882-F884 PolarHBondContact O-N 3.4Å; F884-Y888 VanDerWaalsContact O-CB 3.29Å; F884-Y888 WeakPolarHBondContact O-CB 3.48Å; F884-Y888 PolarHBondContact O-N 2.88Å; F884-P1054 HydrophobicContact CB-CB 4.21Å; F884-P1054 HydrophobicContact CD2-CB 4.41Å; F884-P1054 HydrophobicContact CG-CB 4.36Å
885	A	61.9	Low	59.7	Low	6 Å²	6	48.7 Å²	48.7	5%	0.05	24%	0.236	C	C	.	.	H	α-helix	trans	-71.4	-36.6	174.9	0	0	0	0	0	112	T882 Y888 Y889	T882-A885 CarbonylContact O-C 3.57Å; T882-A885 WeakPolarHBondContact O-CA 3.27Å; T882-A885 WeakPolarHBondContact O-CB 3.14Å; T882-A885 PolarHBondContact O-N 2.88Å; T882-A885 WeakPolarHBondContact OG1-CB 3.24Å; T882-A885 PolarHBondContact OG1-N 2.98Å; A885-Y888 PolarHBondContact O-N 2.9Å; A885-Y889 WeakPolarHBondContact O-CB 3.42Å; A885-Y889 PolarHBondContact O-N 3.25Å
886	S	69.9	Low	61.2	Low	0 Å²	0	47.6 Å²	47.6	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-69.5	-39.1	174.4	66.8	0	0	0	0	111.8	G793 T882 L883 Y889 A890	G793-S886 WeakPolarHBondContact O-CB 3.37Å; G793-S886 PolarHBondContact O-OG 3.47Å; T882-S886 PolarHBondContact O-N 2.89Å; L883-S886 WeakPolarHBondContact CA-OG 3.32Å; L883-S886 PolarHBondContact O-OG 3.34Å; S886-Y889 PolarHBondContact O-N 2.85Å; S886-A890 WeakPolarHBondContact O-CB 3.47Å; S886-A890 PolarHBondContact O-N 3.23Å
887	L	75.6	Confident	62.1	Low	34 Å²	34	49.8 Å²	49.8	18%	0.178	24%	0.241	C	C	.	.	H	α-helix	trans	-59.9	-48.2	170.1	-80.3	162.2	0	0	0	111.8	L790 L883 Y889 A890 V891	L790-L887 HydrophobicContact CD2-CD2 3.69Å; L883-L887 HydrophobicContact CD2-CD1 3.88Å; L883-L887 HydrophobicContact CG-CD1 3.98Å; L883-L887 VanDerWaalsContact O-CB 3.24Å; L883-L887 WeakPolarHBondContact O-CB 3.28Å; L883-L887 VanDerWaalsContact O-CD1 3.27Å; L883-L887 WeakPolarHBondContact O-CD1 3.39Å; L883-L887 WeakPolarHBondContact O-CG 3.45Å; L883-L887 PolarHBondContact O-N 2.96Å; L887-Y889 VanDerWaalsContact C-N 3.35Å; L887-Y889 PolarHBondContact O-N 2.91Å; L887-A890 PolarHBondContact O-N 3.35Å; L887-V891 WeakPolarHBondContact O-CG2 3.19Å; L887-V891 PolarHBondContact O-N 3.42Å
888	Y	69	Low	62.5	Low	41 Å²	41	46.7 Å²	46.7	16%	0.161	24%	0.24	C	C	.	.	H	α-helix	trans	-61	-44.7	177.4	-179.8	-100.8	0	0	0	111.4	F884 A885 A890 V891 Q892 M1057	F884-Y888 VanDerWaalsContact O-CB 3.29Å; F884-Y888 WeakPolarHBondContact O-CB 3.48Å; F884-Y888 PolarHBondContact O-N 2.88Å; A885-Y888 PolarHBondContact O-N 2.9Å; Y888-A890 PolarHBondContact O-N 3.25Å; Y888-V891 PolarHBondContact O-N 2.87Å; Y888-Q892 WeakPolarHBondContact O-CB 3.35Å; Y888-Q892 PolarHBondContact O-N 3.42Å; Y888-M1057 HydrophobicContact CD1-SD 4.1Å; Y888-M1057 HydrophobicContact CD2-CB 4.4Å; Y888-M1057 HydrophobicContact CD2-SD 3.62Å; Y888-M1057 HydrophobicContact CE2-SD 4.14Å; Y888-M1057 HydrophobicContact CG-SD 3.6Å; Y888-M1057 VanDerWaalsContact CG-SD 3.6Å
889	Y	69.3	Low	62.3	Low	27 Å²	27	46.9 Å²	46.9	11%	0.106	24%	0.244	C	C	.	.	H	α-helix	trans	-59.2	-46.5	175	-179	-100.7	0	0	0	111.9	F796 A885 S886 L887 V891 Q892 V893 V916 P918 T927	F796-Y889 HydrophobicContact CD1-CD1 4.21Å; F796-Y889 HydrophobicContact CD1-CE1 4.11Å; F796-Y889 AromaticContact CD2-CD1 3.86Å; F796-Y889 HydrophobicContact CD2-CD1 3.86Å; F796-Y889 HydrophobicContact CD2-CE1 4.3Å; F796-Y889 HydrophobicContact CE1-CD1 4.13Å; F796-Y889 AromaticContact CE1-CE1 3.65Å; F796-Y889 HydrophobicContact CE1-CE1 3.65Å; F796-Y889 AromaticContact CE2-CD1 3.82Å; F796-Y889 HydrophobicContact CE2-CD1 3.82Å; F796-Y889 AromaticContact CE2-CE1 3.89Å; F796-Y889 HydrophobicContact CE2-CE1 3.89Å; F796-Y889 HydrophobicContact CG-CD1 4.09Å; F796-Y889 HydrophobicContact CG-CE1 4.43Å; F796-Y889 AromaticContact CZ-CD1 3.96Å; F796-Y889 HydrophobicContact CZ-CD1 3.96Å; F796-Y889 AromaticContact CZ-CE1 3.55Å; F796-Y889 HydrophobicContact CZ-CE1 3.55Å; A885-Y889 WeakPolarHBondContact O-CB 3.42Å; A885-Y889 PolarHBondContact O-N 3.25Å; S886-Y889 PolarHBondContact O-N 2.85Å; L887-Y889 VanDerWaalsContact C-N 3.35Å; L887-Y889 PolarHBondContact O-N 2.91Å; Y889-V891 PolarHBondContact O-N 3Å; Y889-Q892 PolarHBondContact O-N 3.26Å; Y889-Q892 VanDerWaalsContact O-N 3.14Å; Y889-V893 HydrophobicContact CD1-CG2 4.16Å; Y889-V893 HydrophobicContact CE1-CG2 3.7Å; Y889-V893 HydrophobicContact CE2-CG2 4.16Å; Y889-V893 WeakPolarHBondContact O-CG2 3.03Å; Y889-V893 PolarHBondContact O-N 3.13Å; Y889-V916 HydrophobicContact CD2-CG1 4.12Å; Y889-V916 WeakPolarHBondContact CD2-O 3.07Å; Y889-V916 VanDerWaalsContact CE2-O 3.32Å; Y889-V916 WeakPolarHBondContact CE2-O 3.41Å; Y889-V916 HydrophobicContact CG-CG1 4.33Å; Y889-P918 HydrophobicContact CE1-CG 4.47Å; Y889-P918 WeakPolarHBondContact OH-CD 3.5Å; Y889-T927 HydrophobicContact CE1-CG2 4.44Å; Y889-T927 VanDerWaalsContact OH-CG2 3.24Å; Y889-T927 WeakPolarHBondContact OH-CG2 3.4Å; Y889-T927 PolarHBondContact OH-OG1 2.75Å; Y889-T927 VanDerWaalsContact OH-OG1 3.12Å
890	A	76.4	Confident	61.8	Low	0 Å²	0	48.9 Å²	48.9	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-58.5	-45.9	176.9	0	0	0	0	0	112	F796 S886 L887 Y888 Q892 V893 C894 Y930	F796-A890 HydrophobicContact CD2-CB 4.1Å; F796-A890 HydrophobicContact CE2-CB 4.22Å; S886-A890 WeakPolarHBondContact O-CB 3.47Å; S886-A890 PolarHBondContact O-N 3.23Å; L887-A890 PolarHBondContact O-N 3.35Å; Y888-A890 PolarHBondContact O-N 3.25Å; A890-Q892 VanDerWaalsContact C-N 3.33Å; A890-Q892 PolarHBondContact O-N 3.03Å; A890-V893 PolarHBondContact O-N 3.14Å; A890-C894 PolarHBondContact O-N 3.26Å; A890-Y930 HydrophobicContact CB-CE1 4.2Å; A890-Y930 WeakPolarHBondContact O-CE1 3.46Å
891	V	71.9	Confident	61.3	Low	26 Å²	26	53.4 Å²	53.4	16%	0.158	28%	0.278	C	S	.	.	H	α-helix	trans	-61.8	-41.2	175.4	174.5	0	0	0	0	111.1	L887 Y888 Y889 V893 C894 T895	L887-V891 WeakPolarHBondContact O-CG2 3.19Å; L887-V891 PolarHBondContact O-N 3.42Å; Y888-V891 PolarHBondContact O-N 2.87Å; Y889-V891 PolarHBondContact O-N 3Å; V891-V893 VanDerWaalsContact C-N 3.35Å; V891-V893 PolarHBondContact O-N 3.35Å; V891-C894 PolarHBondContact O-N 3.01Å; V891-T895 HydrophobicContact CG1-CG2 4.25Å; V891-T895 WeakPolarHBondContact O-CA 3.18Å; V891-T895 WeakPolarHBondContact O-CG2 3.22Å; V891-T895 PolarHBondContact O-N 3.49Å
892	Q	67.3	Low	60.3	Low	56 Å²	56	56 Å²	56	26%	0.262	30%	0.296	S	S	.	.	H	α-helix	trans	-68.4	-32.6	-179.6	-154.9	70.7	-6.1	0	0	113	Y888 Y889 A890 T895 T896 Y913	Y888-Q892 WeakPolarHBondContact O-CB 3.35Å; Y888-Q892 PolarHBondContact O-N 3.42Å; Y889-Q892 PolarHBondContact O-N 3.26Å; Y889-Q892 VanDerWaalsContact O-N 3.14Å; A890-Q892 VanDerWaalsContact C-N 3.33Å; A890-Q892 PolarHBondContact O-N 3.03Å; Q892-T895 WeakPolarHBondContact O-CA 3.32Å; Q892-T895 PolarHBondContact O-N 3.41Å; Q892-T896 PolarHBondContact O-N 3.42Å; Q892-T896 PolarHBondContact O-OG1 2.88Å; Q892-Y913 HydrophobicContact CG-CD1 4.21Å; Q892-Y913 HydrophobicContact CG-CE1 4.22Å
893	V	70	Confident	58.9	Low	15 Å²	15	62.2 Å²	62.2	9%	0.091	32%	0.317	C	S	.	.	H	α-helix	trans	-65	-45.5	174	173.4	0	0	0	0	110.7	Y889 A890 V891 T896 T927 Y930	Y889-V893 HydrophobicContact CD1-CG2 4.16Å; Y889-V893 HydrophobicContact CE1-CG2 3.7Å; Y889-V893 HydrophobicContact CE2-CG2 4.16Å; Y889-V893 WeakPolarHBondContact O-CG2 3.03Å; Y889-V893 PolarHBondContact O-N 3.13Å; A890-V893 PolarHBondContact O-N 3.14Å; V891-V893 VanDerWaalsContact C-N 3.35Å; V891-V893 PolarHBondContact O-N 3.35Å; V893-T896 PolarHBondContact O-N 2.75Å; V893-T927 HydrophobicContact CG1-CG2 4.18Å; V893-T927 HydrophobicContact CG2-CG2 3.99Å; V893-Y930 HydrophobicContact CB-CD1 4.24Å; V893-Y930 HydrophobicContact CB-CE1 4.45Å; V893-Y930 HydrophobicContact CG1-CD1 3.84Å; V893-Y930 HydrophobicContact CG1-CE1 4.46Å
894	C	68.9	Low	57.1	Low	1 Å²	1	69.9 Å²	69.9	1%	0.007	34%	0.342	C	S	.	.	H	α-helix	trans	-65.7	-43.9	173.6	-62.8	0	0	0	0	111.6	L785 A890 V891 T896 Y930 L938	L785-C894 HydrophobicContact CD1-CB 4.41Å; A890-C894 PolarHBondContact O-N 3.26Å; V891-C894 PolarHBondContact O-N 3.01Å; C894-T896 PolarHBondContact O-N 2.74Å; C894-Y930 WeakPolarHBondContact SG-CE1 3.23Å; C894-L938 WeakPolarHBondContact O-CD2 3.41Å
895	T	64.4	Low	55.5	Low	19 Å²	19	69 Å²	69	12%	0.117	35%	0.346	C	S	.	.	H	α-helix	trans	-24.2	-41	161	109.4	0	0	0	0	119.1	V891 Q892 I897 L938 L1065	V891-T895 HydrophobicContact CG1-CG2 4.25Å; V891-T895 WeakPolarHBondContact O-CA 3.18Å; V891-T895 WeakPolarHBondContact O-CG2 3.22Å; V891-T895 PolarHBondContact O-N 3.49Å; Q892-T895 WeakPolarHBondContact O-CA 3.32Å; Q892-T895 PolarHBondContact O-N 3.41Å; T895-I897 PolarHBondContact O-N 3.46Å; T895-L938 HydrophobicContact CG2-CD1 4.1Å; T895-L938 HydrophobicContact CG2-CD2 3.65Å; T895-L1065 HydrophobicContact CG2-CD2 3.81Å
896	T	62.2	Low	54.1	Low	39 Å²	39	75.1 Å²	75.1	24%	0.239	38%	0.377	C	S	.	.			trans	-80.8	93.4	-159.9	-65.5	0	0	0	0	110.2	Q892 V893 C894 G898 Y913	Q892-T896 PolarHBondContact O-N 3.42Å; Q892-T896 PolarHBondContact O-OG1 2.88Å; V893-T896 PolarHBondContact O-N 2.75Å; C894-T896 PolarHBondContact O-N 2.74Å; T896-G898 PolarHBondContact O-N 3.32Å; T896-G898 VanDerWaalsContact O-N 3.12Å; T896-Y913 WeakPolarHBondContact CG2-OH 3.31Å; T896-Y913 PolarHBondContact OG1-OH 3.2Å
897	I	54.6	Low	52.4	Low	60 Å²	60	82.3 Å²	82.3	31%	0.308	42%	0.415	S	S	.	.			trans	-68.8	110.1	172.1	-61.1	173.8	0	0	0	107.9	T895 K899 L939 L942 T1021 L1068	T895-I897 PolarHBondContact O-N 3.46Å; I897-K899 PolarHBondContact O-N 2.9Å; I897-L939 HydrophobicContact CG1-CD2 4.21Å; I897-L939 HydrophobicContact CG2-CD2 4.29Å; I897-L942 HydrophobicContact CD1-CD1 3.91Å; I897-T1021 HydrophobicContact CD1-CG2 4.22Å; I897-L1068 HydrophobicContact CD1-CD2 4.28Å
898	G	46.9	Very low	50.4	Low	53 Å²	53	83.6 Å²	83.6	55%	0.546	43%	0.43	S	S	.	.			trans	-54.4	117.4	-179.3	0	0	0	0	0	111.8	T896 N900	T896-G898 PolarHBondContact O-N 3.32Å; T896-G898 VanDerWaalsContact O-N 3.12Å; G898-N900 PolarHBondContact O-N 2.97Å
899	K	36.3	Very low	48.6	Very low	116 Å²	116	83.8 Å²	83.8	50%	0.504	44%	0.44	S	S	.	.			trans	-57.5	130.6	159.8	-69.3	176.1	177.9	167.6	0	108.3	I897 F901 G1023	I897-K899 PolarHBondContact O-N 2.9Å; K899-F901 PolarHBondContact O-N 3.47Å; K899-F901 VanDerWaalsContact O-N 3.15Å; K899-G1023 WeakPolarHBondContact CE-O 3.34Å; K899-G1023 PolarHBondContact NZ-O 3.25Å
900	N	35.6	Very low	47	Very low	154 Å²	154	86.1 Å²	86.1	82%	0.824	47%	0.465	S	S	*	.	S	Bend	trans	-31.8	112.3	-178.8	-72	-33.2	0	0	0	114.9	G898 T902	G898-N900 PolarHBondContact O-N 2.97Å; N900-T902 PolarHBondContact O-N 3.28Å
901	F	34.1	Very low	45	Very low	208 Å²	208	91.5 Å²	91.5	91%	0.912	50%	0.503	S	S	*	.	S	Bend	trans	34.3	69.1	139.3	-146	-96.6	0	0	0	117.1	K899	K899-F901 PolarHBondContact O-N 3.47Å; K899-F901 VanDerWaalsContact O-N 3.15Å
902	T	30.6	Very low	43.3	Very low	96 Å²	96	93.3 Å²	93.3	59%	0.589	53%	0.526	S	S	*	.			trans	-155.3	120.4	146.1	28.1	0	0	0	0	109.1	N900 R904 C905	N900-T902 PolarHBondContact O-N 3.28Å; T902-R904 PolarHBondContact O-N 3.43Å; T902-C905 PolarHBondContact O-N 3.38Å
903	F	33.3	Very low	41.8	Very low	197 Å²	197	95.3 Å²	95.3	86%	0.864	53%	0.532	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53	-16.5	-178.7	-157.2	-102.7	0	0	0	113.9
904	R	31.3	Very low	40.5	Very low	230 Å²	230	96.3 Å²	96.3	87%	0.868	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.4	-20.3	175.4	-112.8	173.8	174.9	-173.8	-2	115.2	T902	T902-R904 PolarHBondContact O-N 3.43Å
905	C	36.4	Very low	39.3	Very low	72 Å²	72	99.1 Å²	99.1	49%	0.486	56%	0.56	S	S	.	*	S	Bend	trans	-85	-19	178.4	-83	0	0	0	0	114.1	T902 L907 A908 A909	T902-C905 PolarHBondContact O-N 3.38Å; C905-L907 VanDerWaalsContact C-N 3.3Å; C905-L907 PolarHBondContact O-N 2.99Å; C905-A908 PolarHBondContact O-N 3.26Å; C905-A908 VanDerWaalsContact O-N 3.13Å; C905-A909 PolarHBondContact O-N 2.75Å
906	L	31.3	Very low	39	Very low	134 Å²	134	99.2 Å²	99.2	70%	0.702	56%	0.561	S	S	*	*	H	α-helix	trans	-68.1	-30.4	-178.6	-145.1	80.9	0	0	0	112.2
907	L	35.6	Very low	38.8	Very low	151 Å²	151	100.6 Å²	100.6	79%	0.791	57%	0.569	S	S	*	*	H	α-helix	trans	-72.4	-27.5	172.8	-80.8	155.6	0	0	0	113	C905	C905-L907 VanDerWaalsContact C-N 3.3Å; C905-L907 PolarHBondContact O-N 2.99Å
908	A	32.7	Very low	39.2	Very low	61 Å²	61	98 Å²	98	50%	0.504	56%	0.556	S	S	.	*	H	α-helix	trans	-85.3	-27.5	175.9	0	0	0	0	0	112.6	C905 A910 S911	C905-A908 PolarHBondContact O-N 3.26Å; C905-A908 VanDerWaalsContact O-N 3.13Å; A908-A910 PolarHBondContact O-N 2.89Å; A908-S911 PolarHBondContact O-N 2.93Å; A908-S911 PolarHBondContact O-OG 3Å
909	A	30.8	Very low	39.7	Very low	45 Å²	45	97.5 Å²	97.5	37%	0.372	54%	0.544	S	S	.	.	H	α-helix	trans	-61.2	-23.8	175.5	0	0	0	0	0	112.9	C905 S911 G912 Y913	C905-A909 PolarHBondContact O-N 2.75Å; A909-S911 PolarHBondContact O-N 3.32Å; A909-G912 PolarHBondContact O-N 3.41Å; A909-Y913 WeakPolarHBondContact O-CD2 3.17Å; A909-Y913 WeakPolarHBondContact O-CE2 3.43Å
910	A	36.1	Very low	41.3	Very low	75 Å²	75	93.7 Å²	93.7	62%	0.62	53%	0.531	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-10.3	175.6	0	0	0	0	0	114.8	A908	A908-A910 PolarHBondContact O-N 2.89Å
911	S	35.7	Very low	42.9	Very low	114 Å²	114	90.3 Å²	90.3	80%	0.797	52%	0.524	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.5	2.4	178.9	53.6	0	0	0	0	115	A908 A909	A908-S911 PolarHBondContact O-N 2.93Å; A908-S911 PolarHBondContact O-OG 3Å; A909-S911 PolarHBondContact O-N 3.32Å
912	G	36.2	Very low	45	Very low	63 Å²	63	85.9 Å²	85.9	65%	0.649	51%	0.509	S	S	*	.	S	Bend	trans	-109.4	2.1	-176.2	0	0	0	0	0	117.6	A909	A909-G912 PolarHBondContact O-N 3.41Å
913	Y	35.6	Very low	47	Very low	99 Å²	99	81.3 Å²	81.3	39%	0.388	48%	0.481	S	S	.	.	S	Bend	trans	-109.1	12.2	-163.6	-77.1	-86.1	0	0	0	117.4	Q892 T896 A909	Q892-Y913 HydrophobicContact CG-CD1 4.21Å; Q892-Y913 HydrophobicContact CG-CE1 4.22Å; T896-Y913 WeakPolarHBondContact CG2-OH 3.31Å; T896-Y913 PolarHBondContact OG1-OH 3.2Å; A909-Y913 WeakPolarHBondContact O-CD2 3.17Å; A909-Y913 WeakPolarHBondContact O-CE2 3.43Å
914	G	41.6	Very low	49	Very low	35 Å²	35	77.1 Å²	77.1	36%	0.361	46%	0.463	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.9	-178.3	179.2	0	0	0	0	0	113.9	V916	G914-V916 PolarHBondContact O-N 3.06Å
915	D	44.1	Very low	51.4	Low	60 Å²	60	72.2 Å²	72.2	32%	0.321	45%	0.453	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-1.6	-169.4	-67.5	-63.7	0	0	0	116.6	H877	H877-D915 WeakPolarHBondContact CB-OD2 3.28Å; H877-D915 WeakPolarHBondContact O-CB 3.33Å
916	V	57.2	Low	53.6	Low	22 Å²	22	71 Å²	71	13%	0.133	44%	0.439	C	S	.	.			trans	-101.7	89.8	-176.2	-169.2	0	0	0	0	109.6	L881 Y889 G914	L881-V916 HydrophobicContact CD1-CG1 3.9Å; Y889-V916 HydrophobicContact CD2-CG1 4.12Å; Y889-V916 WeakPolarHBondContact CD2-O 3.07Å; Y889-V916 VanDerWaalsContact CE2-O 3.32Å; Y889-V916 WeakPolarHBondContact CE2-O 3.41Å; Y889-V916 HydrophobicContact CG-CG1 4.33Å; G914-V916 PolarHBondContact O-N 3.06Å
917	V	58.2	Low	55.9	Low	67 Å²	67	65.6 Å²	65.6	41%	0.406	41%	0.412	S	S	.	.			trans	-138.5	141.3	177.6	-179.9	0	0	0	0	108.2	S919	V917-S919 PolarHBondContact O-N 3.39Å
918	P	63.2	Low	58	Low	7 Å²	7	64.6 Å²	64.6	5%	0.045	41%	0.405	C	S	.	.			trans	-59.1	127.4	176.1	25	-36.8	0	0	0	110.3	E800 Y889 G923 K924	E800-P918 WeakPolarHBondContact OE1-CA 3.32Å; E800-P918 WeakPolarHBondContact OE1-CB 3.2Å; Y889-P918 HydrophobicContact CE1-CG 4.47Å; Y889-P918 WeakPolarHBondContact OH-CD 3.5Å; P918-G923 VanDerWaalsContact CB-C 3.43Å; P918-K924 HydrophobicContact CB-CG 4.39Å; P918-K924 HydrophobicContact CG-CG 4.04Å; P918-K924 WeakPolarHBondContact O-CE 3.49Å
919	S	58.7	Low	60.4	Low	42 Å²	42	64.3 Å²	64.3	29%	0.294	40%	0.403	S	S	.	.			trans	-88.8	-29.6	-179.9	66.8	0	0	0	0	112	E800 V917	E800-S919 VanDerWaalsContact CD-N 3.32Å; E800-S919 PolarHBondContact OE1-N 2.99Å; E800-S919 WeakPolarHBondContact OE2-CB 3.41Å; E800-S919 PolarHBondContact OE2-N 3.39Å; E800-S919 PolarHBondContact OE2-OG 3.42Å; V917-S919 PolarHBondContact O-N 3.39Å
920	T	68.2	Low	63	Low	35 Å²	35	62.5 Å²	62.5	22%	0.215	39%	0.386	C	S	.	.	S	Bend	trans	-79.5	148.8	-179.4	67.7	0	0	0	0	111.7	E800 A803 L922 G923 K924	E800-T920 WeakPolarHBondContact OE1-CB 3.47Å; E800-T920 WeakPolarHBondContact OE1-CG2 3.27Å; E800-T920 PolarHBondContact OE1-N 2.8Å; E800-T920 PolarHBondContact OE1-OG1 3.35Å; A803-T920 HydrophobicContact CB-CG2 4.22Å; T920-L922 PolarHBondContact O-N 3.15Å; T920-G923 PolarHBondContact O-N 3Å; T920-G923 PolarHBondContact OG1-N 2.71Å; T920-K924 WeakPolarHBondContact O-CG 3.4Å; T920-K924 PolarHBondContact O-N 3.33Å; T920-K924 VanDerWaalsContact O-N 3.1Å
921	A	71	Confident	65	Low	83 Å²	83	60.3 Å²	60.3	69%	0.686	37%	0.366	S	S	*	.	H	α-helix	trans	-58.6	-37.7	172.8	0	0	0	0	0	111.5	K924 L925	A921-K924 PolarHBondContact O-N 3.45Å; A921-L925 PolarHBondContact O-N 3.48Å
922	L	76.4	Confident	67.1	Low	116 Å²	116	61.2 Å²	61.2	61%	0.607	36%	0.361	S	S	*	.	H	α-helix	trans	-64.7	-46.3	177.2	-166.6	151.7	0	0	0	111.7	A799 T920 K924 L925 F926	A799-L922 HydrophobicContact CB-CD2 3.7Å; T920-L922 PolarHBondContact O-N 3.15Å; L922-K924 VanDerWaalsContact C-N 3.3Å; L922-K924 PolarHBondContact O-N 2.83Å; L922-L925 PolarHBondContact O-N 3.31Å; L922-F926 WeakPolarHBondContact O-CB 2.76Å; L922-F926 PolarHBondContact O-N 3.02Å
923	G	74.6	Confident	69.3	Low	0 Å²	0	64 Å²	64	0%	0	36%	0.361	C	S	.	.	H	α-helix	trans	-61.7	-35.7	175.9	0	0	0	0	0	113.1	P918 T920 T927	P918-G923 VanDerWaalsContact CB-C 3.43Å; T920-G923 PolarHBondContact O-N 3Å; T920-G923 PolarHBondContact OG1-N 2.71Å; G923-T927 PolarHBondContact O-N 3.38Å; G923-T927 PolarHBondContact O-OG1 2.83Å
924	K	74.3	Confident	71.3	Confident	108 Å²	108	59.3 Å²	59.3	47%	0.47	34%	0.342	S	S	.	.	H	α-helix	trans	-66.5	-45.9	173.8	-69.2	173.7	-175.4	174.5	0	112	P918 T920 A921 L922 T927 M928	P918-K924 HydrophobicContact CB-CG 4.39Å; P918-K924 HydrophobicContact CG-CG 4.04Å; P918-K924 WeakPolarHBondContact O-CE 3.49Å; T920-K924 WeakPolarHBondContact O-CG 3.4Å; T920-K924 PolarHBondContact O-N 3.33Å; T920-K924 VanDerWaalsContact O-N 3.1Å; A921-K924 PolarHBondContact O-N 3.45Å; L922-K924 VanDerWaalsContact C-N 3.3Å; L922-K924 PolarHBondContact O-N 2.83Å; K924-T927 WeakPolarHBondContact O-CB 3.38Å; K924-T927 PolarHBondContact O-N 3.42Å; K924-M928 PolarHBondContact O-N 3.3Å
925	L	81.1	Confident	73	Confident	127 Å²	127	59.6 Å²	59.6	67%	0.665	34%	0.335	S	S	*	.	H	α-helix	trans	-65.8	-40.4	179.4	-164	133.8	0	0	0	111.7	A921 L922 T927 M928 A929	A921-L925 PolarHBondContact O-N 3.48Å; L922-L925 PolarHBondContact O-N 3.31Å; L925-T927 PolarHBondContact O-N 3.4Å; L925-M928 PolarHBondContact O-N 3.22Å; L925-A929 PolarHBondContact O-N 3.11Å
926	F	83.1	Confident	74.5	Confident	46 Å²	46	60.2 Å²	60.2	20%	0.202	34%	0.343	C	S	.	.	H	α-helix	trans	-63.6	-39.4	173.7	-176.1	-106.1	0	0	0	112	I795 F796 L922 M928 A929 Y930	I795-F926 HydrophobicContact CB-CE1 3.79Å; I795-F926 HydrophobicContact CB-CE2 4.33Å; I795-F926 HydrophobicContact CB-CZ 3.69Å; I795-F926 HydrophobicContact CD1-CE1 4.47Å; I795-F926 HydrophobicContact CD1-CE2 3.9Å; I795-F926 HydrophobicContact CD1-CZ 3.54Å; I795-F926 HydrophobicContact CG1-CZ 4.22Å; I795-F926 HydrophobicContact CG2-CD1 3.82Å; I795-F926 HydrophobicContact CG2-CD2 3.95Å; I795-F926 HydrophobicContact CG2-CE1 3.52Å; I795-F926 HydrophobicContact CG2-CE2 3.65Å; I795-F926 HydrophobicContact CG2-CG 4.05Å; I795-F926 HydrophobicContact CG2-CZ 3.44Å; I795-F926 VanDerWaalsContact CG2-CZ 3.44Å; F796-F926 AromaticContact CD1-CD1 3.91Å; F796-F926 HydrophobicContact CD1-CD1 3.91Å; F796-F926 HydrophobicContact CD1-CE1 4.42Å; F796-F926 HydrophobicContact CD2-CD1 4.42Å; F796-F926 HydrophobicContact CD2-CE1 4.17Å; F796-F926 AromaticContact CE1-CD1 3.46Å; F796-F926 HydrophobicContact CE1-CD1 3.46Å; F796-F926 VanDerWaalsContact CE1-CD1 3.46Å; F796-F926 HydrophobicContact CE1-CE1 4.13Å; F796-F926 HydrophobicContact CE1-CG 4.49Å; F796-F926 HydrophobicContact CE2-CD1 4.01Å; F796-F926 AromaticContact CE2-CE1 3.84Å; F796-F926 HydrophobicContact CE2-CE1 3.84Å; F796-F926 HydrophobicContact CG-CD1 4.36Å; F796-F926 HydrophobicContact CG-CE1 4.43Å; F796-F926 AromaticContact CZ-CD1 3.49Å; F796-F926 HydrophobicContact CZ-CD1 3.49Å; F796-F926 VanDerWaalsContact CZ-CD1 3.49Å; F796-F926 AromaticContact CZ-CE1 3.8Å; F796-F926 HydrophobicContact CZ-CE1 3.8Å; L922-F926 WeakPolarHBondContact O-CB 2.76Å; L922-F926 PolarHBondContact O-N 3.02Å; F926-M928 VanDerWaalsContact C-N 3.31Å; F926-M928 PolarHBondContact O-N 2.89Å; F926-A929 PolarHBondContact O-N 3.02Å; F926-Y930 HydrophobicContact CE1-CD2 4.11Å; F926-Y930 HydrophobicContact CE1-CG 4.39Å; F926-Y930 AromaticContact CZ-CD2 3.94Å; F926-Y930 HydrophobicContact CZ-CD2 3.94Å; F926-Y930 WeakPolarHBondContact O-CB 3.4Å; F926-Y930 PolarHBondContact O-N 2.86Å
927	T	79.4	Confident	75.5	Confident	22 Å²	22	61.3 Å²	61.3	14%	0.135	35%	0.348	C	S	.	.	H	α-helix	trans	-57.5	-43.2	174	-59	0	0	0	0	112	F796 Y889 V893 G923 K924 L925 Y930 S931	F796-T927 VanDerWaalsContact CE1-OG1 3.27Å; F796-T927 WeakPolarHBondContact CE1-OG1 3.42Å; F796-T927 WeakPolarHBondContact CZ-OG1 3.47Å; Y889-T927 HydrophobicContact CE1-CG2 4.44Å; Y889-T927 VanDerWaalsContact OH-CG2 3.24Å; Y889-T927 WeakPolarHBondContact OH-CG2 3.4Å; Y889-T927 PolarHBondContact OH-OG1 2.75Å; Y889-T927 VanDerWaalsContact OH-OG1 3.12Å; V893-T927 HydrophobicContact CG1-CG2 4.18Å; V893-T927 HydrophobicContact CG2-CG2 3.99Å; G923-T927 PolarHBondContact O-N 3.38Å; G923-T927 PolarHBondContact O-OG1 2.83Å; K924-T927 WeakPolarHBondContact O-CB 3.38Å; K924-T927 PolarHBondContact O-N 3.42Å; L925-T927 PolarHBondContact O-N 3.4Å; T927-Y930 PolarHBondContact O-N 3.37Å; T927-S931 WeakPolarHBondContact O-CB 3.43Å; T927-S931 PolarHBondContact O-N 3.49Å; T927-S931 PolarHBondContact O-OG 2.96Å
928	M	79.5	Confident	76.4	Confident	130 Å²	130	58.2 Å²	58.2	64%	0.64	33%	0.329	S	S	*	.	H	α-helix	trans	-60.3	-50.9	178	-64.3	177.5	-179.2	0	0	111	K924 L925 F926 Y930 S931 L932	K924-M928 PolarHBondContact O-N 3.3Å; L925-M928 PolarHBondContact O-N 3.22Å; F926-M928 VanDerWaalsContact C-N 3.31Å; F926-M928 PolarHBondContact O-N 2.89Å; M928-Y930 PolarHBondContact O-N 3.34Å; M928-S931 PolarHBondContact O-N 2.7Å; M928-S931 PolarHBondContact O-OG 3.42Å; M928-L932 PolarHBondContact O-N 3.46Å
929	A	84.1	Confident	77	Confident	54 Å²	54	61.7 Å²	61.7	45%	0.446	35%	0.347	S	S	.	.	H	α-helix	trans	-63.9	-41	179.3	0	0	0	0	0	112.8	L925 F926 L932	L925-A929 PolarHBondContact O-N 3.11Å; F926-A929 PolarHBondContact O-N 3.02Å; A929-L932 PolarHBondContact O-N 2.89Å
930	Y	85	Confident	78	Confident	8 Å²	8	61.1 Å²	61.1	3%	0.031	34%	0.338	C	S	.	.	H	α-helix	trans	-65.4	-39.7	178.1	-172	-95.4	0	0	0	111.8	Y788 S789 F796 A890 V893 C894 F926 T927 M928 L932 L933 G934	Y788-Y930 VanDerWaalsContact C-OH 3.25Å; Y788-Y930 HydrophobicContact CD1-CE1 4.24Å; Y788-Y930 AromaticContact CD1-CE2 3.65Å; Y788-Y930 HydrophobicContact CD1-CE2 3.65Å; Y788-Y930 AromaticContact CD1-CZ 3.45Å; Y788-Y930 VanDerWaalsContact CD1-CZ 3.45Å; Y788-Y930 WeakPolarHBondContact CD1-OH 3.44Å; Y788-Y930 HydrophobicContact CD2-CE2 4.27Å; Y788-Y930 HydrophobicContact CE1-CD1 4.1Å; Y788-Y930 AromaticContact CE1-CD2 3.71Å; Y788-Y930 HydrophobicContact CE1-CD2 3.71Å; Y788-Y930 AromaticContact CE1-CE1 3.65Å; Y788-Y930 HydrophobicContact CE1-CE1 3.65Å; Y788-Y930 AromaticContact CE1-CE2 3.2Å; Y788-Y930 HydrophobicContact CE1-CE2 3.2Å; Y788-Y930 HydrophobicContact CE1-CG 4.12Å; Y788-Y930 AromaticContact CE1-CZ 3.15Å; Y788-Y930 WeakPolarHBondContact CE1-OH 3.32Å; Y788-Y930 HydrophobicContact CE2-CD2 4.14Å; Y788-Y930 AromaticContact CE2-CE2 3.88Å; Y788-Y930 HydrophobicContact CE2-CE2 3.88Å; Y788-Y930 HydrophobicContact CG-CE2 4.15Å; Y788-Y930 AromaticContact CZ-CD2 3.45Å; Y788-Y930 VanDerWaalsContact CZ-CD2 3.45Å; Y788-Y930 AromaticContact CZ-CE2 3.31Å; Y788-Y930 AromaticContact CZ-CZ 3.81Å; Y788-Y930 WeakPolarHBondContact O-CE2 3.44Å; Y788-Y930 PolarHBondContact O-OH 3.33Å; Y788-Y930 WeakPolarHBondContact OH-CA 3.47Å; Y788-Y930 VanDerWaalsContact OH-CD2 3.23Å; Y788-Y930 WeakPolarHBondContact OH-CD2 3.28Å; Y788-Y930 PolarHBondContact OH-O 2.68Å; S789-Y930 VanDerWaalsContact CA-OH 3.28Å; S789-Y930 WeakPolarHBondContact CA-OH 3.31Å; S789-Y930 PolarHBondContact N-OH 3.36Å; F796-Y930 HydrophobicContact CE2-CD1 4.38Å; A890-Y930 HydrophobicContact CB-CE1 4.2Å; A890-Y930 WeakPolarHBondContact O-CE1 3.46Å; V893-Y930 HydrophobicContact CB-CD1 4.24Å; V893-Y930 HydrophobicContact CB-CE1 4.45Å; V893-Y930 HydrophobicContact CG1-CD1 3.84Å; V893-Y930 HydrophobicContact CG1-CE1 4.46Å; C894-Y930 WeakPolarHBondContact SG-CE1 3.23Å; F926-Y930 HydrophobicContact CE1-CD2 4.11Å; F926-Y930 HydrophobicContact CE1-CG 4.39Å; F926-Y930 AromaticContact CZ-CD2 3.94Å; F926-Y930 HydrophobicContact CZ-CD2 3.94Å; F926-Y930 WeakPolarHBondContact O-CB 3.4Å; F926-Y930 PolarHBondContact O-N 2.86Å; T927-Y930 PolarHBondContact O-N 3.37Å; M928-Y930 PolarHBondContact O-N 3.34Å; Y930-L932 VanDerWaalsContact C-N 3.31Å; Y930-L932 PolarHBondContact O-N 2.84Å; Y930-L933 PolarHBondContact O-N 3.08Å; Y930-G934 PolarHBondContact O-N 3.15Å
931	S	78.4	Confident	78.5	Confident	29 Å²	29	59.9 Å²	59.9	20%	0.203	33%	0.33	C	S	.	.	H	α-helix	trans	-64.5	-31.8	178.4	70.9	0	0	0	0	113.9	T927 M928 L933 I935	T927-S931 WeakPolarHBondContact O-CB 3.43Å; T927-S931 PolarHBondContact O-N 3.49Å; T927-S931 PolarHBondContact O-OG 2.96Å; M928-S931 PolarHBondContact O-N 2.7Å; M928-S931 PolarHBondContact O-OG 3.42Å; S931-L933 VanDerWaalsContact C-N 3.33Å; S931-L933 PolarHBondContact O-N 2.66Å; S931-I935 WeakPolarHBondContact O-CB 3.46Å; S931-I935 VanDerWaalsContact O-CG1 3.3Å; S931-I935 WeakPolarHBondContact O-CG1 3.19Å; S931-I935 PolarHBondContact O-N 2.98Å; S931-I935 VanDerWaalsContact O-N 3.15Å
932	L	79.5	Confident	78.9	Confident	132 Å²	132	56.4 Å²	56.4	69%	0.691	30%	0.3	S	S	*	.	H	α-helix	trans	-63.8	-34.7	-178.6	-75.9	170.2	0	0	0	113.4	M928 A929 Y930 P936	M928-L932 PolarHBondContact O-N 3.46Å; A929-L932 PolarHBondContact O-N 2.89Å; Y930-L932 VanDerWaalsContact C-N 3.31Å; Y930-L932 PolarHBondContact O-N 2.84Å; L932-P936 WeakPolarHBondContact O-CD 3.34Å; L932-P936 VanDerWaalsContact O-CG 3.31Å; L932-P936 WeakPolarHBondContact O-CG 3.36Å
933	L	82.5	Confident	78.8	Confident	122 Å²	122	54.7 Å²	54.7	64%	0.639	29%	0.291	S	S	*	.	H	α-helix	trans	-94.8	-36.2	178.2	-65.1	173.3	0	0	0	111.9	Y788 Y930 S931 L937	Y788-L933 HydrophobicContact CE2-CB 4.39Å; Y930-L933 PolarHBondContact O-N 3.08Å; S931-L933 VanDerWaalsContact C-N 3.33Å; S931-L933 PolarHBondContact O-N 2.66Å; L933-L937 WeakPolarHBondContact O-CB 3.29Å; L933-L937 PolarHBondContact O-N 3.27Å
934	G	77.3	Confident	79.1	Confident	0 Å²	0	56.7 Å²	56.7	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-65.4	-43.6	-177.6	0	0	0	0	0	114.1	Y930 L938	Y930-G934 PolarHBondContact O-N 3.15Å; G934-L938 PolarHBondContact O-N 2.91Å
935	I	76.5	Confident	79.5	Confident	41 Å²	41	55.5 Å²	55.5	21%	0.21	29%	0.293	C	S	.	.	H	α-helix	trans	-66.5	-50.4	-175.9	-63	167.6	0	0	0	111.8	S931 L937 L938 L939	S931-I935 WeakPolarHBondContact O-CB 3.46Å; S931-I935 VanDerWaalsContact O-CG1 3.3Å; S931-I935 WeakPolarHBondContact O-CG1 3.19Å; S931-I935 PolarHBondContact O-N 2.98Å; S931-I935 VanDerWaalsContact O-N 3.15Å; I935-L937 VanDerWaalsContact C-N 3.32Å; I935-L937 PolarHBondContact O-N 3.07Å; I935-L938 PolarHBondContact O-N 3.36Å; I935-L939 HydrophobicContact CG2-CD1 4.13Å; I935-L939 HydrophobicContact CG2-CG 4.41Å; I935-L939 WeakPolarHBondContact O-CG 3.11Å; I935-L939 PolarHBondContact O-N 3.04Å
936	P	75.8	Confident	79.5	Confident	74 Å²	74	49.4 Å²	49.4	48%	0.481	26%	0.262	S	S	.	.	H	α-helix	trans	-60.9	-39.2	177.5	-24.3	35.2	0	0	0	113.3	L932 L939 Y940	L932-P936 WeakPolarHBondContact O-CD 3.34Å; L932-P936 VanDerWaalsContact O-CG 3.31Å; L932-P936 WeakPolarHBondContact O-CG 3.36Å; P936-L939 PolarHBondContact O-N 3.21Å; P936-Y940 PolarHBondContact O-N 3.41Å
937	L	78.4	Confident	79.2	Confident	45 Å²	45	49.2 Å²	49.2	24%	0.236	26%	0.264	C	S	.	.	H	α-helix	trans	-63.2	-42.9	177.1	-177.2	65.4	0	0	0	111.4	L785 L933 I935 Y940 I941	L785-L937 HydrophobicContact CB-CD2 4.31Å; L785-L937 HydrophobicContact CD1-CD2 4.15Å; L785-L937 HydrophobicContact CD1-CG 4.49Å; L933-L937 WeakPolarHBondContact O-CB 3.29Å; L933-L937 PolarHBondContact O-N 3.27Å; I935-L937 VanDerWaalsContact C-N 3.32Å; I935-L937 PolarHBondContact O-N 3.07Å; L937-Y940 PolarHBondContact O-N 3.41Å; L937-I941 HydrophobicContact CD1-CD1 4.45Å; L937-I941 HydrophobicContact CG-CD1 4.14Å; L937-I941 WeakPolarHBondContact O-CD1 3.49Å; L937-I941 VanDerWaalsContact O-CG1 3.32Å; L937-I941 WeakPolarHBondContact O-CG1 3.32Å; L937-I941 PolarHBondContact O-N 3.45Å; L937-I941 VanDerWaalsContact O-N 3.14Å
938	L	77	Confident	79.3	Confident	1 Å²	1	51.9 Å²	51.9	1%	0.005	28%	0.277	C	S	.	.	H	α-helix	trans	-62.8	-47.2	175.2	179.7	71.3	0	0	0	111.6	L785 C894 T895 G934 I935 Y940 I941 L942 L1065	L785-L938 HydrophobicContact CD2-CD1 4.04Å; C894-L938 WeakPolarHBondContact O-CD2 3.41Å; T895-L938 HydrophobicContact CG2-CD1 4.1Å; T895-L938 HydrophobicContact CG2-CD2 3.65Å; G934-L938 PolarHBondContact O-N 2.91Å; I935-L938 PolarHBondContact O-N 3.36Å; L938-Y940 VanDerWaalsContact C-N 3.27Å; L938-Y940 PolarHBondContact O-N 3.25Å; L938-I941 PolarHBondContact O-N 2.85Å; L938-I941 VanDerWaalsContact O-N 3.13Å; L938-L942 HydrophobicContact CD1-CD1 4.32Å; L938-L942 HydrophobicContact CD1-CG 4.19Å; L938-L942 HydrophobicContact CD2-CD1 4.18Å; L938-L942 HydrophobicContact CG-CD1 3.87Å; L938-L942 HydrophobicContact CG-CG 4.14Å; L938-L942 WeakPolarHBondContact O-CG 3.25Å; L938-L942 PolarHBondContact O-N 3.39Å; L938-L1065 HydrophobicContact CD1-CD2 3.55Å
939	L	75.2	Confident	79.4	Confident	81 Å²	81	46.7 Å²	46.7	42%	0.424	25%	0.252	S	S	.	.	H	α-helix	trans	-59.1	-40.1	-179.6	-70.9	176	0	0	0	111.8	I897 I935 P936 L942 D943	I897-L939 HydrophobicContact CG1-CD2 4.21Å; I897-L939 HydrophobicContact CG2-CD2 4.29Å; I935-L939 HydrophobicContact CG2-CD1 4.13Å; I935-L939 HydrophobicContact CG2-CG 4.41Å; I935-L939 WeakPolarHBondContact O-CG 3.11Å; I935-L939 PolarHBondContact O-N 3.04Å; P936-L939 PolarHBondContact O-N 3.21Å; L939-L942 PolarHBondContact O-N 3.39Å; L939-D943 PolarHBondContact O-N 3.46Å
940	Y	79.9	Confident	79	Confident	30 Å²	30	45.3 Å²	45.3	12%	0.118	24%	0.236	C	C	.	.	H	α-helix	trans	-61.7	-47.6	173.9	172.8	-114.7	0	0	0	112.3	F771 L774 P781 P936 L937 L938 L942 D943 E944	F771-Y940 HydrophobicContact CD1-CD2 4.1Å; F771-Y940 AromaticContact CD1-CE2 3.38Å; F771-Y940 HydrophobicContact CD1-CE2 3.38Å; F771-Y940 AromaticContact CD1-CZ 3.87Å; F771-Y940 AromaticContact CE1-CD2 3.3Å; F771-Y940 HydrophobicContact CE1-CD2 3.3Å; F771-Y940 AromaticContact CE1-CE2 3.03Å; F771-Y940 HydrophobicContact CE1-CE2 3.03Å; F771-Y940 HydrophobicContact CE1-CG 4.4Å; F771-Y940 AromaticContact CE1-CZ 3.94Å; F771-Y940 AromaticContact CZ-CD2 3.94Å; F771-Y940 HydrophobicContact CZ-CD2 3.94Å; F771-Y940 HydrophobicContact CZ-CE2 4.07Å; L774-Y940 HydrophobicContact CB-CE1 4.22Å; L774-Y940 WeakPolarHBondContact CB-OH 3.47Å; L774-Y940 HydrophobicContact CD1-CE1 3.96Å; L774-Y940 HydrophobicContact CD2-CE1 4.48Å; L774-Y940 HydrophobicContact CG-CE1 4.45Å; P781-Y940 HydrophobicContact CB-CD1 4.31Å; P781-Y940 HydrophobicContact CB-CE1 4.11Å; P781-Y940 HydrophobicContact CG-CD1 4.44Å; P781-Y940 HydrophobicContact CG-CE1 3.75Å; P936-Y940 PolarHBondContact O-N 3.41Å; L937-Y940 PolarHBondContact O-N 3.41Å; L938-Y940 VanDerWaalsContact C-N 3.27Å; L938-Y940 PolarHBondContact O-N 3.25Å; Y940-L942 VanDerWaalsContact C-N 3.31Å; Y940-L942 PolarHBondContact O-N 3.02Å; Y940-D943 PolarHBondContact O-N 3.21Å; Y940-E944 HydrophobicContact CD2-CG 4.35Å; Y940-E944 HydrophobicContact CE1-CG 4.32Å; Y940-E944 HydrophobicContact CE2-CG 3.66Å; Y940-E944 PolarHBondContact O-N 3.39Å
941	I	79.3	Confident	78.6	Confident	8 Å²	8	50.5 Å²	50.5	4%	0.041	26%	0.259	C	S	.	.	H	α-helix	trans	-60.9	-42.2	178.2	-68.4	163.8	0	0	0	110.9	P781 L785 L937 L938 W945	P781-I941 HydrophobicContact CB-CD1 4.04Å; P781-I941 HydrophobicContact CB-CG1 3.62Å; P781-I941 WeakPolarHBondContact O-CD1 3.46Å; L785-I941 HydrophobicContact CB-CD1 3.66Å; L785-I941 HydrophobicContact CD2-CD1 3.76Å; L785-I941 HydrophobicContact CG-CD1 4.17Å; L937-I941 HydrophobicContact CD1-CD1 4.45Å; L937-I941 HydrophobicContact CG-CD1 4.14Å; L937-I941 WeakPolarHBondContact O-CD1 3.49Å; L937-I941 VanDerWaalsContact O-CG1 3.32Å; L937-I941 WeakPolarHBondContact O-CG1 3.32Å; L937-I941 PolarHBondContact O-N 3.45Å; L937-I941 VanDerWaalsContact O-N 3.14Å; L938-I941 PolarHBondContact O-N 2.85Å; L938-I941 VanDerWaalsContact O-N 3.13Å; I941-W945 HydrophobicContact CG2-CG 4.33Å; I941-W945 VanDerWaalsContact O-CB 3.28Å; I941-W945 WeakPolarHBondContact O-CB 3.32Å; I941-W945 VanDerWaalsContact O-CD1 3.23Å; I941-W945 PolarHBondContact O-N 3.43Å
942	L	78.7	Confident	78.6	Confident	10 Å²	10	53.6 Å²	53.6	5%	0.052	27%	0.273	C	S	.	.	H	α-helix	trans	-65.2	-36.5	178.7	-70	176.8	0	0	0	112.4	I897 L938 L939 Y940 G946 L1068 A1069 S1072	I897-L942 HydrophobicContact CD1-CD1 3.91Å; L938-L942 HydrophobicContact CD1-CD1 4.32Å; L938-L942 HydrophobicContact CD1-CG 4.19Å; L938-L942 HydrophobicContact CD2-CD1 4.18Å; L938-L942 HydrophobicContact CG-CD1 3.87Å; L938-L942 HydrophobicContact CG-CG 4.14Å; L938-L942 WeakPolarHBondContact O-CG 3.25Å; L938-L942 PolarHBondContact O-N 3.39Å; L939-L942 PolarHBondContact O-N 3.39Å; Y940-L942 VanDerWaalsContact C-N 3.31Å; Y940-L942 PolarHBondContact O-N 3.02Å; L942-G946 PolarHBondContact O-N 2.97Å; L942-L1068 HydrophobicContact CD1-CB 4.22Å; L942-L1068 HydrophobicContact CD2-CB 3.64Å; L942-A1069 HydrophobicContact CD2-CB 4.21Å; L942-S1072 VanDerWaalsContact O-CB 3.28Å; L942-S1072 WeakPolarHBondContact O-CB 3.32Å; L942-S1072 PolarHBondContact O-OG 3.42Å
943	D	75.8	Confident	78.4	Confident	80 Å²	80	48.6 Å²	48.6	43%	0.428	25%	0.247	S	C	.	.	H	α-helix	trans	-70.2	-48.3	175.5	-173	47.9	0	0	0	111.9	L939 Y940 W945 G946 T947 N1076	L939-D943 PolarHBondContact O-N 3.46Å; Y940-D943 PolarHBondContact O-N 3.21Å; D943-W945 PolarHBondContact O-N 3.01Å; D943-G946 PolarHBondContact O-N 3.31Å; D943-T947 WeakPolarHBondContact O-CG2 3.27Å; D943-T947 PolarHBondContact O-N 2.89Å; D943-T947 PolarHBondContact O-OG1 3.26Å; D943-N1076 PolarHBondContact OD1-ND2 3.35Å
944	E	79.6	Confident	77.8	Confident	43 Å²	43	45.6 Å²	45.6	20%	0.201	23%	0.228	C	C	.	.	H	α-helix	trans	-55.5	-49.1	173.6	-90.9	-82.5	154.2	0	0	111.9	Y940 T947 L948	Y940-E944 HydrophobicContact CD2-CG 4.35Å; Y940-E944 HydrophobicContact CE1-CG 4.32Å; Y940-E944 HydrophobicContact CE2-CG 3.66Å; Y940-E944 PolarHBondContact O-N 3.39Å; E944-T947 PolarHBondContact O-N 3.41Å; E944-T947 PolarHBondContact O-OG1 2.92Å; E944-L948 WeakPolarHBondContact O-CB 3.44Å; E944-L948 PolarHBondContact O-N 3.37Å
945	W	83.8	Confident	77.6	Confident	82 Å²	82	54.5 Å²	54.5	31%	0.311	26%	0.262	S	S	.	.	H	α-helix	trans	-69.5	-36.2	179.8	-78.3	42.2	0	0	0	112.1	L782 I941 D943 L948 L949 A1069	L782-W945 HydrophobicContact CD1-CH2 4.1Å; L782-W945 HydrophobicContact CD1-CZ2 3.72Å; L782-W945 HydrophobicContact CD2-CH2 4.33Å; L782-W945 HydrophobicContact CD2-CZ2 3.94Å; L782-W945 HydrophobicContact CG-CZ2 4.27Å; I941-W945 HydrophobicContact CG2-CG 4.33Å; I941-W945 VanDerWaalsContact O-CB 3.28Å; I941-W945 WeakPolarHBondContact O-CB 3.32Å; I941-W945 VanDerWaalsContact O-CD1 3.23Å; I941-W945 PolarHBondContact O-N 3.43Å; D943-W945 PolarHBondContact O-N 3.01Å; W945-L948 PolarHBondContact O-N 3.33Å; W945-L949 WeakPolarHBondContact O-CB 3.47Å; W945-L949 WeakPolarHBondContact O-CG 3.42Å; W945-L949 PolarHBondContact O-N 2.95Å; W945-A1069 HydrophobicContact CB-CB 3.76Å; W945-A1069 HydrophobicContact CE3-CB 4.36Å
946	G	79.7	Confident	77.5	Confident	0 Å²	0	56.7 Å²	56.7	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-61.7	-45.3	173.9	0	0	0	0	0	112.3	L942 D943 L949 M950 A1069 M1073	L942-G946 PolarHBondContact O-N 2.97Å; D943-G946 PolarHBondContact O-N 3.31Å; G946-L949 PolarHBondContact O-N 3.41Å; G946-M950 PolarHBondContact O-N 3.15Å; G946-A1069 WeakPolarHBondContact CA-O 3.5Å; G946-M1073 WeakPolarHBondContact O-CB 3.47Å; G946-M1073 WeakPolarHBondContact O-CG 3.45Å
947	T	78.6	Confident	77.2	Confident	42 Å²	42	55.7 Å²	55.7	26%	0.258	27%	0.265	S	S	.	.	H	α-helix	trans	-68.5	-33.8	175.8	64.1	0	0	0	0	112.5	D943 E944 M950 K951	D943-T947 WeakPolarHBondContact O-CG2 3.27Å; D943-T947 PolarHBondContact O-N 2.89Å; D943-T947 PolarHBondContact O-OG1 3.26Å; E944-T947 PolarHBondContact O-N 3.41Å; E944-T947 PolarHBondContact O-OG1 2.92Å; T947-M950 WeakPolarHBondContact O-CB 3.29Å; T947-M950 PolarHBondContact O-N 3.13Å; T947-K951 WeakPolarHBondContact O-CG 3.49Å; T947-K951 PolarHBondContact O-N 3.3Å
948	L	80.2	Confident	76.5	Confident	77 Å²	77	61.6 Å²	61.6	40%	0.403	29%	0.285	S	S	.	.	H	α-helix	trans	-66.7	-44.4	174.9	-170.9	145.8	0	0	0	111.7	E944 W945 M950 K951 L952	E944-L948 WeakPolarHBondContact O-CB 3.44Å; E944-L948 PolarHBondContact O-N 3.37Å; W945-L948 PolarHBondContact O-N 3.33Å; L948-M950 VanDerWaalsContact C-N 3.28Å; L948-M950 PolarHBondContact O-N 3.11Å; L948-K951 PolarHBondContact O-N 3.08Å; L948-L952 WeakPolarHBondContact O-CB 3.46Å; L948-L952 PolarHBondContact O-N 2.95Å
949	L	81.4	Confident	76.4	Confident	22 Å²	22	66.1 Å²	66.1	12%	0.115	31%	0.309	C	S	.	.	H	α-helix	trans	-60.4	-39.2	173	-78.5	165.6	0	0	0	111.3	W945 G946 L952 M953 F1066 A1069 Q1070 M1073	W945-L949 WeakPolarHBondContact O-CB 3.47Å; W945-L949 WeakPolarHBondContact O-CG 3.42Å; W945-L949 PolarHBondContact O-N 2.95Å; G946-L949 PolarHBondContact O-N 3.41Å; L949-L952 PolarHBondContact O-N 2.95Å; L949-M953 PolarHBondContact O-N 3.48Å; L949-F1066 HydrophobicContact CD2-CE2 4.14Å; L949-F1066 HydrophobicContact CD2-CZ 3.89Å; L949-A1069 HydrophobicContact CD1-CB 4.06Å; L949-Q1070 HydrophobicContact CD1-CB 4.22Å; L949-M1073 HydrophobicContact CB-CB 4.16Å; L949-M1073 HydrophobicContact CB-CG 4.09Å; L949-M1073 HydrophobicContact CB-SD 3.76Å
950	M	76.2	Confident	76	Confident	24 Å²	24	70.3 Å²	70.3	12%	0.118	32%	0.319	C	S	.	.	H	α-helix	trans	-61.2	-48	174.4	-160.8	-166.6	-70.2	0	0	111.7	G946 T947 L948 L952 M953 F954 M1073 N1076 L1077	G946-M950 PolarHBondContact O-N 3.15Å; T947-M950 WeakPolarHBondContact O-CB 3.29Å; T947-M950 PolarHBondContact O-N 3.13Å; L948-M950 VanDerWaalsContact C-N 3.28Å; L948-M950 PolarHBondContact O-N 3.11Å; M950-L952 VanDerWaalsContact C-N 3.31Å; M950-L952 PolarHBondContact O-N 2.85Å; M950-M953 PolarHBondContact O-N 3.24Å; M950-F954 HydrophobicContact CB-CE2 4.33Å; M950-F954 HydrophobicContact CG-CD2 4.32Å; M950-F954 HydrophobicContact CG-CE2 3.44Å; M950-F954 VanDerWaalsContact CG-CE2 3.44Å; M950-F954 HydrophobicContact CG-CZ 3.6Å; M950-F954 WeakPolarHBondContact O-CD2 3.29Å; M950-F954 WeakPolarHBondContact O-CG 3.27Å; M950-F954 PolarHBondContact O-N 3.22Å; M950-F954 HydrophobicContact SD-CE2 3.7Å; M950-F954 HydrophobicContact SD-CZ 3.76Å; M950-M1073 HydrophobicContact CB-CE 4.18Å; M950-M1073 HydrophobicContact CB-CG 3.91Å; M950-M1073 HydrophobicContact CG-CE 4.12Å; M950-M1073 HydrophobicContact CG-CG 4.47Å; M950-N1076 HydrophobicContact CE-CB 3.37Å; M950-L1077 HydrophobicContact CE-CB 4.29Å
951	K	76.6	Confident	75.3	Confident	118 Å²	118	71.3 Å²	71.3	51%	0.513	33%	0.327	S	S	.	.	H	α-helix	trans	-60.2	-38.8	175.1	-72.2	170.2	-175.7	165.7	0	112.2	T947 L948 F954 R955	T947-K951 WeakPolarHBondContact O-CG 3.49Å; T947-K951 PolarHBondContact O-N 3.3Å; L948-K951 PolarHBondContact O-N 3.08Å; K951-F954 PolarHBondContact O-N 3.02Å; K951-R955 PolarHBondContact O-N 3.39Å
952	L	78.1	Confident	74.6	Confident	94 Å²	94	74.1 Å²	74.1	49%	0.492	35%	0.351	S	S	.	.	H	α-helix	trans	-65.6	-45.2	175.6	-173.8	69.9	0	0	0	111.1	L948 L949 M950 F954 R955 V956	L948-L952 WeakPolarHBondContact O-CB 3.46Å; L948-L952 PolarHBondContact O-N 2.95Å; L949-L952 PolarHBondContact O-N 2.95Å; M950-L952 VanDerWaalsContact C-N 3.31Å; M950-L952 PolarHBondContact O-N 2.85Å; L952-F954 VanDerWaalsContact C-N 3.3Å; L952-F954 PolarHBondContact O-N 2.95Å; L952-R955 PolarHBondContact O-N 3.09Å; L952-R955 VanDerWaalsContact O-N 3.09Å; L952-V956 HydrophobicContact CG-CG2 4.48Å; L952-V956 WeakPolarHBondContact O-CG2 3.44Å; L952-V956 PolarHBondContact O-N 3.05Å
953	M	75.1	Confident	73.8	Confident	27 Å²	27	82.2 Å²	82.2	13%	0.133	39%	0.385	C	S	.	.	H	α-helix	trans	-60.6	-38.5	175.3	-81	-167	51.4	0	0	112.3	L949 M950 V956 K957 V979 L983 A984 L987 M1073	L949-M953 PolarHBondContact O-N 3.48Å; M950-M953 PolarHBondContact O-N 3.24Å; M953-V956 PolarHBondContact O-N 2.99Å; M953-K957 WeakPolarHBondContact O-CB 3.48Å; M953-K957 PolarHBondContact O-N 3.47Å; M953-V979 HydrophobicContact CE-CG1 3.95Å; M953-L983 HydrophobicContact CE-CD2 3.79Å; M953-L983 HydrophobicContact CE-CG 3.93Å; M953-A984 HydrophobicContact CE-CB 4.44Å; M953-L987 HydrophobicContact CE-CD1 3.61Å; M953-L987 HydrophobicContact CG-CD1 4.29Å; M953-L987 HydrophobicContact SD-CD1 3.35Å; M953-L987 WeakPolarHBondContact SD-CD1 3.15Å; M953-M1073 HydrophobicContact CB-CE 3.92Å; M953-M1073 HydrophobicContact CE-CE 3.89Å; M953-M1073 HydrophobicContact CG-CE 3.8Å; M953-M1073 HydrophobicContact CG-SD 4.17Å; M953-M1073 HydrophobicContact SD-CE 3.05Å; M953-M1073 WeakPolarHBondContact SD-CE 3.48Å; M953-M1073 HydrophobicContact SD-SD 3.51Å
954	F	70.5	Confident	73.1	Confident	59 Å²	59	82.1 Å²	82.1	26%	0.259	39%	0.388	S	S	.	.	H	α-helix	trans	-62.1	-42.9	171.9	-63.9	-49.5	0	0	0	112.1	M950 K951 L952 K957 Y958 V976 V979	M950-F954 HydrophobicContact CB-CE2 4.33Å; M950-F954 HydrophobicContact CG-CD2 4.32Å; M950-F954 HydrophobicContact CG-CE2 3.44Å; M950-F954 VanDerWaalsContact CG-CE2 3.44Å; M950-F954 HydrophobicContact CG-CZ 3.6Å; M950-F954 WeakPolarHBondContact O-CD2 3.29Å; M950-F954 WeakPolarHBondContact O-CG 3.27Å; M950-F954 PolarHBondContact O-N 3.22Å; M950-F954 HydrophobicContact SD-CE2 3.7Å; M950-F954 HydrophobicContact SD-CZ 3.76Å; K951-F954 PolarHBondContact O-N 3.02Å; L952-F954 VanDerWaalsContact C-N 3.3Å; L952-F954 PolarHBondContact O-N 2.95Å; F954-K957 PolarHBondContact O-N 3.39Å; F954-Y958 WeakPolarHBondContact O-CB 3.38Å; F954-Y958 PolarHBondContact O-N 2.79Å; F954-V976 HydrophobicContact CE1-CB 4.28Å; F954-V976 HydrophobicContact CE1-CG1 3.96Å; F954-V976 HydrophobicContact CE1-CG2 4.3Å; F954-V976 HydrophobicContact CE2-CG2 4.16Å; F954-V976 HydrophobicContact CZ-CB 4Å; F954-V976 HydrophobicContact CZ-CG1 3.53Å; F954-V976 HydrophobicContact CZ-CG2 3.71Å; F954-V979 HydrophobicContact CD1-CG2 3.49Å; F954-V979 VanDerWaalsContact CD1-CG2 3.49Å; F954-V979 HydrophobicContact CE1-CB 4.21Å; F954-V979 HydrophobicContact CE1-CG2 3.4Å; F954-V979 VanDerWaalsContact CE1-CG2 3.4Å
955	R	72.4	Confident	71.6	Confident	186 Å²	186	87 Å²	87	70%	0.702	41%	0.412	S	S	*	.	H	α-helix	trans	-65	-42.6	176.5	-77.4	-162.7	174.8	-169	0.4	112.5	K951 L952 Y958 I959	K951-R955 PolarHBondContact O-N 3.39Å; L952-R955 PolarHBondContact O-N 3.09Å; L952-R955 VanDerWaalsContact O-N 3.09Å; R955-Y958 WeakPolarHBondContact O-CB 3.48Å; R955-Y958 PolarHBondContact O-N 3.42Å; R955-I959 VanDerWaalsContact O-CG1 3.25Å; R955-I959 WeakPolarHBondContact O-CG1 3.1Å; R955-I959 PolarHBondContact O-N 3.33Å
956	V	74.7	Confident	69.8	Low	88 Å²	88	87.3 Å²	87.3	53%	0.533	44%	0.441	S	S	.	.	H	α-helix	trans	-63.7	-43.7	177.3	173.4	0	0	0	0	110.1	L952 M953 Y958 I959 W960	L952-V956 HydrophobicContact CG-CG2 4.48Å; L952-V956 WeakPolarHBondContact O-CG2 3.44Å; L952-V956 PolarHBondContact O-N 3.05Å; M953-V956 PolarHBondContact O-N 2.99Å; V956-Y958 PolarHBondContact O-N 3.31Å; V956-I959 PolarHBondContact O-N 2.96Å; V956-W960 WeakPolarHBondContact O-CB 3.4Å; V956-W960 PolarHBondContact O-N 3.19Å
957	K	69.5	Low	68	Low	52 Å²	52	90.9 Å²	90.9	23%	0.226	47%	0.471	C	S	.	.	H	α-helix	trans	-63.3	-41	175.3	-172.5	175.4	-179.7	-175.5	0	112	M953 F954 I959 W960 N961 D978 V979	M953-K957 WeakPolarHBondContact O-CB 3.48Å; M953-K957 PolarHBondContact O-N 3.47Å; F954-K957 PolarHBondContact O-N 3.39Å; K957-I959 PolarHBondContact O-N 2.91Å; K957-W960 PolarHBondContact O-N 2.88Å; K957-N961 WeakPolarHBondContact O-CB 3.41Å; K957-N961 PolarHBondContact O-N 3.43Å; K957-D978 VanDerWaalsContact NZ-C 3.32Å; K957-D978 PolarHBondContact NZ-O 3.43Å; K957-V979 HydrophobicContact CD-CG2 4.09Å
958	Y	65.1	Low	65.9	Low	169 Å²	169	95.3 Å²	95.3	66%	0.663	50%	0.504	S	S	*	.	H	α-helix	trans	-58.6	-47.4	174.3	175	-98.7	0	0	0	111.4	F954 R955 V956 W960 A962	F954-Y958 WeakPolarHBondContact O-CB 3.38Å; F954-Y958 PolarHBondContact O-N 2.79Å; R955-Y958 WeakPolarHBondContact O-CB 3.48Å; R955-Y958 PolarHBondContact O-N 3.42Å; V956-Y958 PolarHBondContact O-N 3.31Å; Y958-W960 VanDerWaalsContact C-N 3.33Å; Y958-W960 PolarHBondContact O-N 3.41Å; Y958-A962 WeakPolarHBondContact O-CB 3.49Å; Y958-A962 PolarHBondContact O-N 3.17Å
959	I	73	Confident	63.9	Low	96 Å²	96	98.1 Å²	98.1	49%	0.492	52%	0.524	S	S	.	.	H	α-helix	trans	-64.8	-38.3	177.1	-65.5	163.8	0	0	0	111	R955 V956 K957 A962 K963	R955-I959 VanDerWaalsContact O-CG1 3.25Å; R955-I959 WeakPolarHBondContact O-CG1 3.1Å; R955-I959 PolarHBondContact O-N 3.33Å; V956-I959 PolarHBondContact O-N 2.96Å; K957-I959 PolarHBondContact O-N 2.91Å; I959-A962 PolarHBondContact O-N 2.93Å; I959-K963 WeakPolarHBondContact O-CB 3.26Å; I959-K963 PolarHBondContact O-N 3.43Å
960	W	66.9	Low	61.7	Low	170 Å²	170	106 Å²	106	64%	0.644	56%	0.559	S	S	*	*	H	α-helix	trans	-69	-46.5	179.5	-163.1	69.6	0	0	0	111.7	V956 K957 Y958 A962 K963 T964	V956-W960 WeakPolarHBondContact O-CB 3.4Å; V956-W960 PolarHBondContact O-N 3.19Å; K957-W960 PolarHBondContact O-N 2.88Å; Y958-W960 VanDerWaalsContact C-N 3.33Å; Y958-W960 PolarHBondContact O-N 3.41Å; W960-A962 VanDerWaalsContact C-N 3.32Å; W960-A962 PolarHBondContact O-N 3.21Å; W960-K963 PolarHBondContact O-N 2.98Å; W960-K963 VanDerWaalsContact O-N 3.15Å; W960-T964 HydrophobicContact CD2-CG2 4.29Å; W960-T964 HydrophobicContact CZ2-CG2 4.21Å; W960-T964 WeakPolarHBondContact O-CB 3.3Å; W960-T964 PolarHBondContact O-N 3.45Å; W960-T964 PolarHBondContact O-OG1 3.29Å
961	N	65.5	Low	59.7	Low	51 Å²	51	114.4 Å²	114.4	27%	0.273	60%	0.598	S	S	.	*	H	α-helix	trans	-62.1	-40.1	174.1	-80.2	5	0	0	0	111.2	K957 K963 T964 M965	K957-N961 WeakPolarHBondContact O-CB 3.41Å; K957-N961 PolarHBondContact O-N 3.43Å; N961-K963 VanDerWaalsContact C-N 3.26Å; N961-K963 PolarHBondContact O-N 3.23Å; N961-T964 PolarHBondContact O-N 2.91Å; N961-M965 WeakPolarHBondContact O-CB 3.13Å; N961-M965 PolarHBondContact O-N 2.87Å
962	A	64.3	Low	57.7	Low	66 Å²	66	119.1 Å²	119.1	55%	0.545	61%	0.613	S	S	.	*	H	α-helix	trans	-64.4	-28.6	175.8	0	0	0	0	0	113.2	Y958 I959 W960	Y958-A962 WeakPolarHBondContact O-CB 3.49Å; Y958-A962 PolarHBondContact O-N 3.17Å; I959-A962 PolarHBondContact O-N 2.93Å; W960-A962 VanDerWaalsContact C-N 3.32Å; W960-A962 PolarHBondContact O-N 3.21Å
963	K	63.7	Low	55.9	Low	180 Å²	180	120.8 Å²	120.8	78%	0.783	63%	0.626	S	S	*	*	H	α-helix	trans	-90.9	-24.8	177.4	-89.4	-176.8	172.8	-178.6	0	114.7	I959 W960 N961	I959-K963 WeakPolarHBondContact O-CB 3.26Å; I959-K963 PolarHBondContact O-N 3.43Å; W960-K963 PolarHBondContact O-N 2.98Å; W960-K963 VanDerWaalsContact O-N 3.15Å; N961-K963 VanDerWaalsContact C-N 3.26Å; N961-K963 PolarHBondContact O-N 3.23Å
964	T	60.5	Low	54.5	Low	78 Å²	78	126.2 Å²	126.2	48%	0.479	65%	0.651	S	S	.	*	H	α-helix	trans	-101.2	-23.5	-175.6	47.6	0	0	0	0	113.9	W960 N961	W960-T964 HydrophobicContact CD2-CG2 4.29Å; W960-T964 HydrophobicContact CZ2-CG2 4.21Å; W960-T964 WeakPolarHBondContact O-CB 3.3Å; W960-T964 PolarHBondContact O-N 3.45Å; W960-T964 PolarHBondContact O-OG1 3.29Å; N961-T964 PolarHBondContact O-N 2.91Å
965	M	47.8	Very low	53.5	Low	146 Å²	146	126.7 Å²	126.7	72%	0.719	66%	0.659	S	S	*	*			trans	-112.8	87.7	176.3	-67.8	-105.9	-149.2	0	0	109.4	N961 A967	N961-M965 WeakPolarHBondContact O-CB 3.13Å; N961-M965 PolarHBondContact O-N 2.87Å; M965-A967 PolarHBondContact O-N 2.79Å
966	G	45.9	Very low	52.7	Low	89 Å²	89	119.7 Å²	119.7	92%	0.918	64%	0.637	S	S	*	*			trans	-72.3	37.5	176.9	0	0	0	0	0	115.1
967	A	41.2	Very low	51.8	Low	75 Å²	75	118.7 Å²	118.7	62%	0.62	63%	0.629	S	S	*	*	S	Bend	trans	-140.3	122.1	-178.2	0	0	0	0	0	112.3	M965 T969	M965-A967 PolarHBondContact O-N 2.79Å; A967-T969 PolarHBondContact O-N 3.42Å; A967-T969 VanDerWaalsContact O-N 3.11Å
968	S	35	Very low	51.5	Low	135 Å²	135	119.8 Å²	119.8	94%	0.944	64%	0.637	S	S	*	*			trans	-54.9	106.5	171.7	-73.4	0	0	0	0	111.7
969	T	37.5	Very low	51.7	Low	135 Å²	135	111.9 Å²	111.9	83%	0.828	61%	0.606	S	S	*	*			trans	-125	111.2	162.2	34.5	0	0	0	0	109.9	A967	A967-T969 PolarHBondContact O-N 3.42Å; A967-T969 VanDerWaalsContact O-N 3.11Å
970	H	36	Very low	51.7	Low	187 Å²	187	109.5 Å²	109.5	87%	0.866	60%	0.597	S	S	*	*			trans	0.7	127.4	165.3	-102.6	-94.2	0	0	0	118.6	R972	H970-R972 VanDerWaalsContact C-N 3.32Å; H970-R972 PolarHBondContact O-N 2.85Å
971	H	35.4	Very low	52.2	Low	202 Å²	202	102.5 Å²	102.5	94%	0.935	57%	0.572	S	S	*	*			trans	-24.4	76.5	158.4	-98.3	-56	0	0	0	115.6
972	R	34.5	Very low	52.9	Low	217 Å²	217	103.3 Å²	103.3	82%	0.819	58%	0.582	S	S	*	*			trans	-99.2	123.6	157.2	-124.6	-177.8	-78.5	-168.5	-3	106.3	H970 H974	H970-R972 VanDerWaalsContact C-N 3.32Å; H970-R972 PolarHBondContact O-N 2.85Å; R972-H974 PolarHBondContact O-N 2.93Å
973	V	40.2	Very low	53.9	Low	128 Å²	128	103.4 Å²	103.4	78%	0.776	57%	0.573	S	S	*	*			trans	-50.6	105.6	174.5	177.2	0	0	0	0	106.8	T975	V973-T975 VanDerWaalsContact C-N 3.27Å; V973-T975 HydrophobicContact CG1-CG2 4.08Å; V973-T975 PolarHBondContact O-N 3.34Å
974	H	44.4	Very low	54.8	Low	142 Å²	142	94.9 Å²	94.9	66%	0.657	54%	0.536	S	S	*	.			trans	-70	93.2	175	-84.3	-71.6	0	0	0	106.9	R972 D978	R972-H974 PolarHBondContact O-N 2.93Å; H974-D978 IonicContact CE1-OD2 2.8Å; H974-D978 IonicContact CG-OD2 3.77Å; H974-D978 IonicContact ND1-OD2 3.52Å; H974-D978 PolarHBondContact ND1-OD2 3.4Å
975	T	50.6	Low	56	Low	68 Å²	68	95.8 Å²	95.8	42%	0.417	54%	0.538	S	S	.	.			trans	-71.7	157.5	174	48.1	0	0	0	0	109.1	V973 D977 D978	V973-T975 VanDerWaalsContact C-N 3.27Å; V973-T975 HydrophobicContact CG1-CG2 4.08Å; V973-T975 PolarHBondContact O-N 3.34Å; T975-D977 VanDerWaalsContact CB-OD2 3.26Å; T975-D977 WeakPolarHBondContact CB-OD2 3.16Å; T975-D977 PolarHBondContact O-N 2.89Å; T975-D977 PolarHBondContact OG1-OD2 2.96Å; T975-D978 PolarHBondContact O-N 2.75Å
976	V	54.1	Low	58	Low	39 Å²	39	93.4 Å²	93.4	24%	0.236	53%	0.527	C	S	.	.	G	3₁₀ helix	trans	-51.9	-20.5	179.8	171.8	0	0	0	0	112.9	F954 D978 V979 L1077 H1080	F954-V976 HydrophobicContact CE1-CB 4.28Å; F954-V976 HydrophobicContact CE1-CG1 3.96Å; F954-V976 HydrophobicContact CE1-CG2 4.3Å; F954-V976 HydrophobicContact CE2-CG2 4.16Å; F954-V976 HydrophobicContact CZ-CB 4Å; F954-V976 HydrophobicContact CZ-CG1 3.53Å; F954-V976 HydrophobicContact CZ-CG2 3.71Å; V976-D978 PolarHBondContact O-N 3.49Å; V976-V979 PolarHBondContact O-N 3.16Å; V976-L1077 HydrophobicContact CG1-CD1 4.16Å; V976-H1080 VanDerWaalsContact CB-CD2 3.46Å; V976-H1080 WeakPolarHBondContact CB-CD2 3.09Å; V976-H1080 WeakPolarHBondContact CB-NE2 3.42Å; V976-H1080 WeakPolarHBondContact CG1-CD2 3.39Å
977	D	57.3	Low	60	Low	68 Å²	68	92.1 Å²	92.1	36%	0.364	50%	0.499	S	S	.	.	G	3₁₀ helix	trans	-46	-31	177.2	-55.4	-27.1	0	0	0	114.3	T975 V979 V1084	T975-D977 VanDerWaalsContact CB-OD2 3.26Å; T975-D977 WeakPolarHBondContact CB-OD2 3.16Å; T975-D977 PolarHBondContact O-N 2.89Å; T975-D977 PolarHBondContact OG1-OD2 2.96Å; D977-V979 PolarHBondContact O-N 2.7Å; D977-V1084 WeakPolarHBondContact OD1-CG1 3.08Å; D977-V1084 WeakPolarHBondContact OD1-CG2 3.05Å
978	D	62.9	Low	62.1	Low	74 Å²	74	89.5 Å²	89.5	40%	0.396	47%	0.474	S	S	.	.	G	3₁₀ helix	trans	-75	-21	-172.7	-81	-22.4	0	0	0	114.7	K957 H974 T975 V976 P980	K957-D978 VanDerWaalsContact NZ-C 3.32Å; K957-D978 PolarHBondContact NZ-O 3.43Å; H974-D978 IonicContact CE1-OD2 2.8Å; H974-D978 IonicContact CG-OD2 3.77Å; H974-D978 IonicContact ND1-OD2 3.52Å; H974-D978 PolarHBondContact ND1-OD2 3.4Å; T975-D978 PolarHBondContact O-N 2.75Å; V976-D978 PolarHBondContact O-N 3.49Å; D978-P980 VanDerWaalsContact O-CD 3.25Å; D978-P980 WeakPolarHBondContact O-CD 3.3Å
979	V	68.8	Low	64.7	Low	4 Å²	4	88.6 Å²	88.6	2%	0.024	45%	0.453	C	S	.	.	S	Bend	trans	-80.5	115.5	-177.9	179.1	0	0	0	0	109.9	M953 F954 K957 V976 D977 L981 L1077 K1081	M953-V979 HydrophobicContact CE-CG1 3.95Å; F954-V979 HydrophobicContact CD1-CG2 3.49Å; F954-V979 VanDerWaalsContact CD1-CG2 3.49Å; F954-V979 HydrophobicContact CE1-CB 4.21Å; F954-V979 HydrophobicContact CE1-CG2 3.4Å; F954-V979 VanDerWaalsContact CE1-CG2 3.4Å; K957-V979 HydrophobicContact CD-CG2 4.09Å; V976-V979 PolarHBondContact O-N 3.16Å; D977-V979 PolarHBondContact O-N 2.7Å; V979-L981 PolarHBondContact O-N 2.9Å; V979-L1077 HydrophobicContact CB-CD1 4.49Å; V979-L1077 HydrophobicContact CG1-CD2 4.16Å; V979-K1081 WeakPolarHBondContact O-CE 3.4Å; V979-K1081 PolarHBondContact O-NZ 2.68Å
980	P	73.3	Confident	67.3	Low	46 Å²	46	86.6 Å²	86.6	30%	0.299	44%	0.437	S	S	.	.			trans	-69.4	130.8	179.2	29.4	-32.9	0	0	0	109.2	D978 S982 L983	D978-P980 VanDerWaalsContact O-CD 3.25Å; D978-P980 WeakPolarHBondContact O-CD 3.3Å; P980-S982 PolarHBondContact O-N 3.23Å; P980-S982 VanDerWaalsContact O-N 3.14Å; P980-L983 HydrophobicContact CG-CB 3.92Å; P980-L983 WeakPolarHBondContact O-CB 3.25Å; P980-L983 PolarHBondContact O-N 2.59Å
981	L	77.7	Confident	70	Confident	22 Å²	22	80.2 Å²	80.2	12%	0.115	41%	0.405	C	S	.	.	H	α-helix	trans	-58	-29.5	178.2	-178.5	64.9	0	0	0	111	V979 L983 A984 L985 L1077 L1078 K1081 F1136	V979-L981 PolarHBondContact O-N 2.9Å; L981-L983 VanDerWaalsContact C-N 3.27Å; L981-L983 PolarHBondContact O-N 3.22Å; L981-A984 PolarHBondContact O-N 2.74Å; L981-L985 HydrophobicContact CD2-CD1 4.49Å; L981-L985 HydrophobicContact CG-CD1 4.09Å; L981-L985 HydrophobicContact CG-CG 4.29Å; L981-L985 WeakPolarHBondContact O-CG 3.23Å; L981-L985 PolarHBondContact O-N 3.5Å; L981-L1077 HydrophobicContact CD1-CD2 3.97Å; L981-L1077 HydrophobicContact CD1-CG 4.25Å; L981-L1078 HydrophobicContact CD2-CD1 3.66Å; L981-K1081 HydrophobicContact CB-CD 4.27Å; L981-F1136 HydrophobicContact CD2-CE1 4.12Å; L981-F1136 HydrophobicContact CD2-CZ 4.13Å
982	S	80.5	Confident	72.5	Confident	69 Å²	69	71 Å²	71	48%	0.483	36%	0.363	S	S	.	.	H	α-helix	trans	-58.2	-34.7	173	55.8	0	0	0	0	113.2	P980 L986	P980-S982 PolarHBondContact O-N 3.23Å; P980-S982 VanDerWaalsContact O-N 3.14Å; S982-L986 WeakPolarHBondContact O-CB 3.34Å; S982-L986 PolarHBondContact O-N 2.69Å
983	L	84.3	Confident	75.2	Confident	68 Å²	68	62 Å²	62	36%	0.356	33%	0.332	S	S	.	.	H	α-helix	trans	-69.1	-41.9	176.4	-178.7	68.7	0	0	0	111.3	M953 P980 L981 L986 L987	M953-L983 HydrophobicContact CE-CD2 3.79Å; M953-L983 HydrophobicContact CE-CG 3.93Å; P980-L983 HydrophobicContact CG-CB 3.92Å; P980-L983 WeakPolarHBondContact O-CB 3.25Å; P980-L983 PolarHBondContact O-N 2.59Å; L981-L983 VanDerWaalsContact C-N 3.27Å; L981-L983 PolarHBondContact O-N 3.22Å; L983-L986 PolarHBondContact O-N 3.4Å; L983-L987 HydrophobicContact CG-CD1 4.34Å; L983-L987 WeakPolarHBondContact O-CB 3.2Å; L983-L987 VanDerWaalsContact O-CG 3.32Å; L983-L987 WeakPolarHBondContact O-CG 3.11Å; L983-L987 PolarHBondContact O-N 3.31Å
984	A	83.3	Confident	77.7	Confident	1 Å²	1	59.9 Å²	59.9	1%	0.008	32%	0.316	C	S	.	.	H	α-helix	trans	-64.7	-44.3	176.6	0	0	0	0	0	111.3	M953 L981 L986 L987 Q988 L1077	M953-A984 HydrophobicContact CE-CB 4.44Å; L981-A984 PolarHBondContact O-N 2.74Å; A984-L986 PolarHBondContact O-N 3.49Å; A984-L987 PolarHBondContact O-N 3.14Å; A984-Q988 PolarHBondContact O-N 3.47Å; A984-L1077 HydrophobicContact CB-CD2 3.7Å
985	L	86.1	Confident	79.7	Confident	97 Å²	97	53.1 Å²	53.1	51%	0.508	29%	0.285	S	S	.	.	H	α-helix	trans	-64.6	-37.6	174.8	-67.8	174.7	0	0	0	112.4	L981 Q988 F989	L981-L985 HydrophobicContact CD2-CD1 4.49Å; L981-L985 HydrophobicContact CG-CD1 4.09Å; L981-L985 HydrophobicContact CG-CG 4.29Å; L981-L985 WeakPolarHBondContact O-CG 3.23Å; L981-L985 PolarHBondContact O-N 3.5Å; L985-Q988 WeakPolarHBondContact O-CB 3.43Å; L985-Q988 PolarHBondContact O-N 2.82Å; L985-F989 WeakPolarHBondContact O-CB 3.39Å; L985-F989 PolarHBondContact O-N 3.49Å
986	L	88.4	Confident	81.3	Confident	95 Å²	95	49.9 Å²	49.9	50%	0.497	27%	0.265	S	S	.	.	H	α-helix	trans	-66.5	-43.2	175.4	-179.7	131.5	0	0	0	111.2	S982 L983 A984 Q988 F989 L990	S982-L986 WeakPolarHBondContact O-CB 3.34Å; S982-L986 PolarHBondContact O-N 2.69Å; L983-L986 PolarHBondContact O-N 3.4Å; A984-L986 PolarHBondContact O-N 3.49Å; L986-Q988 VanDerWaalsContact C-N 3.28Å; L986-Q988 PolarHBondContact O-N 3.01Å; L986-F989 PolarHBondContact O-N 3.02Å; L986-L990 HydrophobicContact CD2-CD1 3.66Å; L986-L990 HydrophobicContact CD2-CG 4.38Å; L986-L990 HydrophobicContact CG-CD1 4.34Å; L986-L990 WeakPolarHBondContact O-CB 3.25Å; L986-L990 VanDerWaalsContact O-CG 3.3Å; L986-L990 WeakPolarHBondContact O-CG 3.22Å; L986-L990 PolarHBondContact O-N 3.38Å
987	L	88	Confident	83	Confident	62 Å²	62	50 Å²	50	33%	0.325	27%	0.27	S	S	.	.	H	α-helix	trans	-61.9	-38.5	172.8	-72	169.3	0	0	0	111.2	M953 L983 A984 F989 L990 W991 Q1070	M953-L987 HydrophobicContact CE-CD1 3.61Å; M953-L987 HydrophobicContact CG-CD1 4.29Å; M953-L987 HydrophobicContact SD-CD1 3.35Å; M953-L987 WeakPolarHBondContact SD-CD1 3.15Å; L983-L987 HydrophobicContact CG-CD1 4.34Å; L983-L987 WeakPolarHBondContact O-CB 3.2Å; L983-L987 VanDerWaalsContact O-CG 3.32Å; L983-L987 WeakPolarHBondContact O-CG 3.11Å; L983-L987 PolarHBondContact O-N 3.31Å; A984-L987 PolarHBondContact O-N 3.14Å; L987-F989 VanDerWaalsContact C-N 3.34Å; L987-L990 PolarHBondContact O-N 3.11Å; L987-W991 WeakPolarHBondContact O-CB 3.44Å; L987-W991 PolarHBondContact O-N 2.96Å; L987-Q1070 PolarHBondContact O-NE2 2.98Å
988	Q	86.9	Confident	84.4	Confident	20 Å²	20	49.6 Å²	49.6	9%	0.093	27%	0.268	C	S	.	.	H	α-helix	trans	-63.8	-43	176.4	-171.7	67	15	0	0	110.8	A984 L985 L986 W991 L992 G1067 Q1070	A984-Q988 PolarHBondContact O-N 3.47Å; L985-Q988 WeakPolarHBondContact O-CB 3.43Å; L985-Q988 PolarHBondContact O-N 2.82Å; L986-Q988 VanDerWaalsContact C-N 3.28Å; L986-Q988 PolarHBondContact O-N 3.01Å; Q988-W991 PolarHBondContact O-N 2.93Å; Q988-L992 WeakPolarHBondContact O-CB 3.24Å; Q988-L992 PolarHBondContact O-N 3.19Å; Q988-G1067 PolarHBondContact NE2-O 3.45Å; Q988-G1067 VanDerWaalsContact NE2-O 3.09Å; Q988-Q1070 VanDerWaalsContact CA-NE2 3.33Å
989	F	89.3	Confident	85.3	Confident	116 Å²	116	46.1 Å²	46.1	51%	0.509	25%	0.249	S	C	.	.	H	α-helix	trans	-65.3	-41.3	176.4	-176.5	-95.8	0	0	0	112.2	L985 L986 L987 L992 C993 F1012	L985-F989 WeakPolarHBondContact O-CB 3.39Å; L985-F989 PolarHBondContact O-N 3.49Å; L986-F989 PolarHBondContact O-N 3.02Å; L987-F989 VanDerWaalsContact C-N 3.34Å; F989-L992 WeakPolarHBondContact O-CB 3.46Å; F989-L992 PolarHBondContact O-N 2.87Å; F989-C993 VanDerWaalsContact CE1-SG 3.5Å; F989-C993 PolarHBondContact O-N 2.81Å; F989-C993 PolarHBondContact O-SG 3.32Å; F989-F1012 HydrophobicContact CE2-CE2 4.22Å; F989-F1012 AromaticContact CE2-CZ 3.9Å; F989-F1012 HydrophobicContact CE2-CZ 3.9Å
990	L	92	Very high	85.9	Confident	94 Å²	94	49.7 Å²	49.7	49%	0.492	27%	0.266	S	S	.	.	H	α-helix	trans	-64.9	-41.6	175.3	-72.5	174.4	0	0	0	111.7	L986 L987 L992 C993 L994	L986-L990 HydrophobicContact CD2-CD1 3.66Å; L986-L990 HydrophobicContact CD2-CG 4.38Å; L986-L990 HydrophobicContact CG-CD1 4.34Å; L986-L990 WeakPolarHBondContact O-CB 3.25Å; L986-L990 VanDerWaalsContact O-CG 3.3Å; L986-L990 WeakPolarHBondContact O-CG 3.22Å; L986-L990 PolarHBondContact O-N 3.38Å; L987-L990 PolarHBondContact O-N 3.11Å; L990-L992 VanDerWaalsContact C-N 3.32Å; L990-L992 PolarHBondContact O-N 3.31Å; L990-C993 PolarHBondContact O-N 2.97Å; L990-L994 WeakPolarHBondContact O-CB 3.5Å; L990-L994 PolarHBondContact O-N 3.47Å
991	W	91.1	Very high	86.4	Confident	52 Å²	52	50.9 Å²	50.9	20%	0.197	28%	0.275	C	S	.	.	H	α-helix	trans	-64.2	-38.9	175.3	-172.8	-104	0	0	0	111.9	L987 Q988 L994 S995 F1019 L1063 F1066	L987-W991 WeakPolarHBondContact O-CB 3.44Å; L987-W991 PolarHBondContact O-N 2.96Å; Q988-W991 PolarHBondContact O-N 2.93Å; W991-L994 HydrophobicContact CE3-CD2 3.95Å; W991-L994 HydrophobicContact CZ3-CD2 3.84Å; W991-L994 PolarHBondContact O-N 3.33Å; W991-S995 PolarHBondContact NE1-OG 3.2Å; W991-S995 VanDerWaalsContact O-CB 3.3Å; W991-S995 WeakPolarHBondContact O-CB 3.44Å; W991-S995 PolarHBondContact O-N 3.03Å; W991-S995 PolarHBondContact O-OG 3.39Å; W991-F1019 AromaticContact CD1-CE2 3.58Å; W991-F1019 AromaticContact CD1-CZ 3.74Å; W991-F1019 AromaticContact NE1-CZ 3.9Å; W991-L1063 HydrophobicContact CH2-CD2 4.3Å; W991-L1063 HydrophobicContact CZ2-CD2 3.81Å; W991-L1063 PolarHBondContact NE1-O 2.84Å; W991-F1066 AromaticContact CD2-CD1 3.68Å; W991-F1066 HydrophobicContact CD2-CD1 3.68Å; W991-F1066 AromaticContact CD2-CE1 3.9Å; W991-F1066 HydrophobicContact CD2-CE1 3.9Å; W991-F1066 AromaticContact CE2-CD1 3.29Å; W991-F1066 AromaticContact CE2-CE1 3.99Å; W991-F1066 HydrophobicContact CE3-CD1 4.06Å; W991-F1066 AromaticContact CE3-CE1 3.89Å; W991-F1066 HydrophobicContact CE3-CE1 3.89Å; W991-F1066 HydrophobicContact CG-CD1 4.32Å; W991-F1066 AromaticContact CH2-CD1 3.74Å; W991-F1066 HydrophobicContact CH2-CD1 3.74Å; W991-F1066 HydrophobicContact CH2-CE1 4.04Å; W991-F1066 HydrophobicContact CH2-CG 4.22Å; W991-F1066 HydrophobicContact CZ2-CB 3.85Å; W991-F1066 AromaticContact CZ2-CD1 3.33Å; W991-F1066 HydrophobicContact CZ2-CD1 3.33Å; W991-F1066 HydrophobicContact CZ2-CE1 4.07Å; W991-F1066 AromaticContact CZ2-CG 3.78Å; W991-F1066 HydrophobicContact CZ2-CG 3.78Å; W991-F1066 HydrophobicContact CZ3-CD1 4.08Å; W991-F1066 AromaticContact CZ3-CE1 3.96Å; W991-F1066 HydrophobicContact CZ3-CE1 3.96Å; W991-F1066 AromaticContact NE1-CD1 3.71Å
992	L	89.1	Confident	86.5	Confident	10 Å²	10	52.6 Å²	52.6	5%	0.052	28%	0.28	C	S	.	.	H	α-helix	trans	-60.4	-47.1	172.6	177.4	66.8	0	0	0	111.6	Q988 F989 L990 L994 S995 A996 F1012 F1015 F1016 F1019	Q988-L992 WeakPolarHBondContact O-CB 3.24Å; Q988-L992 PolarHBondContact O-N 3.19Å; F989-L992 WeakPolarHBondContact O-CB 3.46Å; F989-L992 PolarHBondContact O-N 2.87Å; L990-L992 VanDerWaalsContact C-N 3.32Å; L990-L992 PolarHBondContact O-N 3.31Å; L992-L994 PolarHBondContact O-N 2.79Å; L992-S995 PolarHBondContact O-N 2.9Å; L992-A996 WeakPolarHBondContact O-CB 3.46Å; L992-A996 PolarHBondContact O-N 2.94Å; L992-F1012 HydrophobicContact CD2-CD2 4.24Å; L992-F1012 HydrophobicContact CD2-CE1 3.87Å; L992-F1012 HydrophobicContact CD2-CE2 3.49Å; L992-F1012 VanDerWaalsContact CD2-CE2 3.49Å; L992-F1012 HydrophobicContact CD2-CZ 3.27Å; L992-F1012 HydrophobicContact CG-CD2 3.96Å; L992-F1012 HydrophobicContact CG-CE2 3.59Å; L992-F1012 HydrophobicContact CG-CZ 3.92Å; L992-F1015 VanDerWaalsContact CD1-C 3.46Å; L992-F1015 HydrophobicContact CD1-CB 3.43Å; L992-F1015 VanDerWaalsContact CD1-CB 3.43Å; L992-F1016 HydrophobicContact CD1-CB 4.1Å; L992-F1016 VanDerWaalsContact CD1-N 3.33Å; L992-F1016 HydrophobicContact CD2-CB 4.18Å; L992-F1016 HydrophobicContact CD2-CD2 3.74Å; L992-F1016 HydrophobicContact CD2-CG 4.46Å; L992-F1019 HydrophobicContact CB-CD2 4.3Å; L992-F1019 HydrophobicContact CB-CE2 4.24Å; L992-F1019 HydrophobicContact CD1-CD2 3.91Å; L992-F1019 HydrophobicContact CD1-CE2 4.06Å
993	C	91.2	Very high	86.1	Confident	26 Å²	26	49.7 Å²	49.7	18%	0.176	26%	0.259	C	S	.	.	H	α-helix	trans	-63.1	-40.8	176.8	-66.5	0	0	0	0	112.4	F989 L990 A997 Y1008	F989-C993 VanDerWaalsContact CE1-SG 3.5Å; F989-C993 PolarHBondContact O-N 2.81Å; F989-C993 PolarHBondContact O-SG 3.32Å; L990-C993 PolarHBondContact O-N 2.97Å; C993-A997 WeakPolarHBondContact O-CB 3.39Å; C993-A997 PolarHBondContact O-N 3.46Å; C993-Y1008 VanDerWaalsContact CA-OH 3.24Å; C993-Y1008 WeakPolarHBondContact CA-OH 3.39Å; C993-Y1008 WeakPolarHBondContact CB-OH 3.28Å; C993-Y1008 PolarHBondContact O-OH 3.16Å
994	L	91.4	Very high	85.4	Confident	84 Å²	84	55.7 Å²	55.7	44%	0.44	28%	0.282	S	S	.	.	H	α-helix	trans	-67	-44.5	178.1	-178.8	67.6	0	0	0	111.3	L990 W991 L992 A996 A997 L998	L990-L994 WeakPolarHBondContact O-CB 3.5Å; L990-L994 PolarHBondContact O-N 3.47Å; W991-L994 HydrophobicContact CE3-CD2 3.95Å; W991-L994 HydrophobicContact CZ3-CD2 3.84Å; W991-L994 PolarHBondContact O-N 3.33Å; L992-L994 PolarHBondContact O-N 2.79Å; L994-A996 VanDerWaalsContact C-N 3.32Å; L994-A996 PolarHBondContact O-N 2.95Å; L994-A997 PolarHBondContact O-N 3.1Å; L994-L998 HydrophobicContact CD1-CD1 4.49Å; L994-L998 HydrophobicContact CD1-CG 4.45Å; L994-L998 HydrophobicContact CG-CD1 4.13Å; L994-L998 HydrophobicContact CG-CG 4.48Å; L994-L998 WeakPolarHBondContact O-CB 3.38Å; L994-L998 WeakPolarHBondContact O-CG 3.38Å; L994-L998 PolarHBondContact O-N 3.33Å
995	S	86.3	Confident	84.6	Confident	0 Å²	0	61 Å²	61	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-61	-43.5	177.8	-57.8	0	0	0	0	110.7	W991 L992 A997 L998 F999 F1015	W991-S995 PolarHBondContact NE1-OG 3.2Å; W991-S995 VanDerWaalsContact O-CB 3.3Å; W991-S995 WeakPolarHBondContact O-CB 3.44Å; W991-S995 PolarHBondContact O-N 3.03Å; W991-S995 PolarHBondContact O-OG 3.39Å; L992-S995 PolarHBondContact O-N 2.9Å; S995-A997 PolarHBondContact O-N 2.89Å; S995-L998 PolarHBondContact O-N 3.43Å; S995-F999 WeakPolarHBondContact O-CB 3.33Å; S995-F999 PolarHBondContact O-N 3.41Å; S995-F1015 VanDerWaalsContact C-CE2 3.42Å; S995-F1015 WeakPolarHBondContact O-CE2 3.4Å
996	A	85.5	Confident	83.6	Confident	0 Å²	0	57.6 Å²	57.6	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-61.6	-41.6	174.2	0	0	0	0	0	112.8	L992 L994 Q1000 Y1008 S1011 F1012	L992-A996 WeakPolarHBondContact O-CB 3.46Å; L992-A996 PolarHBondContact O-N 2.94Å; L994-A996 VanDerWaalsContact C-N 3.32Å; L994-A996 PolarHBondContact O-N 2.95Å; A996-Q1000 WeakPolarHBondContact O-CB 3.45Å; A996-Q1000 PolarHBondContact O-N 3.29Å; A996-Y1008 HydrophobicContact CB-CD2 4.17Å; A996-Y1008 HydrophobicContact CB-CE2 3.63Å; A996-S1011 WeakPolarHBondContact O-CB 3.18Å; A996-F1012 HydrophobicContact CB-CB 3.88Å; A996-F1012 HydrophobicContact CB-CD2 4.35Å
997	A	88.9	Confident	82.9	Confident	42 Å²	42	58.4 Å²	58.4	35%	0.347	30%	0.299	S	S	.	.	H	α-helix	trans	-68.8	-42.6	179.3	0	0	0	0	0	112	C993 L994 S995 Q1000 S1001 Y1008	C993-A997 WeakPolarHBondContact O-CB 3.39Å; C993-A997 PolarHBondContact O-N 3.46Å; L994-A997 PolarHBondContact O-N 3.1Å; S995-A997 PolarHBondContact O-N 2.89Å; A997-Q1000 PolarHBondContact O-N 3.04Å; A997-S1001 WeakPolarHBondContact O-CB 3.38Å; A997-S1001 PolarHBondContact O-N 2.87Å; A997-Y1008 HydrophobicContact CB-CE2 3.95Å
998	L	88.2	Confident	82.7	Confident	59 Å²	59	59.6 Å²	59.6	31%	0.309	30%	0.299	S	S	.	.	H	α-helix	trans	-62.5	-44.5	175.5	-73.5	173.4	0	0	0	110.9	L994 S995 S1001 W1002 L1063	L994-L998 HydrophobicContact CD1-CD1 4.49Å; L994-L998 HydrophobicContact CD1-CG 4.45Å; L994-L998 HydrophobicContact CG-CD1 4.13Å; L994-L998 HydrophobicContact CG-CG 4.48Å; L994-L998 WeakPolarHBondContact O-CB 3.38Å; L994-L998 WeakPolarHBondContact O-CG 3.38Å; L994-L998 PolarHBondContact O-N 3.33Å; S995-L998 PolarHBondContact O-N 3.43Å; L998-S1001 WeakPolarHBondContact O-CB 3.45Å; L998-S1001 PolarHBondContact O-N 3.39Å; L998-S1001 VanDerWaalsContact O-N 3.14Å; L998-S1001 PolarHBondContact O-OG 3.16Å; L998-W1002 PolarHBondContact O-N 2.91Å; L998-W1002 VanDerWaalsContact O-N 3.13Å; L998-L1063 HydrophobicContact CB-CD1 4.41Å; L998-L1063 HydrophobicContact CD1-CD1 4.43Å; L998-L1063 HydrophobicContact CD1-CD2 4.03Å
999	F	81.1	Confident	82.3	Confident	2 Å²	2	65.3 Å²	65.3	1%	0.009	32%	0.324	C	S	.	.	H	α-helix	trans	-65.8	-41.6	178	-171.2	-95.5	0	0	0	112.6	S995 S1001 W1002 E1003 V1006 F1015 V1049 P1051 C1060	S995-F999 WeakPolarHBondContact O-CB 3.33Å; S995-F999 PolarHBondContact O-N 3.41Å; F999-S1001 PolarHBondContact O-N 3.19Å; F999-W1002 PolarHBondContact O-N 2.75Å; F999-W1002 VanDerWaalsContact O-N 3.16Å; F999-E1003 HydrophobicContact CE1-CB 4.27Å; F999-E1003 PolarHBondContact O-N 2.98Å; F999-V1006 HydrophobicContact CE1-CB 4.43Å; F999-V1006 HydrophobicContact CE1-CG1 4.25Å; F999-V1006 HydrophobicContact CE1-CG2 4.34Å; F999-F1015 HydrophobicContact CB-CE2 3.58Å; F999-F1015 HydrophobicContact CB-CZ 4.12Å; F999-F1015 HydrophobicContact CD2-CE2 4.4Å; F999-F1015 HydrophobicContact CD2-CZ 4.38Å; F999-F1015 HydrophobicContact CG-CE2 4.04Å; F999-F1015 HydrophobicContact CG-CZ 4.46Å; F999-V1049 HydrophobicContact CE1-CG1 3.72Å; F999-V1049 HydrophobicContact CZ-CG1 3.77Å; F999-P1051 HydrophobicContact CE2-CB 4.27Å; F999-P1051 HydrophobicContact CE2-CG 4.48Å; F999-P1051 HydrophobicContact CZ-CB 4.45Å; F999-C1060 VanDerWaalsContact CD2-SG 3.58Å
1000	Q	81.4	Confident	81.1	Confident	78 Å²	78	60.1 Å²	60.1	36%	0.364	30%	0.302	S	S	.	.	H	α-helix	trans	-60.4	-35	172	-174.3	-174.5	12.9	0	0	112	A996 A997 W1002 E1003 Y1008	A996-Q1000 WeakPolarHBondContact O-CB 3.45Å; A996-Q1000 PolarHBondContact O-N 3.29Å; A997-Q1000 PolarHBondContact O-N 3.04Å; Q1000-W1002 VanDerWaalsContact C-N 3.31Å; Q1000-W1002 PolarHBondContact O-N 3.1Å; Q1000-E1003 CarbonylContact O-C 3.58Å; Q1000-Y1008 VanDerWaalsContact OE1-CB 3.31Å
1001	S	83.9	Confident	80.4	Confident	72 Å²	72	55.7 Å²	55.7	50%	0.503	28%	0.279	S	S	.	.	H	α-helix	trans	-67.8	-31.8	177.4	81.8	0	0	0	0	113	A997 L998 F999	A997-S1001 WeakPolarHBondContact O-CB 3.38Å; A997-S1001 PolarHBondContact O-N 2.87Å; L998-S1001 WeakPolarHBondContact O-CB 3.45Å; L998-S1001 PolarHBondContact O-N 3.39Å; L998-S1001 VanDerWaalsContact O-N 3.14Å; L998-S1001 PolarHBondContact O-OG 3.16Å; F999-S1001 PolarHBondContact O-N 3.19Å
1002	W	80.1	Confident	80.1	Confident	58 Å²	58	55.1 Å²	55.1	22%	0.22	28%	0.278	C	S	.	.	H	α-helix	trans	-82.1	-39.8	177.5	-62.7	-17	0	0	0	112.1	L998 F999 Q1000 Y1056 L1059 L1063	L998-W1002 PolarHBondContact O-N 2.91Å; L998-W1002 VanDerWaalsContact O-N 3.13Å; F999-W1002 PolarHBondContact O-N 2.75Å; F999-W1002 VanDerWaalsContact O-N 3.16Å; Q1000-W1002 VanDerWaalsContact C-N 3.31Å; Q1000-W1002 PolarHBondContact O-N 3.1Å; W1002-Y1056 HydrophobicContact CB-CD1 4.45Å; W1002-Y1056 HydrophobicContact CB-CD2 3.81Å; W1002-Y1056 HydrophobicContact CB-CE2 4.06Å; W1002-Y1056 HydrophobicContact CB-CG 4.07Å; W1002-Y1056 HydrophobicContact CD2-CD1 4.06Å; W1002-Y1056 HydrophobicContact CD2-CG 4.2Å; W1002-Y1056 HydrophobicContact CE3-CD1 4.42Å; W1002-Y1056 HydrophobicContact CE3-CG 4.29Å; W1002-Y1056 HydrophobicContact CG-CD1 4.07Å; W1002-Y1056 HydrophobicContact CG-CD2 4.3Å; W1002-Y1056 HydrophobicContact CG-CE1 4.28Å; W1002-Y1056 HydrophobicContact CG-CG 4.12Å; W1002-L1059 HydrophobicContact CH2-CB 3.49Å; W1002-L1059 VanDerWaalsContact CH2-CB 3.49Å; W1002-L1059 HydrophobicContact CH2-CD1 4.26Å; W1002-L1059 HydrophobicContact CH2-CG 4.37Å; W1002-L1059 HydrophobicContact CZ2-CB 4.28Å; W1002-L1059 HydrophobicContact CZ2-CD1 4.25Å; W1002-L1059 HydrophobicContact CZ3-CB 3.67Å; W1002-L1063 HydrophobicContact CH2-CD1 3.92Å; W1002-L1063 HydrophobicContact CZ3-CD1 4Å
1003	E	71.3	Confident	79.2	Confident	8 Å²	8	57 Å²	57	4%	0.037	29%	0.285	C	S	.	.			trans	-114	81.1	-175.7	-156.4	76	-156.6	0	0	109.7	F999 Q1000 D1005 V1006 P1051 K1052	F999-E1003 HydrophobicContact CE1-CB 4.27Å; F999-E1003 PolarHBondContact O-N 2.98Å; Q1000-E1003 CarbonylContact O-C 3.58Å; E1003-D1005 PolarHBondContact O-N 3.14Å; E1003-V1006 HydrophobicContact CB-CB 4.47Å; E1003-V1006 HydrophobicContact CB-CG2 4.11Å; E1003-V1006 HydrophobicContact CG-CB 4.39Å; E1003-V1006 HydrophobicContact CG-CG2 3.54Å; E1003-V1006 PolarHBondContact O-N 3.44Å; E1003-P1051 WeakPolarHBondContact OE2-CA 3.43Å; E1003-P1051 WeakPolarHBondContact OE2-CB 3.33Å; E1003-K1052 VanDerWaalsContact CD-N 3.34Å; E1003-K1052 WeakPolarHBondContact OE1-CB 3.37Å; E1003-K1052 WeakPolarHBondContact OE1-CD 3.15Å; E1003-K1052 WeakPolarHBondContact OE1-CG 3.45Å; E1003-K1052 PolarHBondContact OE1-N 3.28Å; E1003-K1052 PolarHBondContact OE2-N 3.17Å
1004	K	69.5	Low	78	Confident	193 Å²	193	57.5 Å²	57.5	84%	0.839	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	-17.5	-176.3	-67.1	-175.4	179.4	179.3	0	114.6
1005	D	66.7	Low	77.4	Confident	114 Å²	114	53.5 Å²	53.5	61%	0.61	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89	-3	-178.8	-62.8	-34.9	0	0	0	113.7	E1003 K1052	E1003-D1005 PolarHBondContact O-N 3.14Å; D1005-K1052 IonicContact OD2-NZ 3.59Å; D1005-K1052 PolarHBondContact OD2-NZ 2.96Å
1006	V	65.1	Low	77.1	Confident	24 Å²	24	57.6 Å²	57.6	15%	0.145	28%	0.281	C	S	.	.	S	Bend	trans	-108.9	124.2	-178.4	-177.4	0	0	0	0	110.1	F999 E1003 S1011 V1049	F999-V1006 HydrophobicContact CE1-CB 4.43Å; F999-V1006 HydrophobicContact CE1-CG1 4.25Å; F999-V1006 HydrophobicContact CE1-CG2 4.34Å; E1003-V1006 HydrophobicContact CB-CB 4.47Å; E1003-V1006 HydrophobicContact CB-CG2 4.11Å; E1003-V1006 HydrophobicContact CG-CB 4.39Å; E1003-V1006 HydrophobicContact CG-CG2 3.54Å; E1003-V1006 PolarHBondContact O-N 3.44Å; V1006-S1011 WeakPolarHBondContact CG1-OG 3.48Å; V1006-V1049 HydrophobicContact CG1-CG1 4.43Å; V1006-V1049 HydrophobicContact CG2-CG1 4.16Å
1007	D	74.5	Confident	76.1	Confident	113 Å²	113	60 Å²	60	60%	0.604	29%	0.294	S	S	*	.			trans	-60.5	150	177.1	-62.3	-36.7	0	0	0	111.8	F1009 S1010 S1011	D1007-F1009 PolarHBondContact O-N 3.46Å; D1007-S1010 VanDerWaalsContact O-CB 3.31Å; D1007-S1010 WeakPolarHBondContact O-CB 3.23Å; D1007-S1010 PolarHBondContact O-N 3.08Å; D1007-S1010 VanDerWaalsContact O-N 3.1Å; D1007-S1011 PolarHBondContact O-N 3.24Å; D1007-S1011 PolarHBondContact O-OG 2.68Å
1008	Y	83.4	Confident	75.1	Confident	87 Å²	87	59.6 Å²	59.6	34%	0.341	29%	0.288	S	S	.	.	H	α-helix	trans	-55.1	-41.6	178	-176.9	-105.4	0	0	0	112.1	C993 A996 A997 Q1000 S1010 S1011 F1012	C993-Y1008 VanDerWaalsContact CA-OH 3.24Å; C993-Y1008 WeakPolarHBondContact CA-OH 3.39Å; C993-Y1008 WeakPolarHBondContact CB-OH 3.28Å; C993-Y1008 PolarHBondContact O-OH 3.16Å; A996-Y1008 HydrophobicContact CB-CD2 4.17Å; A996-Y1008 HydrophobicContact CB-CE2 3.63Å; A997-Y1008 HydrophobicContact CB-CE2 3.95Å; Q1000-Y1008 VanDerWaalsContact OE1-CB 3.31Å; Y1008-S1010 PolarHBondContact O-N 3.04Å; Y1008-S1011 WeakPolarHBondContact O-CB 3.17Å; Y1008-S1011 PolarHBondContact O-N 3.42Å; Y1008-F1012 HydrophobicContact CE1-CD2 4.47Å; Y1008-F1012 WeakPolarHBondContact O-CB 3.39Å; Y1008-F1012 PolarHBondContact O-N 3.26Å
1009	F	78.7	Confident	74.5	Confident	139 Å²	139	57 Å²	57	61%	0.61	27%	0.274	S	S	*	.	H	α-helix	trans	-64.4	-40.2	179.3	-175.4	-98.7	0	0	0	112.3	D1007 S1011 F1012 Y1013	D1007-F1009 PolarHBondContact O-N 3.46Å; F1009-S1011 VanDerWaalsContact C-N 3.31Å; F1009-S1011 PolarHBondContact O-N 3.1Å; F1009-F1012 PolarHBondContact O-N 3.44Å; F1009-Y1013 VanDerWaalsContact O-CB 3.3Å; F1009-Y1013 WeakPolarHBondContact O-CB 3.3Å; F1009-Y1013 PolarHBondContact O-N 3.15Å
1010	S	64.2	Low	73.9	Confident	8 Å²	8	58.8 Å²	58.8	6%	0.056	29%	0.285	C	S	.	.	H	α-helix	trans	-61.1	-42.8	174	-60.3	0	0	0	0	111.3	D1007 Y1008 F1014 L1044	D1007-S1010 VanDerWaalsContact O-CB 3.31Å; D1007-S1010 WeakPolarHBondContact O-CB 3.23Å; D1007-S1010 PolarHBondContact O-N 3.08Å; D1007-S1010 VanDerWaalsContact O-N 3.1Å; Y1008-S1010 PolarHBondContact O-N 3.04Å; S1010-F1014 WeakPolarHBondContact O-CB 3.35Å; S1010-F1014 PolarHBondContact O-N 2.93Å; S1010-L1044 VanDerWaalsContact OG-CD1 3.27Å; S1010-L1044 WeakPolarHBondContact OG-CD1 3.44Å; S1010-L1044 WeakPolarHBondContact OG-CD2 3.49Å
1011	S	76.5	Confident	73	Confident	0 Å²	0	58.3 Å²	58.3	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-65.6	-44	176.1	-52.1	0	0	0	0	111.6	A996 V1006 D1007 Y1008 F1009 F1014 F1015	A996-S1011 WeakPolarHBondContact O-CB 3.18Å; V1006-S1011 WeakPolarHBondContact CG1-OG 3.48Å; D1007-S1011 PolarHBondContact O-N 3.24Å; D1007-S1011 PolarHBondContact O-OG 2.68Å; Y1008-S1011 WeakPolarHBondContact O-CB 3.17Å; Y1008-S1011 PolarHBondContact O-N 3.42Å; F1009-S1011 VanDerWaalsContact C-N 3.31Å; F1009-S1011 PolarHBondContact O-N 3.1Å; S1011-F1014 PolarHBondContact O-N 3.25Å; S1011-F1015 VanDerWaalsContact O-CD2 3.26Å; S1011-F1015 WeakPolarHBondContact O-CD2 3.34Å; S1011-F1015 PolarHBondContact O-N 3.18Å
1012	F	84.3	Confident	71.6	Confident	41 Å²	41	59.5 Å²	59.5	18%	0.18	29%	0.288	C	S	.	.	H	α-helix	trans	-63.4	-45.7	176.3	-177	-83.9	0	0	0	112	F989 L992 A996 Y1008 F1009 F1014 F1015 F1016	F989-F1012 HydrophobicContact CE2-CE2 4.22Å; F989-F1012 AromaticContact CE2-CZ 3.9Å; F989-F1012 HydrophobicContact CE2-CZ 3.9Å; L992-F1012 HydrophobicContact CD2-CD2 4.24Å; L992-F1012 HydrophobicContact CD2-CE1 3.87Å; L992-F1012 HydrophobicContact CD2-CE2 3.49Å; L992-F1012 VanDerWaalsContact CD2-CE2 3.49Å; L992-F1012 HydrophobicContact CD2-CZ 3.27Å; L992-F1012 HydrophobicContact CG-CD2 3.96Å; L992-F1012 HydrophobicContact CG-CE2 3.59Å; L992-F1012 HydrophobicContact CG-CZ 3.92Å; A996-F1012 HydrophobicContact CB-CB 3.88Å; A996-F1012 HydrophobicContact CB-CD2 4.35Å; Y1008-F1012 HydrophobicContact CE1-CD2 4.47Å; Y1008-F1012 WeakPolarHBondContact O-CB 3.39Å; Y1008-F1012 PolarHBondContact O-N 3.26Å; F1009-F1012 PolarHBondContact O-N 3.44Å; F1012-F1014 VanDerWaalsContact C-N 3.34Å; F1012-F1014 PolarHBondContact O-N 2.85Å; F1012-F1015 PolarHBondContact O-N 2.81Å; F1012-F1016 HydrophobicContact CE1-CB 4.45Å; F1012-F1016 VanDerWaalsContact O-CB 3.26Å; F1012-F1016 WeakPolarHBondContact O-CB 3.47Å; F1012-F1016 PolarHBondContact O-N 2.79Å
1013	Y	70.3	Confident	70.1	Confident	48 Å²	48	58.4 Å²	58.4	19%	0.188	29%	0.294	C	S	.	.	H	α-helix	trans	-59.6	-45.1	176.8	178.6	-101.6	0	0	0	111.3	F1009 F1016 I1017 V1045	F1009-Y1013 VanDerWaalsContact O-CB 3.3Å; F1009-Y1013 WeakPolarHBondContact O-CB 3.3Å; F1009-Y1013 PolarHBondContact O-N 3.15Å; Y1013-F1016 PolarHBondContact O-N 3.33Å; Y1013-I1017 HydrophobicContact CD1-CD1 4.48Å; Y1013-I1017 HydrophobicContact CD2-CG2 4.33Å; Y1013-I1017 HydrophobicContact CE1-CD1 4.01Å; Y1013-I1017 HydrophobicContact CE1-CG2 4.18Å; Y1013-I1017 HydrophobicContact CE2-CG2 3.83Å; Y1013-I1017 WeakPolarHBondContact O-CG1 3.01Å; Y1013-I1017 PolarHBondContact O-N 2.82Å; Y1013-V1045 HydrophobicContact CE1-CG2 4.41Å
1014	F	67	Low	68.6	Low	37 Å²	37	62.4 Å²	62.4	16%	0.162	31%	0.312	C	S	.	.	H	α-helix	trans	-55	-53.8	176.1	174	-98.9	0	0	0	112	S1010 S1011 F1012 F1016 I1017 S1018	S1010-F1014 WeakPolarHBondContact O-CB 3.35Å; S1010-F1014 PolarHBondContact O-N 2.93Å; S1011-F1014 PolarHBondContact O-N 3.25Å; F1012-F1014 VanDerWaalsContact C-N 3.34Å; F1012-F1014 PolarHBondContact O-N 2.85Å; F1014-F1016 VanDerWaalsContact C-N 3.32Å; F1014-F1016 PolarHBondContact O-N 3.23Å; F1014-I1017 WeakPolarHBondContact O-CG1 3.36Å; F1014-S1018 PolarHBondContact O-N 3.22Å; F1014-S1018 PolarHBondContact O-OG 3.41Å
1015	F	78.3	Confident	67.3	Low	0 Å²	0	54.7 Å²	54.7	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-68.5	-29.9	177.8	-73.6	-73	0	0	0	113.1	L992 S995 F999 S1011 F1012 S1018 F1019 L1063 V1064	L992-F1015 VanDerWaalsContact CD1-C 3.46Å; L992-F1015 HydrophobicContact CD1-CB 3.43Å; L992-F1015 VanDerWaalsContact CD1-CB 3.43Å; S995-F1015 VanDerWaalsContact C-CE2 3.42Å; S995-F1015 WeakPolarHBondContact O-CE2 3.4Å; F999-F1015 HydrophobicContact CB-CE2 3.58Å; F999-F1015 HydrophobicContact CB-CZ 4.12Å; F999-F1015 HydrophobicContact CD2-CE2 4.4Å; F999-F1015 HydrophobicContact CD2-CZ 4.38Å; F999-F1015 HydrophobicContact CG-CE2 4.04Å; F999-F1015 HydrophobicContact CG-CZ 4.46Å; S1011-F1015 VanDerWaalsContact O-CD2 3.26Å; S1011-F1015 WeakPolarHBondContact O-CD2 3.34Å; S1011-F1015 PolarHBondContact O-N 3.18Å; F1012-F1015 PolarHBondContact O-N 2.81Å; F1015-S1018 PolarHBondContact O-N 3.39Å; F1015-F1019 HydrophobicContact CB-CE1 4.4Å; F1015-F1019 HydrophobicContact CB-CE2 4.34Å; F1015-F1019 HydrophobicContact CB-CZ 4.18Å; F1015-F1019 AromaticContact CD1-CE1 3.81Å; F1015-F1019 HydrophobicContact CD1-CE1 3.81Å; F1015-F1019 AromaticContact CD1-CZ 3.78Å; F1015-F1019 HydrophobicContact CD1-CZ 3.78Å; F1015-F1019 HydrophobicContact CG-CZ 4.32Å; F1015-F1019 WeakPolarHBondContact O-CB 3.43Å; F1015-F1019 WeakPolarHBondContact O-CD1 3.25Å; F1015-F1019 WeakPolarHBondContact O-CG 3.34Å; F1015-F1019 PolarHBondContact O-N 3.38Å; F1015-L1063 HydrophobicContact CE1-CB 4.02Å; F1015-L1063 HydrophobicContact CZ-CB 4.45Å; F1015-L1063 HydrophobicContact CZ-CD1 4.11Å; F1015-V1064 HydrophobicContact CD1-CG2 4.2Å; F1015-V1064 HydrophobicContact CE1-CG2 3.98Å
1016	F	79.8	Confident	65.8	Low	87 Å²	87	58.9 Å²	58.9	38%	0.382	30%	0.3	S	S	.	.	H	α-helix	trans	-65.8	-47.4	179.6	179.6	-97	0	0	0	111.2	L992 F1012 Y1013 F1014 S1018 F1019 T1020	L992-F1016 HydrophobicContact CD1-CB 4.1Å; L992-F1016 VanDerWaalsContact CD1-N 3.33Å; L992-F1016 HydrophobicContact CD2-CB 4.18Å; L992-F1016 HydrophobicContact CD2-CD2 3.74Å; L992-F1016 HydrophobicContact CD2-CG 4.46Å; F1012-F1016 HydrophobicContact CE1-CB 4.45Å; F1012-F1016 VanDerWaalsContact O-CB 3.26Å; F1012-F1016 WeakPolarHBondContact O-CB 3.47Å; F1012-F1016 PolarHBondContact O-N 2.79Å; Y1013-F1016 PolarHBondContact O-N 3.33Å; F1014-F1016 VanDerWaalsContact C-N 3.32Å; F1014-F1016 PolarHBondContact O-N 3.23Å; F1016-S1018 VanDerWaalsContact C-N 3.32Å; F1016-S1018 PolarHBondContact O-N 2.86Å; F1016-F1019 PolarHBondContact O-N 3.25Å; F1016-T1020 HydrophobicContact CD1-CG2 4.38Å; F1016-T1020 HydrophobicContact CD2-CG2 4.08Å; F1016-T1020 HydrophobicContact CE1-CG2 4.07Å; F1016-T1020 HydrophobicContact CE2-CG2 3.76Å; F1016-T1020 HydrophobicContact CG-CG2 4.39Å; F1016-T1020 HydrophobicContact CZ-CG2 3.76Å; F1016-T1020 WeakPolarHBondContact O-CB 3.44Å; F1016-T1020 VanDerWaalsContact O-CG2 3.31Å; F1016-T1020 WeakPolarHBondContact O-CG2 3.37Å; F1016-T1020 PolarHBondContact O-N 2.93Å; F1016-T1020 PolarHBondContact O-OG1 3.21Å
1017	I	65.5	Low	64.7	Low	51 Å²	51	61.3 Å²	61.3	26%	0.262	33%	0.33	S	S	.	.	H	α-helix	trans	-67.3	-35.1	177	63.7	175.3	0	0	0	111.6	Y1013 F1014 T1021	Y1013-I1017 HydrophobicContact CD1-CD1 4.48Å; Y1013-I1017 HydrophobicContact CD2-CG2 4.33Å; Y1013-I1017 HydrophobicContact CE1-CD1 4.01Å; Y1013-I1017 HydrophobicContact CE1-CG2 4.18Å; Y1013-I1017 HydrophobicContact CE2-CG2 3.83Å; Y1013-I1017 WeakPolarHBondContact O-CG1 3.01Å; Y1013-I1017 PolarHBondContact O-N 2.82Å; F1014-I1017 WeakPolarHBondContact O-CG1 3.36Å; I1017-T1021 PolarHBondContact O-N 2.81Å
1018	S	67.3	Low	63.1	Low	32 Å²	32	58.3 Å²	58.3	22%	0.224	32%	0.318	C	S	.	.	H	α-helix	trans	-65.6	-44.9	175.1	-63	0	0	0	0	112	F1014 F1015 F1016	F1014-S1018 PolarHBondContact O-N 3.22Å; F1014-S1018 PolarHBondContact O-OG 3.41Å; F1015-S1018 PolarHBondContact O-N 3.39Å; F1016-S1018 VanDerWaalsContact C-N 3.32Å; F1016-S1018 PolarHBondContact O-N 2.86Å
1019	F	75.9	Confident	61.2	Low	5 Å²	5	62.7 Å²	62.7	2%	0.022	34%	0.339	C	S	.	.	H	α-helix	trans	-77	-35.5	-178.5	-66.3	-1.9	0	0	0	112.5	W991 L992 F1015 F1016 T1021 V1064 L1071	W991-F1019 AromaticContact CD1-CE2 3.58Å; W991-F1019 AromaticContact CD1-CZ 3.74Å; W991-F1019 AromaticContact NE1-CZ 3.9Å; L992-F1019 HydrophobicContact CB-CD2 4.3Å; L992-F1019 HydrophobicContact CB-CE2 4.24Å; L992-F1019 HydrophobicContact CD1-CD2 3.91Å; L992-F1019 HydrophobicContact CD1-CE2 4.06Å; F1015-F1019 HydrophobicContact CB-CE1 4.4Å; F1015-F1019 HydrophobicContact CB-CE2 4.34Å; F1015-F1019 HydrophobicContact CB-CZ 4.18Å; F1015-F1019 AromaticContact CD1-CE1 3.81Å; F1015-F1019 HydrophobicContact CD1-CE1 3.81Å; F1015-F1019 AromaticContact CD1-CZ 3.78Å; F1015-F1019 HydrophobicContact CD1-CZ 3.78Å; F1015-F1019 HydrophobicContact CG-CZ 4.32Å; F1015-F1019 WeakPolarHBondContact O-CB 3.43Å; F1015-F1019 WeakPolarHBondContact O-CD1 3.25Å; F1015-F1019 WeakPolarHBondContact O-CG 3.34Å; F1015-F1019 PolarHBondContact O-N 3.38Å; F1016-F1019 PolarHBondContact O-N 3.25Å; F1019-T1021 PolarHBondContact O-N 2.67Å; F1019-V1064 HydrophobicContact CE1-CG2 4.5Å; F1019-L1071 WeakPolarHBondContact O-CD2 3.46Å
1020	T	68.1	Low	59.3	Low	40 Å²	40	64 Å²	64	25%	0.245	34%	0.344	C	S	.	.	H	α-helix	trans	-78.4	-10.3	178.5	57.1	0	0	0	0	112.7	F1016 I1022	F1016-T1020 HydrophobicContact CD1-CG2 4.38Å; F1016-T1020 HydrophobicContact CD2-CG2 4.08Å; F1016-T1020 HydrophobicContact CE1-CG2 4.07Å; F1016-T1020 HydrophobicContact CE2-CG2 3.76Å; F1016-T1020 HydrophobicContact CG-CG2 4.39Å; F1016-T1020 HydrophobicContact CZ-CG2 3.76Å; F1016-T1020 WeakPolarHBondContact O-CB 3.44Å; F1016-T1020 VanDerWaalsContact O-CG2 3.31Å; F1016-T1020 WeakPolarHBondContact O-CG2 3.37Å; F1016-T1020 PolarHBondContact O-N 2.93Å; F1016-T1020 PolarHBondContact O-OG1 3.21Å; T1020-I1022 PolarHBondContact O-N 2.79Å
1021	T	63.5	Low	58.4	Low	67 Å²	67	67.4 Å²	67.4	41%	0.411	36%	0.36	S	S	.	.			trans	54.4	18.6	-176.1	66.6	0	0	0	0	113.9	I897 I1017 F1019 G1023 L1068	I897-T1021 HydrophobicContact CD1-CG2 4.22Å; I1017-T1021 PolarHBondContact O-N 2.81Å; F1019-T1021 PolarHBondContact O-N 2.67Å; T1021-G1023 PolarHBondContact O-N 3.33Å; T1021-L1068 HydrophobicContact CG2-CD2 4.03Å
1022	I	54.5	Low	56.6	Low	98 Å²	98	76 Å²	76	50%	0.503	39%	0.392	S	S	.	.			trans	-75.9	80.3	178	-58.1	171.2	0	0	0	108.1	T1020	T1020-I1022 PolarHBondContact O-N 2.79Å
1023	G	48	Very low	54.7	Low	35 Å²	35	76.8 Å²	76.8	36%	0.361	41%	0.407	S	S	.	.			trans	-75.4	131.2	165.3	0	0	0	0	0	109.3	K899 T1021 G1025	K899-G1023 WeakPolarHBondContact CE-O 3.34Å; K899-G1023 PolarHBondContact NZ-O 3.25Å; T1021-G1023 PolarHBondContact O-N 3.33Å; G1023-G1025 PolarHBondContact O-N 3.49Å
1024	F	39.5	Very low	53.2	Low	92 Å²	92	77.5 Å²	77.5	40%	0.404	42%	0.418	S	S	.	.			trans	-68.5	101.5	177	-63.4	-81.3	0	0	0	111.3	Y1035	F1024-Y1035 HydrophobicContact CD1-CD2 4.35Å
1025	G	43.2	Very low	51.9	Low	31 Å²	31	82.1 Å²	82.1	32%	0.32	44%	0.436	S	S	.	.			trans	-99.2	115.9	169.9	0	0	0	0	0	110.3	G1023 G1027 M1031	G1023-G1025 PolarHBondContact O-N 3.49Å; G1025-G1027 PolarHBondContact O-N 3.12Å; G1025-M1031 WeakPolarHBondContact O-CE 3.49Å
1026	K	34.7	Very low	50	Low	201 Å²	201	85 Å²	85	87%	0.874	46%	0.459	S	S	*	.	S	Bend	trans	-59.9	101.8	178.4	-69.9	177.2	175.4	176.1	0	110.5
1027	G	41.8	Very low	48.2	Very low	76 Å²	76	85.3 Å²	85.3	78%	0.784	47%	0.468	S	S	*	.			trans	-163.9	-37.1	-179.6	0	0	0	0	0	120.1	G1025	G1025-G1027 PolarHBondContact O-N 3.12Å
1028	S	40.1	Very low	47	Very low	49 Å²	49	83.9 Å²	83.9	34%	0.343	46%	0.464	S	S	.	.			trans	-112.2	147.5	-173.3	70.6	0	0	0	0	113.8	F1030 M1031 R1032	S1028-F1030 PolarHBondContact O-N 2.68Å; S1028-M1031 WeakPolarHBondContact O-CA 3.36Å; S1028-M1031 WeakPolarHBondContact O-CB 3.48Å; S1028-M1031 PolarHBondContact O-N 3.25Å; S1028-M1031 WeakPolarHBondContact OG-CB 3.09Å; S1028-M1031 WeakPolarHBondContact OG-CG 3.3Å; S1028-M1031 PolarHBondContact OG-N 2.65Å; S1028-R1032 PolarHBondContact O-N 3.27Å
1029	K	43.3	Very low	45.7	Very low	180 Å²	180	85.1 Å²	85.1	78%	0.783	48%	0.476	S	S	*	.	H	α-helix	trans	-57.7	-35.4	175.8	-74.7	-179.3	178.9	177.7	0	112.3	M1031 R1032	K1029-M1031 VanDerWaalsContact C-N 3.32Å; K1029-M1031 PolarHBondContact O-N 2.87Å; K1029-R1032 PolarHBondContact O-N 3.32Å
1030	F	40.4	Very low	43.9	Very low	167 Å²	167	88.7 Å²	88.7	73%	0.732	51%	0.506	S	S	*	.	H	α-helix	trans	-64	-35.1	172.6	-171.4	-101.4	0	0	0	112.3	S1028 R1032 A1033 C1034	S1028-F1030 PolarHBondContact O-N 2.68Å; F1030-R1032 PolarHBondContact O-N 2.75Å; F1030-A1033 PolarHBondContact O-N 3.41Å; F1030-C1034 PolarHBondContact O-N 3.17Å
1031	M	45	Very low	42.4	Very low	78 Å²	78	92.7 Å²	92.7	38%	0.384	52%	0.524	S	S	.	.	H	α-helix	trans	-70.6	-24.8	174.9	-89.5	-165.8	-103.9	0	0	114.2	G1025 S1028 K1029 A1033 C1034 Y1035	G1025-M1031 WeakPolarHBondContact O-CE 3.49Å; S1028-M1031 WeakPolarHBondContact O-CA 3.36Å; S1028-M1031 WeakPolarHBondContact O-CB 3.48Å; S1028-M1031 PolarHBondContact O-N 3.25Å; S1028-M1031 WeakPolarHBondContact OG-CB 3.09Å; S1028-M1031 WeakPolarHBondContact OG-CG 3.3Å; S1028-M1031 PolarHBondContact OG-N 2.65Å; K1029-M1031 VanDerWaalsContact C-N 3.32Å; K1029-M1031 PolarHBondContact O-N 2.87Å; M1031-A1033 VanDerWaalsContact C-N 3.28Å; M1031-A1033 PolarHBondContact O-N 2.86Å; M1031-C1034 PolarHBondContact O-N 3.5Å; M1031-Y1035 WeakPolarHBondContact O-CB 3.15Å; M1031-Y1035 PolarHBondContact O-N 3.48Å
1032	R	39.1	Very low	41.1	Very low	180 Å²	180	95 Å²	95	68%	0.679	54%	0.538	S	S	*	.	H	α-helix	trans	-65.5	-31.7	173	-82.8	-175.7	-111.9	-176.9	-6.1	112.3	S1028 K1029 F1030 Y1035 A1036	S1028-R1032 PolarHBondContact O-N 3.27Å; K1029-R1032 PolarHBondContact O-N 3.32Å; F1030-R1032 PolarHBondContact O-N 2.75Å; R1032-Y1035 PolarHBondContact O-N 2.7Å; R1032-A1036 VanDerWaalsContact O-CB 3.31Å; R1032-A1036 WeakPolarHBondContact O-CB 3.19Å; R1032-A1036 PolarHBondContact O-N 3.14Å
1033	A	42.8	Very low	39.9	Very low	59 Å²	59	95.8 Å²	95.8	49%	0.488	55%	0.549	S	S	.	.	H	α-helix	trans	-68.4	-44.8	173.4	0	0	0	0	0	111.3	F1030 M1031 Y1035 A1036 V1037	F1030-A1033 PolarHBondContact O-N 3.41Å; M1031-A1033 VanDerWaalsContact C-N 3.28Å; M1031-A1033 PolarHBondContact O-N 2.86Å; A1033-Y1035 VanDerWaalsContact C-N 3.33Å; A1033-Y1035 PolarHBondContact O-N 3.08Å; A1033-A1036 PolarHBondContact O-N 3.25Å; A1033-V1037 VanDerWaalsContact O-CG2 3.31Å; A1033-V1037 WeakPolarHBondContact O-CG2 3.5Å; A1033-V1037 PolarHBondContact O-N 2.72Å
1034	C	39.4	Very low	39.3	Very low	63 Å²	63	97.2 Å²	97.2	43%	0.426	55%	0.549	S	S	.	.	H	α-helix	trans	-64.3	-36.7	173.8	-64	0	0	0	0	112.6	F1030 M1031 V1037 A1038	F1030-C1034 PolarHBondContact O-N 3.17Å; M1031-C1034 PolarHBondContact O-N 3.5Å; C1034-V1037 PolarHBondContact O-N 3.23Å; C1034-A1038 VanDerWaalsContact O-CB 3.3Å; C1034-A1038 WeakPolarHBondContact O-CB 3.23Å; C1034-A1038 PolarHBondContact O-N 2.89Å
1035	Y	39.9	Very low	39	Very low	134 Å²	134	96 Å²	96	53%	0.525	55%	0.548	S	S	.	.	H	α-helix	trans	-68.4	-37	176.1	-151	-93.3	0	0	0	111.7	F1024 M1031 R1032 A1033 A1039	F1024-Y1035 HydrophobicContact CD1-CD2 4.35Å; M1031-Y1035 WeakPolarHBondContact O-CB 3.15Å; M1031-Y1035 PolarHBondContact O-N 3.48Å; R1032-Y1035 PolarHBondContact O-N 2.7Å; A1033-Y1035 VanDerWaalsContact C-N 3.33Å; A1033-Y1035 PolarHBondContact O-N 3.08Å; Y1035-A1039 WeakPolarHBondContact O-CA 3.45Å; Y1035-A1039 WeakPolarHBondContact O-CB 3.41Å; Y1035-A1039 PolarHBondContact O-N 3.38Å
1036	A	39.2	Very low	38.5	Very low	60 Å²	60	97.6 Å²	97.6	50%	0.496	56%	0.559	S	S	.	*	H	α-helix	trans	-69.7	-37.6	174.8	0	0	0	0	0	112.3	R1032 A1033 A1040	R1032-A1036 VanDerWaalsContact O-CB 3.31Å; R1032-A1036 WeakPolarHBondContact O-CB 3.19Å; R1032-A1036 PolarHBondContact O-N 3.14Å; A1033-A1036 PolarHBondContact O-N 3.25Å; A1036-A1040 VanDerWaalsContact O-CB 3.22Å; A1036-A1040 WeakPolarHBondContact O-CB 3.41Å; A1036-A1040 PolarHBondContact O-N 3.31Å
1037	V	42	Very low	38.7	Very low	93 Å²	93	90.8 Å²	90.8	56%	0.564	55%	0.546	S	S	*	.	H	α-helix	trans	-70.4	-38.8	175.5	174.9	0	0	0	0	111.5	A1033 C1034	A1033-V1037 VanDerWaalsContact O-CG2 3.31Å; A1033-V1037 WeakPolarHBondContact O-CG2 3.5Å; A1033-V1037 PolarHBondContact O-N 2.72Å; C1034-V1037 PolarHBondContact O-N 3.23Å
1038	A	39.6	Very low	38.8	Very low	22 Å²	22	91.8 Å²	91.8	18%	0.182	53%	0.533	C	S	.	.	H	α-helix	trans	-74.7	-32.4	174.9	0	0	0	0	0	113.1	C1034 M1041	C1034-A1038 VanDerWaalsContact O-CB 3.3Å; C1034-A1038 WeakPolarHBondContact O-CB 3.23Å; C1034-A1038 PolarHBondContact O-N 2.89Å; A1038-M1041 PolarHBondContact O-N 3.47Å
1039	A	38.8	Very low	39.2	Very low	57 Å²	57	91.1 Å²	91.1	47%	0.471	53%	0.527	S	S	.	.	H	α-helix	trans	-75.9	-25	175.1	0	0	0	0	0	113.1	Y1035 M1041	Y1035-A1039 WeakPolarHBondContact O-CA 3.45Å; Y1035-A1039 WeakPolarHBondContact O-CB 3.41Å; Y1035-A1039 PolarHBondContact O-N 3.38Å; A1039-M1041 PolarHBondContact O-N 3.33Å
1040	A	39.7	Very low	39.5	Very low	80 Å²	80	84 Å²	84	66%	0.661	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.1	-8.4	172.3	0	0	0	0	0	113.4	A1036	A1036-A1040 VanDerWaalsContact O-CB 3.22Å; A1036-A1040 WeakPolarHBondContact O-CB 3.41Å; A1036-A1040 PolarHBondContact O-N 3.31Å
1041	M	36.3	Very low	40.2	Very low	125 Å²	125	76.4 Å²	76.4	62%	0.616	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.4	29.9	-179.5	-114.4	102.1	100.2	0	0	113.9	A1038 A1039	A1038-M1041 PolarHBondContact O-N 3.47Å; A1039-M1041 PolarHBondContact O-N 3.33Å
1042	T	35.2	Very low	40.6	Very low	114 Å²	114	78.7 Å²	78.7	70%	0.699	47%	0.474	S	S	*	.			trans	-42.4	139.2	174.3	25	0	0	0	0	113.7
1043	P	30.8	Very low	41.7	Very low	115 Å²	115	75 Å²	75	75%	0.747	46%	0.464	S	S	*	.	S	Bend	cis	-137.2	61.3	20.3	40	-18.2	0	0	0	114.7
1044	L	35.7	Very low	42.5	Very low	66 Å²	66	75 Å²	75	35%	0.346	46%	0.459	S	S	.	.	S	Bend	trans	-129.3	3.6	-174.1	-153	107.1	0	0	0	115.4	S1010	S1010-L1044 VanDerWaalsContact OG-CD1 3.27Å; S1010-L1044 WeakPolarHBondContact OG-CD1 3.44Å; S1010-L1044 WeakPolarHBondContact OG-CD2 3.49Å
1045	V	31.5	Very low	43.8	Very low	65 Å²	65	78.1 Å²	78.1	39%	0.394	47%	0.471	S	S	.	.			trans	-93	2.4	-165.5	179.6	0	0	0	0	113.9	Y1013	Y1013-V1045 HydrophobicContact CE1-CG2 4.41Å
1046	A	33.3	Very low	45.2	Very low	65 Å²	65	75.5 Å²	75.5	54%	0.537	46%	0.461	S	S	.	.	S	Bend	trans	-86.6	131.3	164.1	0	0	0	0	0	108.7	D1048	A1046-D1048 PolarHBondContact O-N 3.29Å
1047	G	39.6	Very low	46.3	Very low	59 Å²	59	73.4 Å²	73.4	61%	0.608	44%	0.441	S	S	*	.	S	Bend	trans	-65.9	57	-174.5	0	0	0	0	0	115.9
1048	D	42.5	Very low	47.5	Very low	96 Å²	96	72.2 Å²	72.2	51%	0.513	44%	0.435	S	S	.	.			trans	-102.4	1.1	-171.6	-73	-9.1	0	0	0	113.9	A1046 V1050	A1046-D1048 PolarHBondContact O-N 3.29Å; D1048-V1050 VanDerWaalsContact C-N 3.3Å; D1048-V1050 PolarHBondContact O-N 2.92Å
1049	V	49.2	Very low	49.1	Very low	35 Å²	35	74.7 Å²	74.7	21%	0.212	45%	0.445	C	S	.	.			trans	-80.9	79.8	179.7	-168.7	0	0	0	0	110.1	F999 V1006	F999-V1049 HydrophobicContact CE1-CG1 3.72Å; F999-V1049 HydrophobicContact CZ-CG1 3.77Å; V1006-V1049 HydrophobicContact CG1-CG1 4.43Å; V1006-V1049 HydrophobicContact CG2-CG1 4.16Å
1050	V	50.6	Low	50.5	Low	30 Å²	30	72.3 Å²	72.3	18%	0.182	43%	0.425	C	S	.	.			trans	-98	122.9	166.2	176.8	0	0	0	0	107.3	R879 D1048 K1052 M1057	R879-V1050 PolarHBondContact NH2-O 3.35Å; D1048-V1050 VanDerWaalsContact C-N 3.3Å; D1048-V1050 PolarHBondContact O-N 2.92Å; V1050-K1052 PolarHBondContact O-N 3Å; V1050-M1057 HydrophobicContact CG1-CE 3.19Å; V1050-M1057 HydrophobicContact CG1-SD 4.22Å
1051	P	53.9	Low	51.9	Low	9 Å²	9	69.2 Å²	69.2	6%	0.058	40%	0.398	C	S	.	.			trans	-55.2	133.3	-178.6	20.9	-31.2	0	0	0	110.2	F999 E1003 H1053 M1057	F999-P1051 HydrophobicContact CE2-CB 4.27Å; F999-P1051 HydrophobicContact CE2-CG 4.48Å; F999-P1051 HydrophobicContact CZ-CB 4.45Å; E1003-P1051 WeakPolarHBondContact OE2-CA 3.43Å; E1003-P1051 WeakPolarHBondContact OE2-CB 3.33Å; P1051-H1053 PolarHBondContact O-N 3.14Å; P1051-M1057 HydrophobicContact CG-CG 3.95Å; P1051-M1057 HydrophobicContact CG-SD 4.23Å
1052	K	52.6	Low	53.9	Low	126 Å²	126	68.3 Å²	68.3	55%	0.548	40%	0.395	S	S	.	.	S	Bend	trans	-64.8	-28.3	-178.6	-71	173	-176.3	179.9	0	111.4	E1003 D1005 V1050 P1054	E1003-K1052 VanDerWaalsContact CD-N 3.34Å; E1003-K1052 WeakPolarHBondContact OE1-CB 3.37Å; E1003-K1052 WeakPolarHBondContact OE1-CD 3.15Å; E1003-K1052 WeakPolarHBondContact OE1-CG 3.45Å; E1003-K1052 PolarHBondContact OE1-N 3.28Å; E1003-K1052 PolarHBondContact OE2-N 3.17Å; D1005-K1052 IonicContact OD2-NZ 3.59Å; D1005-K1052 PolarHBondContact OD2-NZ 2.96Å; V1050-K1052 PolarHBondContact O-N 3Å; K1052-P1054 WeakPolarHBondContact O-CD 3.48Å
1053	H	63.5	Low	56.1	Low	102 Å²	102	63.6 Å²	63.6	47%	0.472	37%	0.365	S	S	.	.	S	Bend	trans	-92.5	109.5	177.1	-64.5	-64.3	0	0	0	110.6	P1051 L1055 Y1056	P1051-H1053 PolarHBondContact O-N 3.14Å; H1053-L1055 PolarHBondContact O-N 3.47Å; H1053-L1055 VanDerWaalsContact O-N 3.07Å; H1053-Y1056 HydrophobicContact CB-CD2 3.46Å; H1053-Y1056 VanDerWaalsContact CB-CD2 3.46Å; H1053-Y1056 HydrophobicContact CB-CE2 3.65Å; H1053-Y1056 HydrophobicContact CB-CG 4.44Å; H1053-Y1056 AromaticContact CD2-CE2 3.89Å; H1053-Y1056 AromaticContact CG-CE2 3.95Å; H1053-Y1056 PolarHBondContact O-N 3.17Å; H1053-Y1056 VanDerWaalsContact O-N 3.08Å
1054	P	59.1	Low	58.3	Low	59 Å²	59	59 Å²	59	38%	0.383	34%	0.335	S	S	.	.	G	3₁₀ helix	trans	-62.1	-20.9	-177.2	23.8	-33.2	0	0	0	113.3	F884 K1052 Y1056 M1057	F884-P1054 HydrophobicContact CB-CB 4.21Å; F884-P1054 HydrophobicContact CD2-CB 4.41Å; F884-P1054 HydrophobicContact CG-CB 4.36Å; K1052-P1054 WeakPolarHBondContact O-CD 3.48Å; P1054-Y1056 VanDerWaalsContact C-N 3.29Å; P1054-Y1056 PolarHBondContact O-N 3.3Å; P1054-M1057 WeakPolarHBondContact O-CB 3.27Å; P1054-M1057 PolarHBondContact O-N 3.29Å
1055	L	66.5	Low	60.3	Low	129 Å²	129	57.6 Å²	57.6	68%	0.675	33%	0.328	S	S	*	.	G	3₁₀ helix	trans	-63.5	-29.2	175.7	-74.8	161.5	0	0	0	113.4	H1053	H1053-L1055 PolarHBondContact O-N 3.47Å; H1053-L1055 VanDerWaalsContact O-N 3.07Å
1056	Y	69.3	Low	62.8	Low	79 Å²	79	57.4 Å²	57.4	31%	0.31	32%	0.322	S	S	.	.	G	3₁₀ helix	trans	-88.5	-10.8	-178.2	-57.2	-51.7	0	0	0	113.6	W1002 H1053 P1054 L1059 C1060	W1002-Y1056 HydrophobicContact CB-CD1 4.45Å; W1002-Y1056 HydrophobicContact CB-CD2 3.81Å; W1002-Y1056 HydrophobicContact CB-CE2 4.06Å; W1002-Y1056 HydrophobicContact CB-CG 4.07Å; W1002-Y1056 HydrophobicContact CD2-CD1 4.06Å; W1002-Y1056 HydrophobicContact CD2-CG 4.2Å; W1002-Y1056 HydrophobicContact CE3-CD1 4.42Å; W1002-Y1056 HydrophobicContact CE3-CG 4.29Å; W1002-Y1056 HydrophobicContact CG-CD1 4.07Å; W1002-Y1056 HydrophobicContact CG-CD2 4.3Å; W1002-Y1056 HydrophobicContact CG-CE1 4.28Å; W1002-Y1056 HydrophobicContact CG-CG 4.12Å; H1053-Y1056 HydrophobicContact CB-CD2 3.46Å; H1053-Y1056 VanDerWaalsContact CB-CD2 3.46Å; H1053-Y1056 HydrophobicContact CB-CE2 3.65Å; H1053-Y1056 HydrophobicContact CB-CG 4.44Å; H1053-Y1056 AromaticContact CD2-CE2 3.89Å; H1053-Y1056 AromaticContact CG-CE2 3.95Å; H1053-Y1056 PolarHBondContact O-N 3.17Å; H1053-Y1056 VanDerWaalsContact O-N 3.08Å; P1054-Y1056 VanDerWaalsContact C-N 3.29Å; P1054-Y1056 PolarHBondContact O-N 3.3Å; Y1056-L1059 HydrophobicContact CD1-CD1 3.94Å; Y1056-L1059 PolarHBondContact O-N 2.91Å; Y1056-C1060 PolarHBondContact O-N 3.41Å; Y1056-C1060 PolarHBondContact O-SG 3.38Å
1057	M	63	Low	65.2	Low	16 Å²	16	54.3 Å²	54.3	8%	0.079	30%	0.296	C	S	.	.	H	α-helix	trans	-51.4	-55.4	176.5	-71.3	-105.6	-158	0	0	113.3	Y888 V1050 P1051 P1054 L1059 C1060 S1061	Y888-M1057 HydrophobicContact CD1-SD 4.1Å; Y888-M1057 HydrophobicContact CD2-CB 4.4Å; Y888-M1057 HydrophobicContact CD2-SD 3.62Å; Y888-M1057 HydrophobicContact CE2-SD 4.14Å; Y888-M1057 HydrophobicContact CG-SD 3.6Å; Y888-M1057 VanDerWaalsContact CG-SD 3.6Å; V1050-M1057 HydrophobicContact CG1-CE 3.19Å; V1050-M1057 HydrophobicContact CG1-SD 4.22Å; P1051-M1057 HydrophobicContact CG-CG 3.95Å; P1051-M1057 HydrophobicContact CG-SD 4.23Å; P1054-M1057 WeakPolarHBondContact O-CB 3.27Å; P1054-M1057 PolarHBondContact O-N 3.29Å; M1057-L1059 VanDerWaalsContact C-N 3.29Å; M1057-L1059 PolarHBondContact O-N 2.95Å; M1057-C1060 WeakPolarHBondContact O-CB 3.27Å; M1057-C1060 PolarHBondContact O-N 3.01Å; M1057-S1061 PolarHBondContact O-N 2.95Å; M1057-S1061 VanDerWaalsContact O-N 3.14Å; M1057-S1061 PolarHBondContact O-OG 2.91Å
1058	P	66.5	Low	67.2	Low	68 Å²	68	51.9 Å²	51.9	44%	0.442	27%	0.269	S	S	.	.	H	α-helix	trans	-65.8	-31.4	-179.7	24.2	-33.8	0	0	0	113	C1060 S1061 I1062	P1058-C1060 VanDerWaalsContact C-N 3.34Å; P1058-S1061 WeakPolarHBondContact O-CB 3.21Å; P1058-S1061 PolarHBondContact O-N 3.42Å; P1058-I1062 WeakPolarHBondContact O-CG1 3.42Å; P1058-I1062 PolarHBondContact O-N 2.92Å; P1058-I1062 VanDerWaalsContact O-N 3.14Å
1059	L	73.5	Confident	69	Low	74 Å²	74	47.4 Å²	47.4	39%	0.387	25%	0.245	S	C	.	.	H	α-helix	trans	-65.6	-38.8	175.1	-71.5	167.3	0	0	0	111.4	W1002 Y1056 M1057 S1061 I1062 L1063	W1002-L1059 HydrophobicContact CH2-CB 3.49Å; W1002-L1059 VanDerWaalsContact CH2-CB 3.49Å; W1002-L1059 HydrophobicContact CH2-CD1 4.26Å; W1002-L1059 HydrophobicContact CH2-CG 4.37Å; W1002-L1059 HydrophobicContact CZ2-CB 4.28Å; W1002-L1059 HydrophobicContact CZ2-CD1 4.25Å; W1002-L1059 HydrophobicContact CZ3-CB 3.67Å; Y1056-L1059 HydrophobicContact CD1-CD1 3.94Å; Y1056-L1059 PolarHBondContact O-N 2.91Å; M1057-L1059 VanDerWaalsContact C-N 3.29Å; M1057-L1059 PolarHBondContact O-N 2.95Å; L1059-S1061 VanDerWaalsContact C-N 3.33Å; L1059-S1061 PolarHBondContact O-N 3.49Å; L1059-I1062 PolarHBondContact O-N 3.41Å; L1059-L1063 PolarHBondContact O-N 3.43Å
1060	C	69.2	Low	70.8	Confident	7 Å²	7	46.4 Å²	46.4	5%	0.047	24%	0.238	C	C	.	.	H	α-helix	trans	-61.8	-41.3	172	-61.7	0	0	0	0	111.6	F999 Y1056 M1057 P1058 I1062 L1063 V1064	F999-C1060 VanDerWaalsContact CD2-SG 3.58Å; Y1056-C1060 PolarHBondContact O-N 3.41Å; Y1056-C1060 PolarHBondContact O-SG 3.38Å; M1057-C1060 WeakPolarHBondContact O-CB 3.27Å; M1057-C1060 PolarHBondContact O-N 3.01Å; P1058-C1060 VanDerWaalsContact C-N 3.34Å; C1060-I1062 VanDerWaalsContact C-N 3.29Å; C1060-I1062 PolarHBondContact O-N 3.33Å; C1060-L1063 PolarHBondContact O-N 3.43Å; C1060-V1064 WeakPolarHBondContact O-CG2 3.46Å; C1060-V1064 PolarHBondContact O-N 3.39Å
1061	S	67.7	Low	72.4	Confident	15 Å²	15	46.9 Å²	46.9	11%	0.105	24%	0.239	C	C	.	.	H	α-helix	trans	-60.1	-37.6	176.7	-53.6	0	0	0	0	112.5	M1057 P1058 L1059 V1064 L1065	M1057-S1061 PolarHBondContact O-N 2.95Å; M1057-S1061 VanDerWaalsContact O-N 3.14Å; M1057-S1061 PolarHBondContact O-OG 2.91Å; P1058-S1061 WeakPolarHBondContact O-CB 3.21Å; P1058-S1061 PolarHBondContact O-N 3.42Å; L1059-S1061 VanDerWaalsContact C-N 3.33Å; L1059-S1061 PolarHBondContact O-N 3.49Å; S1061-V1064 PolarHBondContact O-N 3.05Å; S1061-L1065 WeakPolarHBondContact O-CB 3.16Å; S1061-L1065 VanDerWaalsContact O-CG 3.32Å; S1061-L1065 WeakPolarHBondContact O-CG 3.35Å; S1061-L1065 PolarHBondContact O-N 3.25Å
1062	I	77.8	Confident	73.7	Confident	106 Å²	106	47.2 Å²	47.2	54%	0.544	24%	0.242	S	C	.	.	H	α-helix	trans	-65.4	-43.8	176.4	-65.6	166.8	0	0	0	110.9	P1058 L1059 C1060 V1064 L1065 F1066	P1058-I1062 WeakPolarHBondContact O-CG1 3.42Å; P1058-I1062 PolarHBondContact O-N 2.92Å; P1058-I1062 VanDerWaalsContact O-N 3.14Å; L1059-I1062 PolarHBondContact O-N 3.41Å; C1060-I1062 VanDerWaalsContact C-N 3.29Å; C1060-I1062 PolarHBondContact O-N 3.33Å; I1062-V1064 VanDerWaalsContact C-N 3.28Å; I1062-V1064 PolarHBondContact O-N 3.49Å; I1062-L1065 PolarHBondContact O-N 3.35Å; I1062-F1066 PolarHBondContact O-N 2.75Å
1063	L	82.8	Confident	75.2	Confident	15 Å²	15	41.4 Å²	41.4	8%	0.079	22%	0.217	C	C	.	.	H	α-helix	trans	-60.6	-39.3	176.3	-66.1	174.9	0	0	0	111.6	W991 L998 W1002 F1015 L1059 C1060 G1067	W991-L1063 HydrophobicContact CH2-CD2 4.3Å; W991-L1063 HydrophobicContact CZ2-CD2 3.81Å; W991-L1063 PolarHBondContact NE1-O 2.84Å; L998-L1063 HydrophobicContact CB-CD1 4.41Å; L998-L1063 HydrophobicContact CD1-CD1 4.43Å; L998-L1063 HydrophobicContact CD1-CD2 4.03Å; W1002-L1063 HydrophobicContact CH2-CD1 3.92Å; W1002-L1063 HydrophobicContact CZ3-CD1 4Å; F1015-L1063 HydrophobicContact CE1-CB 4.02Å; F1015-L1063 HydrophobicContact CZ-CB 4.45Å; F1015-L1063 HydrophobicContact CZ-CD1 4.11Å; L1059-L1063 PolarHBondContact O-N 3.43Å; C1060-L1063 PolarHBondContact O-N 3.43Å; L1063-G1067 PolarHBondContact O-N 2.77Å
1064	V	76.7	Confident	76.2	Confident	18 Å²	18	37 Å²	37	11%	0.109	20%	0.198	C	C	.	.	H	α-helix	trans	-68.2	-46.9	176.2	176	0	0	0	0	112.4	F1015 F1019 C1060 S1061 I1062 F1066 G1067 L1068	F1015-V1064 HydrophobicContact CD1-CG2 4.2Å; F1015-V1064 HydrophobicContact CE1-CG2 3.98Å; F1019-V1064 HydrophobicContact CE1-CG2 4.5Å; C1060-V1064 WeakPolarHBondContact O-CG2 3.46Å; C1060-V1064 PolarHBondContact O-N 3.39Å; S1061-V1064 PolarHBondContact O-N 3.05Å; I1062-V1064 VanDerWaalsContact C-N 3.28Å; I1062-V1064 PolarHBondContact O-N 3.49Å; V1064-F1066 VanDerWaalsContact C-N 3.33Å; V1064-F1066 PolarHBondContact O-N 2.96Å; V1064-G1067 PolarHBondContact O-N 2.97Å; V1064-L1068 HydrophobicContact CG1-CD1 3.96Å; V1064-L1068 HydrophobicContact CG1-CG 4.23Å; V1064-L1068 WeakPolarHBondContact O-CB 3.3Å; V1064-L1068 WeakPolarHBondContact O-CG 3.43Å; V1064-L1068 PolarHBondContact O-N 3.03Å
1065	L	77.4	Confident	77.4	Confident	37 Å²	37	37.8 Å²	37.8	19%	0.194	20%	0.197	C	C	.	.	H	α-helix	trans	-59.6	-43.4	177.8	-74.8	170.8	0	0	0	111.9	T895 L938 S1061 I1062 L1068 A1069	T895-L1065 HydrophobicContact CG2-CD2 3.81Å; L938-L1065 HydrophobicContact CD1-CD2 3.55Å; S1061-L1065 WeakPolarHBondContact O-CB 3.16Å; S1061-L1065 VanDerWaalsContact O-CG 3.32Å; S1061-L1065 WeakPolarHBondContact O-CG 3.35Å; S1061-L1065 PolarHBondContact O-N 3.25Å; I1062-L1065 PolarHBondContact O-N 3.35Å; L1065-L1068 PolarHBondContact O-N 2.77Å; L1065-A1069 WeakPolarHBondContact O-CB 3.26Å; L1065-A1069 PolarHBondContact O-N 3.25Å
1066	F	84	Confident	78	Confident	61 Å²	61	32.9 Å²	32.9	27%	0.268	17%	0.172	S	C	.	.	H	α-helix	trans	-67	-41.1	175.7	-169.1	-87.7	0	0	0	111.9	L949 W991 I1062 V1064 L1068 A1069 Q1070	L949-F1066 HydrophobicContact CD2-CE2 4.14Å; L949-F1066 HydrophobicContact CD2-CZ 3.89Å; W991-F1066 AromaticContact CD2-CD1 3.68Å; W991-F1066 HydrophobicContact CD2-CD1 3.68Å; W991-F1066 AromaticContact CD2-CE1 3.9Å; W991-F1066 HydrophobicContact CD2-CE1 3.9Å; W991-F1066 AromaticContact CE2-CD1 3.29Å; W991-F1066 AromaticContact CE2-CE1 3.99Å; W991-F1066 HydrophobicContact CE3-CD1 4.06Å; W991-F1066 AromaticContact CE3-CE1 3.89Å; W991-F1066 HydrophobicContact CE3-CE1 3.89Å; W991-F1066 HydrophobicContact CG-CD1 4.32Å; W991-F1066 AromaticContact CH2-CD1 3.74Å; W991-F1066 HydrophobicContact CH2-CD1 3.74Å; W991-F1066 HydrophobicContact CH2-CE1 4.04Å; W991-F1066 HydrophobicContact CH2-CG 4.22Å; W991-F1066 HydrophobicContact CZ2-CB 3.85Å; W991-F1066 AromaticContact CZ2-CD1 3.33Å; W991-F1066 HydrophobicContact CZ2-CD1 3.33Å; W991-F1066 HydrophobicContact CZ2-CE1 4.07Å; W991-F1066 AromaticContact CZ2-CG 3.78Å; W991-F1066 HydrophobicContact CZ2-CG 3.78Å; W991-F1066 HydrophobicContact CZ3-CD1 4.08Å; W991-F1066 AromaticContact CZ3-CE1 3.96Å; W991-F1066 HydrophobicContact CZ3-CE1 3.96Å; W991-F1066 AromaticContact NE1-CD1 3.71Å; I1062-F1066 PolarHBondContact O-N 2.75Å; V1064-F1066 VanDerWaalsContact C-N 3.33Å; V1064-F1066 PolarHBondContact O-N 2.96Å; F1066-L1068 VanDerWaalsContact C-N 3.33Å; F1066-L1068 PolarHBondContact O-N 3.14Å; F1066-A1069 PolarHBondContact O-N 3.2Å; F1066-Q1070 WeakPolarHBondContact O-CB 3.41Å; F1066-Q1070 PolarHBondContact O-N 3.47Å
1067	G	83.5	Confident	78.6	Confident	0 Å²	0	29.1 Å²	29.1	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-62.8	-37	176.3	0	0	0	0	0	113.5	Q988 L1063 V1064 L1071	Q988-G1067 PolarHBondContact NE2-O 3.45Å; Q988-G1067 VanDerWaalsContact NE2-O 3.09Å; L1063-G1067 PolarHBondContact O-N 2.77Å; V1064-G1067 PolarHBondContact O-N 2.97Å; G1067-L1071 PolarHBondContact O-N 3.37Å
1068	L	81.3	Confident	79.5	Confident	8 Å²	8	31 Å²	31	4%	0.042	17%	0.168	C	C	.	.	H	α-helix	trans	-71.1	-38.1	172.9	-70	176.2	0	0	0	112	I897 L942 T1021 V1064 L1065 F1066 Q1070 L1071 S1072	I897-L1068 HydrophobicContact CD1-CD2 4.28Å; L942-L1068 HydrophobicContact CD1-CB 4.22Å; L942-L1068 HydrophobicContact CD2-CB 3.64Å; T1021-L1068 HydrophobicContact CG2-CD2 4.03Å; V1064-L1068 HydrophobicContact CG1-CD1 3.96Å; V1064-L1068 HydrophobicContact CG1-CG 4.23Å; V1064-L1068 WeakPolarHBondContact O-CB 3.3Å; V1064-L1068 WeakPolarHBondContact O-CG 3.43Å; V1064-L1068 PolarHBondContact O-N 3.03Å; L1065-L1068 PolarHBondContact O-N 2.77Å; F1066-L1068 VanDerWaalsContact C-N 3.33Å; F1066-L1068 PolarHBondContact O-N 3.14Å; L1068-Q1070 VanDerWaalsContact C-N 3.31Å; L1068-Q1070 PolarHBondContact O-N 3.4Å; L1068-L1071 WeakPolarHBondContact O-CB 3.37Å; L1068-L1071 PolarHBondContact O-N 3.41Å; L1068-S1072 WeakPolarHBondContact O-CB 3.28Å; L1068-S1072 PolarHBondContact O-N 3.04Å
1069	A	82	Confident	80.1	Confident	1 Å²	1	32.9 Å²	32.9	1%	0.008	17%	0.17	C	C	.	.	H	α-helix	trans	-64.9	-37.2	174.3	0	0	0	0	0	111.7	L942 W945 G946 L949 L1065 F1066 S1072 M1073	L942-A1069 HydrophobicContact CD2-CB 4.21Å; W945-A1069 HydrophobicContact CB-CB 3.76Å; W945-A1069 HydrophobicContact CE3-CB 4.36Å; G946-A1069 WeakPolarHBondContact CA-O 3.5Å; L949-A1069 HydrophobicContact CD1-CB 4.06Å; L1065-A1069 WeakPolarHBondContact O-CB 3.26Å; L1065-A1069 PolarHBondContact O-N 3.25Å; F1066-A1069 PolarHBondContact O-N 3.2Å; A1069-S1072 WeakPolarHBondContact O-CB 3.4Å; A1069-S1072 PolarHBondContact O-N 3.31Å; A1069-M1073 PolarHBondContact O-N 3.19Å
1070	Q	85.2	Confident	80.4	Confident	15 Å²	15	32.6 Å²	32.6	7%	0.07	17%	0.167	C	C	.	.	H	α-helix	trans	-73.6	-32.1	176.3	-163.2	-178.8	-28.1	0	0	112.3	L949 L987 Q988 F1066 L1068 M1073 C1074	L949-Q1070 HydrophobicContact CD1-CB 4.22Å; L987-Q1070 PolarHBondContact O-NE2 2.98Å; Q988-Q1070 VanDerWaalsContact CA-NE2 3.33Å; F1066-Q1070 WeakPolarHBondContact O-CB 3.41Å; F1066-Q1070 PolarHBondContact O-N 3.47Å; L1068-Q1070 VanDerWaalsContact C-N 3.31Å; L1068-Q1070 PolarHBondContact O-N 3.4Å; Q1070-M1073 WeakPolarHBondContact O-CB 3.42Å; Q1070-M1073 PolarHBondContact O-N 2.92Å; Q1070-C1074 PolarHBondContact O-N 2.96Å; Q1070-C1074 PolarHBondContact O-SG 3.18Å
1071	L	84.4	Confident	80.9	Confident	40 Å²	40	33.2 Å²	33.2	21%	0.209	17%	0.169	C	C	.	.	H	α-helix	trans	-63.8	-45.2	167	-172.5	81.9	0	0	0	111.3	F1019 G1067 L1068 M1073 C1074 I1075	F1019-L1071 WeakPolarHBondContact O-CD2 3.46Å; G1067-L1071 PolarHBondContact O-N 3.37Å; L1068-L1071 WeakPolarHBondContact O-CB 3.37Å; L1068-L1071 PolarHBondContact O-N 3.41Å; L1071-M1073 VanDerWaalsContact C-N 3.28Å; L1071-M1073 PolarHBondContact O-N 3.36Å; L1071-C1074 CarbonylContact O-C 3.6Å; L1071-C1074 WeakPolarHBondContact O-CA 3.43Å; L1071-C1074 WeakPolarHBondContact O-CB 3.45Å; L1071-C1074 PolarHBondContact O-N 2.65Å; L1071-I1075 HydrophobicContact CD2-CD1 4.24Å; L1071-I1075 HydrophobicContact CG-CD1 4.18Å; L1071-I1075 WeakPolarHBondContact O-CG1 3.3Å; L1071-I1075 PolarHBondContact O-N 2.86Å
1072	S	81.6	Confident	81.5	Confident	16 Å²	16	33.6 Å²	33.6	11%	0.112	17%	0.169	C	C	.	.	H	α-helix	trans	-55.8	-43.9	174.1	174.4	0	0	0	0	111.1	L942 L1068 A1069 C1074 I1075 N1076	L942-S1072 VanDerWaalsContact O-CB 3.28Å; L942-S1072 WeakPolarHBondContact O-CB 3.32Å; L942-S1072 PolarHBondContact O-OG 3.42Å; L1068-S1072 WeakPolarHBondContact O-CB 3.28Å; L1068-S1072 PolarHBondContact O-N 3.04Å; A1069-S1072 WeakPolarHBondContact O-CB 3.4Å; A1069-S1072 PolarHBondContact O-N 3.31Å; S1072-C1074 PolarHBondContact O-N 3.13Å; S1072-I1075 PolarHBondContact O-N 3.34Å; S1072-N1076 WeakPolarHBondContact O-CB 3.39Å; S1072-N1076 PolarHBondContact O-N 3.12Å
1073	M	85.1	Confident	81.6	Confident	4 Å²	4	31.2 Å²	31.2	2%	0.02	16%	0.158	C	C	.	.	H	α-helix	trans	-56.7	-46.8	171.3	-173.6	-158.5	153.1	0	0	112.3	G946 L949 M950 M953 A1069 Q1070 L1071 I1075 N1076 L1077	G946-M1073 WeakPolarHBondContact O-CB 3.47Å; G946-M1073 WeakPolarHBondContact O-CG 3.45Å; L949-M1073 HydrophobicContact CB-CB 4.16Å; L949-M1073 HydrophobicContact CB-CG 4.09Å; L949-M1073 HydrophobicContact CB-SD 3.76Å; M950-M1073 HydrophobicContact CB-CE 4.18Å; M950-M1073 HydrophobicContact CB-CG 3.91Å; M950-M1073 HydrophobicContact CG-CE 4.12Å; M950-M1073 HydrophobicContact CG-CG 4.47Å; M953-M1073 HydrophobicContact CB-CE 3.92Å; M953-M1073 HydrophobicContact CE-CE 3.89Å; M953-M1073 HydrophobicContact CG-CE 3.8Å; M953-M1073 HydrophobicContact CG-SD 4.17Å; M953-M1073 HydrophobicContact SD-CE 3.05Å; M953-M1073 WeakPolarHBondContact SD-CE 3.48Å; M953-M1073 HydrophobicContact SD-SD 3.51Å; A1069-M1073 PolarHBondContact O-N 3.19Å; Q1070-M1073 WeakPolarHBondContact O-CB 3.42Å; Q1070-M1073 PolarHBondContact O-N 2.92Å; L1071-M1073 VanDerWaalsContact C-N 3.28Å; L1071-M1073 PolarHBondContact O-N 3.36Å; M1073-I1075 VanDerWaalsContact C-N 3.33Å; M1073-I1075 PolarHBondContact O-N 3.46Å; M1073-N1076 PolarHBondContact O-N 3.28Å; M1073-L1077 WeakPolarHBondContact O-CB 3.2Å; M1073-L1077 PolarHBondContact O-N 3.14Å
1074	C	84.5	Confident	81.3	Confident	10 Å²	10	32 Å²	32	7%	0.068	16%	0.163	C	C	.	.	H	α-helix	trans	-62.3	-39.8	178.4	-66.6	0	0	0	0	112	Q1070 L1071 S1072 L1077 L1078	Q1070-C1074 PolarHBondContact O-N 2.96Å; Q1070-C1074 PolarHBondContact O-SG 3.18Å; L1071-C1074 CarbonylContact O-C 3.6Å; L1071-C1074 WeakPolarHBondContact O-CA 3.43Å; L1071-C1074 WeakPolarHBondContact O-CB 3.45Å; L1071-C1074 PolarHBondContact O-N 2.65Å; S1072-C1074 PolarHBondContact O-N 3.13Å; C1074-L1077 PolarHBondContact O-N 2.93Å; C1074-L1078 VanDerWaalsContact O-CB 3.29Å; C1074-L1078 WeakPolarHBondContact O-CB 3.08Å; C1074-L1078 PolarHBondContact O-N 2.99Å
1075	I	82.6	Confident	81.3	Confident	74 Å²	74	31.8 Å²	31.8	38%	0.379	16%	0.162	S	C	.	.	H	α-helix	trans	-64.6	-48	176.1	-67.3	167.2	0	0	0	110.2	L1071 S1072 M1073 L1077 L1078 Q1079	L1071-I1075 HydrophobicContact CD2-CD1 4.24Å; L1071-I1075 HydrophobicContact CG-CD1 4.18Å; L1071-I1075 WeakPolarHBondContact O-CG1 3.3Å; L1071-I1075 PolarHBondContact O-N 2.86Å; S1072-I1075 PolarHBondContact O-N 3.34Å; M1073-I1075 VanDerWaalsContact C-N 3.33Å; M1073-I1075 PolarHBondContact O-N 3.46Å; I1075-L1077 VanDerWaalsContact C-N 3.31Å; I1075-L1077 PolarHBondContact O-N 3.44Å; I1075-L1078 WeakPolarHBondContact O-CB 3.33Å; I1075-L1078 PolarHBondContact O-N 3.49Å; I1075-L1078 VanDerWaalsContact O-N 3.15Å; I1075-Q1079 HydrophobicContact CG2-CG 4.33Å; I1075-Q1079 WeakPolarHBondContact O-CB 3.26Å; I1075-Q1079 WeakPolarHBondContact O-CG 3.41Å; I1075-Q1079 PolarHBondContact O-N 2.95Å
1076	N	79	Confident	81.5	Confident	26 Å²	26	31.4 Å²	31.4	14%	0.139	16%	0.158	C	C	.	.	H	α-helix	trans	-63	-38.8	179.3	-71.8	-7.2	0	0	0	111.2	D943 M950 S1072 M1073 H1080	D943-N1076 PolarHBondContact OD1-ND2 3.35Å; M950-N1076 HydrophobicContact CE-CB 3.37Å; S1072-N1076 WeakPolarHBondContact O-CB 3.39Å; S1072-N1076 PolarHBondContact O-N 3.12Å; M1073-N1076 PolarHBondContact O-N 3.28Å; N1076-H1080 WeakPolarHBondContact O-CB 3.25Å; N1076-H1080 PolarHBondContact O-N 3.18Å
1077	L	82.4	Confident	81.4	Confident	0 Å²	0	34.9 Å²	34.9	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-66.6	-40.5	174.3	-175.4	65.8	0	0	0	111.8	M950 V976 V979 L981 A984 M1073 C1074 I1075 K1081	M950-L1077 HydrophobicContact CE-CB 4.29Å; V976-L1077 HydrophobicContact CG1-CD1 4.16Å; V979-L1077 HydrophobicContact CB-CD1 4.49Å; V979-L1077 HydrophobicContact CG1-CD2 4.16Å; L981-L1077 HydrophobicContact CD1-CD2 3.97Å; L981-L1077 HydrophobicContact CD1-CG 4.25Å; A984-L1077 HydrophobicContact CB-CD2 3.7Å; M1073-L1077 WeakPolarHBondContact O-CB 3.2Å; M1073-L1077 PolarHBondContact O-N 3.14Å; C1074-L1077 PolarHBondContact O-N 2.93Å; I1075-L1077 VanDerWaalsContact C-N 3.31Å; I1075-L1077 PolarHBondContact O-N 3.44Å; L1077-K1081 WeakPolarHBondContact O-CG 3.15Å; L1077-K1081 PolarHBondContact O-N 3.06Å
1078	L	81.4	Confident	81.1	Confident	57 Å²	57	39.5 Å²	39.5	30%	0.298	20%	0.198	S	C	.	.	H	α-helix	trans	-63.7	-48.7	176.6	-178.9	71.4	0	0	0	111.3	L981 C1074 I1075 H1080 K1081 I1082 F1136	L981-L1078 HydrophobicContact CD2-CD1 3.66Å; C1074-L1078 VanDerWaalsContact O-CB 3.29Å; C1074-L1078 WeakPolarHBondContact O-CB 3.08Å; C1074-L1078 PolarHBondContact O-N 2.99Å; I1075-L1078 WeakPolarHBondContact O-CB 3.33Å; I1075-L1078 PolarHBondContact O-N 3.49Å; I1075-L1078 VanDerWaalsContact O-N 3.15Å; L1078-H1080 VanDerWaalsContact C-N 3.33Å; L1078-H1080 PolarHBondContact O-N 3.38Å; L1078-K1081 PolarHBondContact O-N 3.24Å; L1078-I1082 HydrophobicContact CD1-CD1 4.4Å; L1078-I1082 HydrophobicContact CG-CD1 4.02Å; L1078-I1082 WeakPolarHBondContact O-CG1 3.47Å; L1078-I1082 PolarHBondContact O-N 3.42Å; L1078-F1136 HydrophobicContact CD1-CD1 4.32Å; L1078-F1136 HydrophobicContact CD1-CE1 3.72Å
1079	Q	79.3	Confident	80.9	Confident	107 Å²	107	39.4 Å²	39.4	50%	0.5	20%	0.198	S	C	.	.	H	α-helix	trans	-56.6	-47.7	177	-75.3	178	-12.9	0	0	111	I1075 K1081 I1082 D1083	I1075-Q1079 HydrophobicContact CG2-CG 4.33Å; I1075-Q1079 WeakPolarHBondContact O-CB 3.26Å; I1075-Q1079 WeakPolarHBondContact O-CG 3.41Å; I1075-Q1079 PolarHBondContact O-N 2.95Å; Q1079-K1081 PolarHBondContact O-N 2.88Å; Q1079-I1082 PolarHBondContact O-N 3.37Å; Q1079-D1083 PolarHBondContact O-N 3.48Å
1080	H	80.7	Confident	80.8	Confident	68 Å²	68	41.2 Å²	41.2	32%	0.315	21%	0.207	S	C	.	.	H	α-helix	trans	-62.2	-40.7	178.2	-166.4	68.7	0	0	0	112.7	V976 N1076 L1078 I1082 D1083 V1084	V976-H1080 VanDerWaalsContact CB-CD2 3.46Å; V976-H1080 WeakPolarHBondContact CB-CD2 3.09Å; V976-H1080 WeakPolarHBondContact CB-NE2 3.42Å; V976-H1080 WeakPolarHBondContact CG1-CD2 3.39Å; N1076-H1080 WeakPolarHBondContact O-CB 3.25Å; N1076-H1080 PolarHBondContact O-N 3.18Å; L1078-H1080 VanDerWaalsContact C-N 3.33Å; L1078-H1080 PolarHBondContact O-N 3.38Å; H1080-I1082 PolarHBondContact O-N 2.95Å; H1080-D1083 WeakPolarHBondContact O-CB 3.44Å; H1080-D1083 PolarHBondContact O-N 3.4Å; H1080-V1084 WeakPolarHBondContact O-CG2 3.36Å; H1080-V1084 PolarHBondContact O-N 3.27Å
1081	K	79	Confident	80.6	Confident	19 Å²	19	46.6 Å²	46.6	8%	0.083	23%	0.232	C	C	.	.	H	α-helix	trans	-65.7	-36.8	174.9	-76	-168.5	-179.7	-132.8	0	113.2	V979 L981 L1077 L1078 Q1079 D1083 V1084 T1085 F1136	V979-K1081 WeakPolarHBondContact O-CE 3.4Å; V979-K1081 PolarHBondContact O-NZ 2.68Å; L981-K1081 HydrophobicContact CB-CD 4.27Å; L1077-K1081 WeakPolarHBondContact O-CG 3.15Å; L1077-K1081 PolarHBondContact O-N 3.06Å; L1078-K1081 PolarHBondContact O-N 3.24Å; Q1079-K1081 PolarHBondContact O-N 2.88Å; K1081-D1083 VanDerWaalsContact C-N 3.33Å; K1081-V1084 PolarHBondContact O-N 3.44Å; K1081-T1085 WeakPolarHBondContact O-CB 3.18Å; K1081-T1085 PolarHBondContact O-N 3.41Å; K1081-T1085 PolarHBondContact O-OG1 3.14Å; K1081-F1136 HydrophobicContact CB-CE1 4.11Å; K1081-F1136 HydrophobicContact CB-CE2 4.29Å; K1081-F1136 HydrophobicContact CB-CZ 3.96Å; K1081-F1136 HydrophobicContact CD-CE1 4.5Å; K1081-F1136 HydrophobicContact CD-CE2 4.1Å; K1081-F1136 HydrophobicContact CD-CZ 3.69Å; K1081-F1136 HydrophobicContact CG-CZ 4.47Å
1082	I	80.6	Confident	80.2	Confident	23 Å²	23	46.6 Å²	46.6	12%	0.118	24%	0.235	C	C	.	.	H	α-helix	trans	-65.4	-39.9	173.9	-65.8	169.6	0	0	0	109.9	L1078 Q1079 H1080 T1085 F1086 F1136 A1139 L1140	L1078-I1082 HydrophobicContact CD1-CD1 4.4Å; L1078-I1082 HydrophobicContact CG-CD1 4.02Å; L1078-I1082 WeakPolarHBondContact O-CG1 3.47Å; L1078-I1082 PolarHBondContact O-N 3.42Å; Q1079-I1082 PolarHBondContact O-N 3.37Å; H1080-I1082 PolarHBondContact O-N 2.95Å; I1082-T1085 PolarHBondContact O-N 3.27Å; I1082-F1086 VanDerWaalsContact O-CB 3.32Å; I1082-F1086 WeakPolarHBondContact O-CB 3.45Å; I1082-F1086 PolarHBondContact O-N 3.03Å; I1082-F1136 HydrophobicContact CG1-CD1 4.04Å; I1082-A1139 HydrophobicContact CD1-CB 4.14Å; I1082-L1140 HydrophobicContact CG2-CG 4.23Å
1083	D	79.3	Confident	79.9	Confident	57 Å²	57	45.8 Å²	45.8	31%	0.305	23%	0.23	S	C	.	.	H	α-helix	trans	-62.7	-46.3	175.1	-70.5	-15.8	0	0	0	112.2	Q1079 H1080 K1081 F1086 Q1087 R1144	Q1079-D1083 PolarHBondContact O-N 3.48Å; H1080-D1083 WeakPolarHBondContact O-CB 3.44Å; H1080-D1083 PolarHBondContact O-N 3.4Å; K1081-D1083 VanDerWaalsContact C-N 3.33Å; D1083-F1086 WeakPolarHBondContact O-CB 3.42Å; D1083-F1086 PolarHBondContact O-N 3.22Å; D1083-Q1087 WeakPolarHBondContact O-CG 3.48Å; D1083-Q1087 PolarHBondContact O-N 2.79Å; D1083-R1144 IonicContact OD1-CZ 2.67Å; D1083-R1144 IonicContact OD1-NH1 2.98Å; D1083-R1144 PolarHBondContact OD1-NH1 3.09Å; D1083-R1144 IonicContact OD1-NH2 2.79Å; D1083-R1144 PolarHBondContact OD1-NH2 3.31Å
1084	V	77.6	Confident	79.6	Confident	31 Å²	31	48.1 Å²	48.1	19%	0.188	24%	0.242	C	C	.	.	H	α-helix	trans	-64.6	-42.8	177.3	172.8	0	0	0	0	110.9	D977 H1080 K1081 F1086 Q1087 M1088	D977-V1084 WeakPolarHBondContact OD1-CG1 3.08Å; D977-V1084 WeakPolarHBondContact OD1-CG2 3.05Å; H1080-V1084 WeakPolarHBondContact O-CG2 3.36Å; H1080-V1084 PolarHBondContact O-N 3.27Å; K1081-V1084 PolarHBondContact O-N 3.44Å; V1084-F1086 VanDerWaalsContact C-N 3.29Å; V1084-F1086 PolarHBondContact O-N 2.96Å; V1084-Q1087 PolarHBondContact O-N 3.05Å; V1084-M1088 HydrophobicContact CG1-CG 4.21Å; V1084-M1088 WeakPolarHBondContact O-CB 3.36Å; V1084-M1088 VanDerWaalsContact O-CG 3.23Å; V1084-M1088 WeakPolarHBondContact O-CG 3.36Å; V1084-M1088 PolarHBondContact O-N 3.44Å
1085	T	76.7	Confident	79.1	Confident	13 Å²	13	55 Å²	55	8%	0.08	27%	0.267	C	S	.	.	H	α-helix	trans	-60.5	-42	175.9	-54.2	0	0	0	0	110.8	K1081 I1082 M1088 L1089 F1136 L1140	K1081-T1085 WeakPolarHBondContact O-CB 3.18Å; K1081-T1085 PolarHBondContact O-N 3.41Å; K1081-T1085 PolarHBondContact O-OG1 3.14Å; I1082-T1085 PolarHBondContact O-N 3.27Å; T1085-M1088 PolarHBondContact O-N 3.42Å; T1085-L1089 HydrophobicContact CG2-CD1 4.22Å; T1085-L1089 VanDerWaalsContact O-CG 3.29Å; T1085-L1089 WeakPolarHBondContact O-CG 3.42Å; T1085-L1089 PolarHBondContact O-N 3.22Å; T1085-F1136 HydrophobicContact CG2-CB 3.94Å; T1085-L1140 HydrophobicContact CG2-CD1 4.46Å
1086	F	81.7	Confident	78.6	Confident	29 Å²	29	53.4 Å²	53.4	13%	0.127	26%	0.259	C	S	.	.	H	α-helix	trans	-61.3	-45.8	175.2	178.3	-116.2	0	0	0	112.4	I1082 D1083 V1084 L1089 L1090 L1140 R1144 L1147 V1148	I1082-F1086 VanDerWaalsContact O-CB 3.32Å; I1082-F1086 WeakPolarHBondContact O-CB 3.45Å; I1082-F1086 PolarHBondContact O-N 3.03Å; D1083-F1086 WeakPolarHBondContact O-CB 3.42Å; D1083-F1086 PolarHBondContact O-N 3.22Å; V1084-F1086 VanDerWaalsContact C-N 3.29Å; V1084-F1086 PolarHBondContact O-N 2.96Å; F1086-L1089 PolarHBondContact O-N 3.45Å; F1086-L1090 HydrophobicContact CD1-CD1 4.24Å; F1086-L1090 HydrophobicContact CE1-CD1 3.72Å; F1086-L1090 HydrophobicContact CE2-CD1 4.17Å; F1086-L1090 HydrophobicContact CE2-CG 4.4Å; F1086-L1090 HydrophobicContact CZ-CD1 3.7Å; F1086-L1090 HydrophobicContact CZ-CG 4.4Å; F1086-L1090 PolarHBondContact O-N 3.23Å; F1086-L1140 HydrophobicContact CB-CD2 4Å; F1086-L1140 HydrophobicContact CD2-CD2 3.68Å; F1086-L1140 HydrophobicContact CG-CD2 4.18Å; F1086-R1144 HydrophobicContact CD2-CB 3.93Å; F1086-R1144 HydrophobicContact CD2-CG 4.39Å; F1086-R1144 HydrophobicContact CE2-CB 3.76Å; F1086-R1144 HydrophobicContact CE2-CG 4.21Å; F1086-R1144 WeakPolarHBondContact CE2-O 3.32Å; F1086-R1144 HydrophobicContact CZ-CB 4.37Å; F1086-R1144 HydrophobicContact CZ-CG 4.37Å; F1086-L1147 HydrophobicContact CE1-CD2 4.5Å; F1086-L1147 HydrophobicContact CE2-CB 4.44Å; F1086-L1147 HydrophobicContact CZ-CB 4.3Å; F1086-L1147 HydrophobicContact CZ-CD2 3.66Å; F1086-V1148 HydrophobicContact CD2-CG2 3.91Å; F1086-V1148 HydrophobicContact CE2-CG2 3.73Å
1087	Q	80.5	Confident	78.1	Confident	134 Å²	134	55 Å²	55	63%	0.626	26%	0.263	S	S	*	.	H	α-helix	trans	-64.6	-41.6	176.4	-72	-174.4	-2.3	0	0	112.2	D1083 V1084 L1089 L1090 H1091	D1083-Q1087 WeakPolarHBondContact O-CG 3.48Å; D1083-Q1087 PolarHBondContact O-N 2.79Å; V1084-Q1087 PolarHBondContact O-N 3.05Å; Q1087-L1089 VanDerWaalsContact C-N 3.33Å; Q1087-L1089 PolarHBondContact O-N 3.07Å; Q1087-L1090 PolarHBondContact O-N 3.45Å; Q1087-H1091 WeakPolarHBondContact O-CB 3.39Å; Q1087-H1091 PolarHBondContact O-N 3.34Å
1088	M	77.1	Confident	77.5	Confident	97 Å²	97	61.6 Å²	61.6	48%	0.478	29%	0.292	S	S	.	.	H	α-helix	trans	-59.6	-41	174.4	-75.8	-90.8	-70.9	0	0	111.8	V1084 T1085 H1091 S1092	V1084-M1088 HydrophobicContact CG1-CG 4.21Å; V1084-M1088 WeakPolarHBondContact O-CB 3.36Å; V1084-M1088 VanDerWaalsContact O-CG 3.23Å; V1084-M1088 WeakPolarHBondContact O-CG 3.36Å; V1084-M1088 PolarHBondContact O-N 3.44Å; T1085-M1088 PolarHBondContact O-N 3.42Å; M1088-H1091 PolarHBondContact O-N 3.41Å; M1088-S1092 WeakPolarHBondContact O-CB 3.2Å; M1088-S1092 PolarHBondContact O-N 3.39Å; M1088-S1092 PolarHBondContact O-OG 3.48Å
1089	L	77.2	Confident	76.9	Confident	7 Å²	7	63.1 Å²	63.1	4%	0.037	30%	0.297	C	S	.	.	H	α-helix	trans	-64.8	-48	176	-73.9	163.4	0	0	0	111.6	T1085 F1086 Q1087 H1091 S1092 V1093 L1125 L1137 L1140 V1148	T1085-L1089 HydrophobicContact CG2-CD1 4.22Å; T1085-L1089 VanDerWaalsContact O-CG 3.29Å; T1085-L1089 WeakPolarHBondContact O-CG 3.42Å; T1085-L1089 PolarHBondContact O-N 3.22Å; F1086-L1089 PolarHBondContact O-N 3.45Å; Q1087-L1089 VanDerWaalsContact C-N 3.33Å; Q1087-L1089 PolarHBondContact O-N 3.07Å; L1089-H1091 VanDerWaalsContact C-N 3.27Å; L1089-H1091 PolarHBondContact O-N 3.21Å; L1089-S1092 PolarHBondContact O-N 3.19Å; L1089-S1092 VanDerWaalsContact O-N 3.13Å; L1089-V1093 WeakPolarHBondContact O-CG2 3.44Å; L1089-V1093 PolarHBondContact O-N 3.01Å; L1089-L1125 HydrophobicContact CD2-CB 3.88Å; L1089-L1125 HydrophobicContact CD2-CD1 4.35Å; L1089-L1137 HydrophobicContact CD1-CD2 3.38Å; L1089-L1137 HydrophobicContact CD1-CG 4.21Å; L1089-L1137 HydrophobicContact CD2-CD2 3.88Å; L1089-L1137 HydrophobicContact CG-CD2 4.23Å; L1089-L1140 HydrophobicContact CD1-CD1 3.69Å; L1089-V1148 HydrophobicContact CB-CG1 4.46Å; L1089-V1148 HydrophobicContact CB-CG2 4.31Å
1090	L	80.6	Confident	76.1	Confident	39 Å²	39	65.1 Å²	65.1	20%	0.204	30%	0.3	C	S	.	.	H	α-helix	trans	-59	-39.7	176	-73.4	173.2	0	0	0	112	F1086 Q1087 D1094 V1148 R1155	F1086-L1090 HydrophobicContact CD1-CD1 4.24Å; F1086-L1090 HydrophobicContact CE1-CD1 3.72Å; F1086-L1090 HydrophobicContact CE2-CD1 4.17Å; F1086-L1090 HydrophobicContact CE2-CG 4.4Å; F1086-L1090 HydrophobicContact CZ-CD1 3.7Å; F1086-L1090 HydrophobicContact CZ-CG 4.4Å; F1086-L1090 PolarHBondContact O-N 3.23Å; Q1087-L1090 PolarHBondContact O-N 3.45Å; L1090-D1094 PolarHBondContact O-N 3.49Å; L1090-D1094 VanDerWaalsContact O-N 3.11Å; L1090-V1148 HydrophobicContact CD2-CG2 4.31Å; L1090-R1155 PolarHBondContact O-NH1 3.09Å
1091	H	81.5	Confident	75.1	Confident	127 Å²	127	66 Å²	66	59%	0.588	31%	0.305	S	S	*	.	H	α-helix	trans	-70.9	-32.5	176.6	-162	-87.1	0	0	0	112.6	Q1087 M1088 L1089 D1094 R1095	Q1087-H1091 WeakPolarHBondContact O-CB 3.39Å; Q1087-H1091 PolarHBondContact O-N 3.34Å; M1088-H1091 PolarHBondContact O-N 3.41Å; L1089-H1091 VanDerWaalsContact C-N 3.27Å; L1089-H1091 PolarHBondContact O-N 3.21Å; H1091-D1094 WeakPolarHBondContact O-CB 3.34Å; H1091-D1094 PolarHBondContact O-N 2.98Å; H1091-R1095 WeakPolarHBondContact O-CB 3.31Å; H1091-R1095 PolarHBondContact O-N 3Å
1092	S	76.1	Confident	74	Confident	40 Å²	40	69.8 Å²	69.8	28%	0.28	33%	0.333	S	S	.	.	H	α-helix	trans	-69.5	-40.5	174.9	-61	0	0	0	0	111.6	M1088 L1089 D1094 R1095 M1096	M1088-S1092 WeakPolarHBondContact O-CB 3.2Å; M1088-S1092 PolarHBondContact O-N 3.39Å; M1088-S1092 PolarHBondContact O-OG 3.48Å; L1089-S1092 PolarHBondContact O-N 3.19Å; L1089-S1092 VanDerWaalsContact O-N 3.13Å; S1092-D1094 VanDerWaalsContact C-N 3.27Å; S1092-D1094 PolarHBondContact O-N 2.86Å; S1092-R1095 PolarHBondContact O-N 3.15Å; S1092-M1096 WeakPolarHBondContact O-CG 3.41Å; S1092-M1096 PolarHBondContact O-N 3.22Å
1093	V	75.8	Confident	72.8	Confident	0 Å²	0	74 Å²	74	0%	0	36%	0.36	C	S	.	.	H	α-helix	trans	-59.8	-39.4	170.5	175.3	0	0	0	0	110	L1089 Y1097 L1125 V1148 W1152 R1155	L1089-V1093 WeakPolarHBondContact O-CG2 3.44Å; L1089-V1093 PolarHBondContact O-N 3.01Å; V1093-Y1097 WeakPolarHBondContact O-CB 3.49Å; V1093-Y1097 PolarHBondContact O-N 2.93Å; V1093-Y1097 VanDerWaalsContact O-N 3.13Å; V1093-L1125 HydrophobicContact CG2-CD1 3.74Å; V1093-L1125 HydrophobicContact CG2-CD2 3.68Å; V1093-L1125 HydrophobicContact CG2-CG 4.39Å; V1093-V1148 HydrophobicContact CG2-CG1 4.19Å; V1093-W1152 HydrophobicContact CB-CE3 4.42Å; V1093-W1152 HydrophobicContact CG1-CB 4.16Å; V1093-W1152 HydrophobicContact CG1-CE3 3.85Å; V1093-W1152 HydrophobicContact CG2-CE3 4.17Å; V1093-R1155 VanDerWaalsContact C-NH1 3.31Å
1094	D	78	Confident	71.4	Confident	52 Å²	52	75.7 Å²	75.7	28%	0.278	38%	0.382	S	S	.	.	H	α-helix	trans	-65.9	-43.2	175.5	-99.2	-39	0	0	0	112.2	L1090 H1091 S1092 Y1097 K1098 R1155	L1090-D1094 PolarHBondContact O-N 3.49Å; L1090-D1094 VanDerWaalsContact O-N 3.11Å; H1091-D1094 WeakPolarHBondContact O-CB 3.34Å; H1091-D1094 PolarHBondContact O-N 2.98Å; S1092-D1094 VanDerWaalsContact C-N 3.27Å; S1092-D1094 PolarHBondContact O-N 2.86Å; D1094-Y1097 PolarHBondContact O-N 3.29Å; D1094-K1098 WeakPolarHBondContact O-CG 3.07Å; D1094-K1098 PolarHBondContact O-N 3.2Å; D1094-R1155 IonicContact OD1-CZ 3.42Å; D1094-R1155 IonicContact OD1-NE 3.17Å; D1094-R1155 PolarHBondContact OD1-NE 3.4Å; D1094-R1155 VanDerWaalsContact OD1-NE 3.1Å; D1094-R1155 IonicContact OD1-NH1 3.08Å; D1094-R1155 IonicContact OD1-NH2 2.84Å; D1094-R1155 PolarHBondContact OD1-NH2 3.08Å; D1094-R1155 IonicContact OD2-CZ 2.75Å; D1094-R1155 IonicContact OD2-NH1 3.39Å; D1094-R1155 IonicContact OD2-NH2 3.09Å; D1094-R1155 PolarHBondContact OD2-NH2 3.15Å
1095	R	74.4	Confident	69.7	Low	154 Å²	154	80.5 Å²	80.5	58%	0.581	40%	0.404	S	S	*	.	H	α-helix	trans	-64.7	-48.3	179.9	-176.9	-179.1	172.7	-172.8	-4.9	111.3	H1091 S1092 Y1097 K1098 E1099	H1091-R1095 WeakPolarHBondContact O-CB 3.31Å; H1091-R1095 PolarHBondContact O-N 3Å; S1092-R1095 PolarHBondContact O-N 3.15Å; R1095-Y1097 VanDerWaalsContact C-N 3.28Å; R1095-Y1097 PolarHBondContact O-N 2.81Å; R1095-K1098 PolarHBondContact O-N 3.44Å; R1095-K1098 VanDerWaalsContact O-N 3.11Å; R1095-E1099 HydrophobicContact CG-CG 4.43Å; R1095-E1099 IonicContact CZ-OE1 2.66Å; R1095-E1099 VanDerWaalsContact CZ-OE1 3.31Å; R1095-E1099 IonicContact NE-OE1 3.74Å; R1095-E1099 PolarHBondContact NE-OE1 3.28Å; R1095-E1099 IonicContact NH2-OE1 3.28Å; R1095-E1099 PolarHBondContact NH2-OE1 3.42Å; R1095-E1099 PolarHBondContact O-N 3.47Å
1096	M	71	Confident	68.3	Low	42 Å²	42	86.8 Å²	86.8	21%	0.207	44%	0.437	C	S	.	.	H	α-helix	trans	-62.9	-36.2	177.8	-70.6	-148.9	-67.8	0	0	112	S1092 R1100 V1124 L1125 W1152	S1092-M1096 WeakPolarHBondContact O-CG 3.41Å; S1092-M1096 PolarHBondContact O-N 3.22Å; M1096-R1100 VanDerWaalsContact O-CB 3.31Å; M1096-R1100 WeakPolarHBondContact O-CB 3.31Å; M1096-R1100 VanDerWaalsContact O-CG 3.24Å; M1096-R1100 WeakPolarHBondContact O-CG 3.39Å; M1096-R1100 PolarHBondContact O-N 3.42Å; M1096-V1124 HydrophobicContact CE-CG1 4.4Å; M1096-L1125 HydrophobicContact CE-CD2 3.38Å; M1096-L1125 HydrophobicContact CE-CG 4.3Å; M1096-W1152 HydrophobicContact CB-CZ3 4.35Å; M1096-W1152 HydrophobicContact CE-CE3 4.35Å; M1096-W1152 HydrophobicContact CE-CH2 3.61Å; M1096-W1152 HydrophobicContact CE-CZ3 3.3Å
1097	Y	69.9	Low	66.3	Low	58 Å²	58	93 Å²	93	23%	0.227	47%	0.471	C	S	.	.	H	α-helix	trans	-62	-44.2	171.9	172.4	-102	0	0	0	112.1	V1093 D1094 R1095 Q1101 R1155 C1158	V1093-Y1097 WeakPolarHBondContact O-CB 3.49Å; V1093-Y1097 PolarHBondContact O-N 2.93Å; V1093-Y1097 VanDerWaalsContact O-N 3.13Å; D1094-Y1097 PolarHBondContact O-N 3.29Å; R1095-Y1097 VanDerWaalsContact C-N 3.28Å; R1095-Y1097 PolarHBondContact O-N 2.81Å; Y1097-Q1101 PolarHBondContact O-N 3.15Å; Y1097-Q1101 PolarHBondContact OH-NE2 3.17Å; Y1097-R1155 HydrophobicContact CD2-CB 3.77Å; Y1097-R1155 HydrophobicContact CD2-CG 4.19Å; Y1097-R1155 WeakPolarHBondContact CD2-O 3.48Å; Y1097-R1155 HydrophobicContact CE2-CB 4.32Å; Y1097-R1155 WeakPolarHBondContact CE2-O 3.44Å; Y1097-R1155 HydrophobicContact CG-CB 4.14Å; Y1097-R1155 HydrophobicContact CG-CG 4.16Å; Y1097-C1158 HydrophobicContact CE2-CB 4.21Å
1098	K	70.3	Confident	64.2	Low	139 Å²	139	93.4 Å²	93.4	60%	0.604	47%	0.473	S	S	*	.	H	α-helix	trans	-66.6	-45.3	177	-73	177.2	-176.7	175.9	0	113.1	D1094 R1095 R1100 Q1101 S1102	D1094-K1098 WeakPolarHBondContact O-CG 3.07Å; D1094-K1098 PolarHBondContact O-N 3.2Å; R1095-K1098 PolarHBondContact O-N 3.44Å; R1095-K1098 VanDerWaalsContact O-N 3.11Å; K1098-R1100 VanDerWaalsContact C-N 3.33Å; K1098-R1100 PolarHBondContact O-N 3.22Å; K1098-Q1101 PolarHBondContact O-N 3.44Å; K1098-S1102 PolarHBondContact O-N 3.11Å
1099	E	67.3	Low	62.5	Low	90 Å²	90	98.5 Å²	98.5	42%	0.421	50%	0.496	S	S	.	.	H	α-helix	trans	-61.6	-42.8	178.5	-74.2	174.9	177.2	0	0	110.5	R1095 Q1101 S1102	R1095-E1099 HydrophobicContact CG-CG 4.43Å; R1095-E1099 IonicContact CZ-OE1 2.66Å; R1095-E1099 VanDerWaalsContact CZ-OE1 3.31Å; R1095-E1099 IonicContact NE-OE1 3.74Å; R1095-E1099 PolarHBondContact NE-OE1 3.28Å; R1095-E1099 IonicContact NH2-OE1 3.28Å; R1095-E1099 PolarHBondContact NH2-OE1 3.42Å; R1095-E1099 PolarHBondContact O-N 3.47Å; E1099-Q1101 VanDerWaalsContact C-N 3.3Å; E1099-Q1101 PolarHBondContact O-N 3.45Å; E1099-S1102 PolarHBondContact O-N 3.07Å; E1099-S1102 VanDerWaalsContact O-N 3.09Å; E1099-S1102 PolarHBondContact O-OG 3.15Å
1100	R	62.8	Low	60.8	Low	149 Å²	149	109.8 Å²	109.8	56%	0.562	54%	0.538	S	S	*	.	H	α-helix	trans	-67.8	-22.4	176.5	-71.7	178.4	-178.2	-171.7	-0.2	114.4	M1096 K1098 S1102	M1096-R1100 VanDerWaalsContact O-CB 3.31Å; M1096-R1100 WeakPolarHBondContact O-CB 3.31Å; M1096-R1100 VanDerWaalsContact O-CG 3.24Å; M1096-R1100 WeakPolarHBondContact O-CG 3.39Å; M1096-R1100 PolarHBondContact O-N 3.42Å; K1098-R1100 VanDerWaalsContact C-N 3.33Å; K1098-R1100 PolarHBondContact O-N 3.22Å; R1100-S1102 VanDerWaalsContact C-N 3.34Å
1101	Q	59.3	Low	58.9	Low	87 Å²	87	114 Å²	114	41%	0.407	56%	0.56	S	S	.	*	H	α-helix	trans	-77	-19.6	171.7	-79.7	-170.5	-16.4	0	0	113.5	Y1097 K1098 E1099	Y1097-Q1101 PolarHBondContact O-N 3.15Å; Y1097-Q1101 PolarHBondContact OH-NE2 3.17Å; K1098-Q1101 PolarHBondContact O-N 3.44Å; E1099-Q1101 VanDerWaalsContact C-N 3.3Å; E1099-Q1101 PolarHBondContact O-N 3.45Å
1102	S	57	Low	57	Low	98 Å²	98	113.8 Å²	113.8	69%	0.685	56%	0.561	S	S	*	*	H	α-helix	trans	-88.2	-12.5	-176.5	69.1	0	0	0	0	114.7	K1098 E1099 R1100	K1098-S1102 PolarHBondContact O-N 3.11Å; E1099-S1102 PolarHBondContact O-N 3.07Å; E1099-S1102 VanDerWaalsContact O-N 3.09Å; E1099-S1102 PolarHBondContact O-OG 3.15Å; R1100-S1102 VanDerWaalsContact C-N 3.34Å
1103	V	55	Low	55.6	Low	110 Å²	110	120.3 Å²	120.3	67%	0.667	59%	0.587	S	S	*	*	S	Bend	trans	-90.2	116.1	-176.4	-175.9	0	0	0	0	110.5
1104	A	48.9	Very low	54.3	Low	93 Å²	93	128.6 Å²	128.6	77%	0.769	62%	0.623	S	S	*	*			trans	-61.2	142	177.5	0	0	0	0	0	112.2	D1106	A1104-D1106 PolarHBondContact O-N 3.49Å; A1104-D1106 VanDerWaalsContact O-N 3.09Å
1105	M	42.6	Very low	53.2	Low	133 Å²	133	129.2 Å²	129.2	66%	0.655	63%	0.628	S	S	*	*	S	Bend	trans	-75.9	12.5	-151.1	-85.8	-171.6	56.7	0	0	118.8	N1107	M1105-N1107 PolarHBondContact O-N 3.49Å
1106	D	47.9	Very low	52.2	Low	145 Å²	145	130 Å²	130	78%	0.775	64%	0.639	S	S	*	*	S	Bend	trans	-82.7	-9.6	-156.7	-80.2	-13.1	0	0	0	118.6	A1104	A1104-D1106 PolarHBondContact O-N 3.49Å; A1104-D1106 VanDerWaalsContact O-N 3.09Å
1107	N	39.4	Very low	51.8	Low	158 Å²	158	132 Å²	132	85%	0.845	65%	0.65	S	S	*	*	S	Bend	trans	-147.8	3.9	-172.1	-90.6	-40.3	0	0	0	121.8	M1105	M1105-N1107 PolarHBondContact O-N 3.49Å
1108	E	36.8	Very low	51.5	Low	143 Å²	143	131.4 Å²	131.4	67%	0.668	65%	0.652	S	S	*	*			trans	-124.2	72.3	-177	-73	-165.8	151.6	0	0	114.7	R1110	E1108-R1110 PolarHBondContact O-N 3.41Å
1109	Q	41.6	Very low	51.3	Low	205 Å²	205	129.8 Å²	129.8	96%	0.958	65%	0.651	S	S	*	*	S	Bend	trans	-74.3	4.1	159.5	-100.3	176	-22.4	0	0	113.4
1110	R	41	Very low	51.3	Low	244 Å²	244	127.5 Å²	127.5	92%	0.921	65%	0.647	S	S	*	*	S	Bend	trans	-108.6	-2.5	-170.6	-84.2	-176.1	175.8	169.3	-0.2	117.3	E1108	E1108-R1110 PolarHBondContact O-N 3.41Å
1111	L	40	Very low	51.5	Low	126 Å²	126	120.6 Å²	120.6	66%	0.66	62%	0.621	S	S	*	*			trans	-119.7	7.1	-171.9	-99.5	124.1	0	0	0	116.7	E1113	L1111-E1113 PolarHBondContact O-N 3.27Å
1112	M	41.2	Very low	51.8	Low	124 Å²	124	117.1 Å²	117.1	61%	0.611	61%	0.605	S	S	*	*			trans	-83.8	48.6	172.9	-74.5	-98.7	-98.4	0	0	111.5	K1114	M1112-K1114 PolarHBondContact O-N 3.3Å
1113	E	47.4	Very low	52.4	Low	176 Å²	176	119 Å²	119	82%	0.822	60%	0.601	S	S	*	*			trans	-67.8	127	172.3	-132.8	172.5	-168.4	0	0	108.5	L1111 V1115	L1111-E1113 PolarHBondContact O-N 3.27Å; E1113-V1115 PolarHBondContact O-N 3.06Å; E1113-V1115 VanDerWaalsContact O-N 3.07Å
1114	K	48.7	Very low	53	Low	174 Å²	174	116.7 Å²	116.7	76%	0.757	59%	0.587	S	S	*	*			trans	-50.2	117.8	174.5	-77.1	174.9	174.3	176.2	0	108.3	M1112 E1116	M1112-K1114 PolarHBondContact O-N 3.3Å; K1114-E1116 VanDerWaalsContact C-N 3.25Å; K1114-E1116 HydrophobicContact CB-CG 3.84Å; K1114-E1116 PolarHBondContact O-N 3.01Å
1115	V	54.2	Low	53.8	Low	65 Å²	65	113 Å²	113	39%	0.394	56%	0.555	S	S	.	*			trans	-74.6	90.6	166.2	-175.4	0	0	0	0	106.2	E1113 D1117 A1120 L1121	E1113-V1115 PolarHBondContact O-N 3.06Å; E1113-V1115 VanDerWaalsContact O-N 3.07Å; V1115-D1117 VanDerWaalsContact C-N 3.27Å; V1115-D1117 PolarHBondContact O-N 3.35Å; V1115-A1120 HydrophobicContact CG1-CB 3.99Å; V1115-L1121 HydrophobicContact CG1-CB 3.72Å
1116	E	54.8	Low	54.8	Low	171 Å²	171	107 Å²	107	80%	0.799	53%	0.526	S	S	*	.			trans	-74.8	-14.3	-173.9	-68.7	-174.1	159.4	0	0	113.5	K1114	K1114-E1116 VanDerWaalsContact C-N 3.25Å; K1114-E1116 HydrophobicContact CB-CG 3.84Å; K1114-E1116 PolarHBondContact O-N 3.01Å
1117	D	62.7	Low	55.4	Low	84 Å²	84	107.1 Å²	107.1	45%	0.449	52%	0.522	S	S	.	.			trans	-128.2	133	-175.1	-167.9	-5.2	0	0	0	112.4	V1115 N1119 A1120 L1121	V1115-D1117 VanDerWaalsContact C-N 3.27Å; V1115-D1117 PolarHBondContact O-N 3.35Å; D1117-N1119 PolarHBondContact O-N 3.08Å; D1117-N1119 PolarHBondContact OD1-N 2.94Å; D1117-N1119 VanDerWaalsContact OD1-N 3.14Å; D1117-A1120 HydrophobicContact CB-CB 4.18Å; D1117-A1120 WeakPolarHBondContact O-CB 3.44Å; D1117-A1120 PolarHBondContact O-N 3.24Å; D1117-L1121 PolarHBondContact O-N 2.84Å; D1117-L1121 VanDerWaalsContact O-N 3.07Å
1118	V	61.9	Low	56.4	Low	45 Å²	45	103.4 Å²	103.4	27%	0.273	52%	0.521	S	S	.	.	H	α-helix	trans	-53.8	-39.3	174	179.6	0	0	0	0	110.6	A1120 L1121 L1122 R1145 V1149	V1118-A1120 VanDerWaalsContact C-N 3.32Å; V1118-A1120 PolarHBondContact O-N 3.18Å; V1118-L1121 PolarHBondContact O-N 2.99Å; V1118-L1122 HydrophobicContact CG1-CD1 3.99Å; V1118-L1122 HydrophobicContact CG1-CG 4.25Å; V1118-L1122 WeakPolarHBondContact O-CB 3.27Å; V1118-L1122 VanDerWaalsContact O-CG 3.23Å; V1118-L1122 WeakPolarHBondContact O-CG 3.46Å; V1118-L1122 PolarHBondContact O-N 3.2Å; V1118-R1145 HydrophobicContact CG1-CB 4.39Å; V1118-V1149 HydrophobicContact CB-CG2 4.07Å; V1118-V1149 HydrophobicContact CG1-CG2 3.6Å; V1118-V1149 HydrophobicContact CG2-CG2 3.67Å
1119	N	66	Low	57.5	Low	106 Å²	106	99.6 Å²	99.6	57%	0.567	51%	0.505	S	S	*	.	H	α-helix	trans	-67.9	-33	178.8	-64.1	-49.2	0	0	0	112.2	D1117 K1123	D1117-N1119 PolarHBondContact O-N 3.08Å; D1117-N1119 PolarHBondContact OD1-N 2.94Å; D1117-N1119 VanDerWaalsContact OD1-N 3.14Å; N1119-K1123 WeakPolarHBondContact O-CB 3.39Å; N1119-K1123 PolarHBondContact O-N 3.33Å
1120	A	68	Low	58.6	Low	41 Å²	41	92.1 Å²	92.1	34%	0.339	48%	0.483	S	S	.	.	H	α-helix	trans	-69.7	-43.6	175.9	0	0	0	0	0	110.8	V1115 D1117 V1118 K1123 V1124	V1115-A1120 HydrophobicContact CG1-CB 3.99Å; D1117-A1120 HydrophobicContact CB-CB 4.18Å; D1117-A1120 WeakPolarHBondContact O-CB 3.44Å; D1117-A1120 PolarHBondContact O-N 3.24Å; V1118-A1120 VanDerWaalsContact C-N 3.32Å; V1118-A1120 PolarHBondContact O-N 3.18Å; A1120-K1123 WeakPolarHBondContact O-CB 3.15Å; A1120-K1123 PolarHBondContact O-N 3.15Å; A1120-V1124 WeakPolarHBondContact O-CG2 3.48Å; A1120-V1124 PolarHBondContact O-N 2.74Å
1121	L	67.3	Low	59.7	Low	4 Å²	4	88 Å²	88	2%	0.021	48%	0.477	C	S	.	.	H	α-helix	trans	-60	-49	173.8	-179.7	62.5	0	0	0	111.5	V1115 D1117 V1118 K1123 V1124 L1125 V1149 W1152	V1115-L1121 HydrophobicContact CG1-CB 3.72Å; D1117-L1121 PolarHBondContact O-N 2.84Å; D1117-L1121 VanDerWaalsContact O-N 3.07Å; V1118-L1121 PolarHBondContact O-N 2.99Å; L1121-K1123 PolarHBondContact O-N 2.92Å; L1121-V1124 PolarHBondContact O-N 2.9Å; L1121-L1125 HydrophobicContact CD1-CD1 4.1Å; L1121-L1125 HydrophobicContact CD1-CG 4.28Å; L1121-L1125 HydrophobicContact CD2-CD1 4.41Å; L1121-L1125 HydrophobicContact CG-CD1 3.84Å; L1121-L1125 HydrophobicContact CG-CG 4.42Å; L1121-L1125 WeakPolarHBondContact O-CB 3.37Å; L1121-L1125 WeakPolarHBondContact O-CG 3.28Å; L1121-L1125 PolarHBondContact O-N 3.26Å; L1121-V1149 HydrophobicContact CD2-CG2 4.28Å; L1121-W1152 HydrophobicContact CD1-CB 4.36Å; L1121-W1152 HydrophobicContact CD1-CD2 3.38Å; L1121-W1152 VanDerWaalsContact CD1-CE2 3.46Å; L1121-W1152 HydrophobicContact CD1-CE3 3.86Å; L1121-W1152 HydrophobicContact CD1-CG 3.6Å; L1121-W1152 HydrophobicContact CD1-CH2 4.45Å; L1121-W1152 HydrophobicContact CD1-CZ2 4Å; L1121-W1152 HydrophobicContact CD1-CZ3 4.39Å; L1121-W1152 HydrophobicContact CD2-CB 3.61Å; L1121-W1152 HydrophobicContact CD2-CD2 4.31Å; L1121-W1152 HydrophobicContact CD2-CG 3.64Å; L1121-W1152 HydrophobicContact CG-CD2 4.47Å; L1121-W1152 HydrophobicContact CG-CG 4.27Å
1122	L	65.4	Low	60.9	Low	14 Å²	14	87 Å²	87	7%	0.073	47%	0.469	C	S	.	.	H	α-helix	trans	-62	-33.7	177.7	-70.4	-179.6	0	0	0	111.6	V1118 S1126 L1137 R1145 V1148	V1118-L1122 HydrophobicContact CG1-CD1 3.99Å; V1118-L1122 HydrophobicContact CG1-CG 4.25Å; V1118-L1122 WeakPolarHBondContact O-CB 3.27Å; V1118-L1122 VanDerWaalsContact O-CG 3.23Å; V1118-L1122 WeakPolarHBondContact O-CG 3.46Å; V1118-L1122 PolarHBondContact O-N 3.2Å; L1122-S1126 WeakPolarHBondContact O-CB 3.48Å; L1122-S1126 PolarHBondContact O-N 2.85Å; L1122-S1126 PolarHBondContact O-OG 2.91Å; L1122-L1137 HydrophobicContact CB-CD2 4.17Å; L1122-L1137 HydrophobicContact CD1-CD2 4.31Å; L1122-L1137 HydrophobicContact CD2-CD2 3.58Å; L1122-L1137 HydrophobicContact CG-CD2 4.2Å; L1122-R1145 HydrophobicContact CD1-CG 4.27Å; L1122-V1148 HydrophobicContact CD2-CG1 4.47Å
1123	K	69.8	Low	62.1	Low	138 Å²	138	82.9 Å²	82.9	60%	0.6	45%	0.45	S	S	*	.	H	α-helix	trans	-66.8	-47.5	175.6	-166.9	177.9	180	-172.3	0	111.2	N1119 A1120 L1121 S1126 E1127	N1119-K1123 WeakPolarHBondContact O-CB 3.39Å; N1119-K1123 PolarHBondContact O-N 3.33Å; A1120-K1123 WeakPolarHBondContact O-CB 3.15Å; A1120-K1123 PolarHBondContact O-N 3.15Å; L1121-K1123 PolarHBondContact O-N 2.92Å; K1123-S1126 WeakPolarHBondContact CA-OG 3.25Å; K1123-S1126 CarbonylContact O-C 3.58Å; K1123-S1126 WeakPolarHBondContact O-CA 3.35Å; K1123-S1126 PolarHBondContact O-N 2.73Å; K1123-S1126 PolarHBondContact O-OG 3.31Å; K1123-E1127 PolarHBondContact O-N 3.19Å; K1123-E1127 VanDerWaalsContact O-N 3.09Å
1124	V	67.7	Low	63.1	Low	62 Å²	62	81.4 Å²	81.4	38%	0.376	44%	0.437	S	S	.	.	H	α-helix	trans	-61.2	-43.5	175.5	173.1	0	0	0	0	111.1	M1096 A1120 L1121 S1126 E1127	M1096-V1124 HydrophobicContact CE-CG1 4.4Å; A1120-V1124 WeakPolarHBondContact O-CG2 3.48Å; A1120-V1124 PolarHBondContact O-N 2.74Å; L1121-V1124 PolarHBondContact O-N 2.9Å; V1124-S1126 PolarHBondContact O-N 3.49Å; V1124-E1127 PolarHBondContact O-N 2.72Å
1125	L	65.4	Low	64.2	Low	16 Å²	16	79 Å²	79	8%	0.084	43%	0.427	C	S	.	.	H	α-helix	trans	-66.2	-20.7	174.9	-70	169.6	0	0	0	113	L1089 V1093 M1096 L1121 V1148	L1089-L1125 HydrophobicContact CD2-CB 3.88Å; L1089-L1125 HydrophobicContact CD2-CD1 4.35Å; V1093-L1125 HydrophobicContact CG2-CD1 3.74Å; V1093-L1125 HydrophobicContact CG2-CD2 3.68Å; V1093-L1125 HydrophobicContact CG2-CG 4.39Å; M1096-L1125 HydrophobicContact CE-CD2 3.38Å; M1096-L1125 HydrophobicContact CE-CG 4.3Å; L1121-L1125 HydrophobicContact CD1-CD1 4.1Å; L1121-L1125 HydrophobicContact CD1-CG 4.28Å; L1121-L1125 HydrophobicContact CD2-CD1 4.41Å; L1121-L1125 HydrophobicContact CG-CD1 3.84Å; L1121-L1125 HydrophobicContact CG-CG 4.42Å; L1121-L1125 WeakPolarHBondContact O-CB 3.37Å; L1121-L1125 WeakPolarHBondContact O-CG 3.28Å; L1121-L1125 PolarHBondContact O-N 3.26Å; L1125-V1148 HydrophobicContact CD1-CG1 3.93Å
1126	S	64.1	Low	65.1	Low	7 Å²	7	76.3 Å²	76.3	5%	0.049	41%	0.409	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.2	-5.2	178.3	78.9	0	0	0	0	114.5	L1122 K1123 V1124 G1128 D1129	L1122-S1126 WeakPolarHBondContact O-CB 3.48Å; L1122-S1126 PolarHBondContact O-N 2.85Å; L1122-S1126 PolarHBondContact O-OG 2.91Å; K1123-S1126 WeakPolarHBondContact CA-OG 3.25Å; K1123-S1126 CarbonylContact O-C 3.58Å; K1123-S1126 WeakPolarHBondContact O-CA 3.35Å; K1123-S1126 PolarHBondContact O-N 2.73Å; K1123-S1126 PolarHBondContact O-OG 3.31Å; V1124-S1126 PolarHBondContact O-N 3.49Å; S1126-G1128 PolarHBondContact O-N 3.21Å; S1126-D1129 PolarHBondContact O-N 3.3Å
1127	E	61	Low	65.7	Low	147 Å²	147	68.7 Å²	68.7	69%	0.687	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.8	97.1	178.7	-81.5	-178.1	174	0	0	109.8	K1123 V1124	K1123-E1127 PolarHBondContact O-N 3.19Å; K1123-E1127 VanDerWaalsContact O-N 3.09Å; V1124-E1127 PolarHBondContact O-N 2.72Å
1128	G	59.2	Low	66.1	Low	80 Å²	80	71.8 Å²	71.8	83%	0.825	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	134.2	-17.9	-177.4	0	0	0	0	0	113.5	S1126	S1126-G1128 PolarHBondContact O-N 3.21Å
1129	D	60.4	Low	66.6	Low	63 Å²	63	72 Å²	72	34%	0.337	39%	0.392	S	S	.	.			trans	-99.3	142.2	-171.8	-87.9	-5.5	0	0	0	113.6	S1126 N1133	S1126-D1129 PolarHBondContact O-N 3.3Å; D1129-N1133 HydrophobicContact CB-CB 3.79Å; D1129-N1133 PolarHBondContact OD2-ND2 3.4Å
1130	G	64.2	Low	66.9	Low	48 Å²	48	67 Å²	67	50%	0.495	37%	0.366	S	S	.	.			trans	-62	164.1	-176.9	0	0	0	0	0	114.1	Q1132 N1133	G1130-Q1132 PolarHBondContact O-N 2.64Å; G1130-N1133 PolarHBondContact O-N 3.26Å
1131	I	64.2	Low	67.3	Low	158 Å²	158	67.1 Å²	67.1	81%	0.81	37%	0.37	S	S	*	.	H	α-helix	trans	-49.5	-32.7	-177.2	-61.2	167.5	0	0	0	112.7	R1134 F1135	I1131-R1134 PolarHBondContact O-N 3.1Å; I1131-F1135 PolarHBondContact O-N 3.47Å
1132	Q	64.9	Low	67.6	Low	103 Å²	103	74.1 Å²	74.1	48%	0.481	40%	0.401	S	S	.	.	H	α-helix	trans	-62.4	-42.4	177.5	-65.3	-174	11.9	0	0	112.9	G1130 R1134 F1135 F1136	G1130-Q1132 PolarHBondContact O-N 2.64Å; Q1132-R1134 PolarHBondContact O-N 3.1Å; Q1132-F1135 WeakPolarHBondContact O-CB 3.38Å; Q1132-F1135 PolarHBondContact O-N 3.02Å; Q1132-F1136 HydrophobicContact CB-CE2 4.05Å; Q1132-F1136 WeakPolarHBondContact O-CD2 3.31Å; Q1132-F1136 PolarHBondContact O-N 3.33Å
1133	N	65.8	Low	68	Low	39 Å²	39	78.1 Å²	78.1	21%	0.209	43%	0.429	C	S	.	.	H	α-helix	trans	-69.8	-33.6	-178	-72.4	6.5	0	0	0	111.7	D1129 G1130 F1135 F1136 L1137	D1129-N1133 HydrophobicContact CB-CB 3.79Å; D1129-N1133 PolarHBondContact OD2-ND2 3.4Å; G1130-N1133 PolarHBondContact O-N 3.26Å; N1133-F1135 VanDerWaalsContact C-N 3.31Å; N1133-F1135 PolarHBondContact O-N 2.78Å; N1133-F1136 PolarHBondContact O-N 3.13Å; N1133-L1137 WeakPolarHBondContact O-CB 3.37Å; N1133-L1137 WeakPolarHBondContact O-CD1 3.48Å; N1133-L1137 WeakPolarHBondContact O-CG 3.39Å; N1133-L1137 PolarHBondContact O-N 2.68Å
1134	R	70.1	Confident	68.4	Low	145 Å²	145	75.6 Å²	75.6	55%	0.547	42%	0.416	S	S	.	.	H	α-helix	trans	-62.5	-38.3	172.2	-67.6	-168.7	-166.4	-176.5	4	112.5	I1131 Q1132 L1137 Q1138	I1131-R1134 PolarHBondContact O-N 3.1Å; Q1132-R1134 PolarHBondContact O-N 3.1Å; R1134-L1137 WeakPolarHBondContact O-CB 3.35Å; R1134-L1137 PolarHBondContact O-N 3.06Å; R1134-Q1138 PolarHBondContact O-N 2.68Å; R1134-Q1138 VanDerWaalsContact O-N 3.13Å
1135	F	71	Confident	68.9	Low	124 Å²	124	76.1 Å²	76.1	54%	0.544	41%	0.411	S	S	.	.	H	α-helix	trans	-66.3	-44.6	175	-176.9	-94.7	0	0	0	111.2	I1131 Q1132 N1133 L1137 Q1138 A1139	I1131-F1135 PolarHBondContact O-N 3.47Å; Q1132-F1135 WeakPolarHBondContact O-CB 3.38Å; Q1132-F1135 PolarHBondContact O-N 3.02Å; N1133-F1135 VanDerWaalsContact C-N 3.31Å; N1133-F1135 PolarHBondContact O-N 2.78Å; F1135-L1137 VanDerWaalsContact C-N 3.3Å; F1135-L1137 PolarHBondContact O-N 3.23Å; F1135-Q1138 PolarHBondContact O-N 3.39Å; F1135-A1139 WeakPolarHBondContact O-CB 3.39Å; F1135-A1139 PolarHBondContact O-N 2.71Å
1136	F	72.8	Confident	69.4	Low	8 Å²	8	78.9 Å²	78.9	4%	0.035	43%	0.426	C	S	.	.	H	α-helix	trans	-64	-34.5	176.2	-63.3	-50	0	0	0	112.7	L981 L1078 K1081 I1082 T1085 Q1132 N1133 A1139 L1140	L981-F1136 HydrophobicContact CD2-CE1 4.12Å; L981-F1136 HydrophobicContact CD2-CZ 4.13Å; L1078-F1136 HydrophobicContact CD1-CD1 4.32Å; L1078-F1136 HydrophobicContact CD1-CE1 3.72Å; K1081-F1136 HydrophobicContact CB-CE1 4.11Å; K1081-F1136 HydrophobicContact CB-CE2 4.29Å; K1081-F1136 HydrophobicContact CB-CZ 3.96Å; K1081-F1136 HydrophobicContact CD-CE1 4.5Å; K1081-F1136 HydrophobicContact CD-CE2 4.1Å; K1081-F1136 HydrophobicContact CD-CZ 3.69Å; K1081-F1136 HydrophobicContact CG-CZ 4.47Å; I1082-F1136 HydrophobicContact CG1-CD1 4.04Å; T1085-F1136 HydrophobicContact CG2-CB 3.94Å; Q1132-F1136 HydrophobicContact CB-CE2 4.05Å; Q1132-F1136 WeakPolarHBondContact O-CD2 3.31Å; Q1132-F1136 PolarHBondContact O-N 3.33Å; N1133-F1136 PolarHBondContact O-N 3.13Å; F1136-A1139 CarbonylContact O-C 3.55Å; F1136-A1139 PolarHBondContact O-N 3.18Å; F1136-L1140 PolarHBondContact O-N 3.28Å
1137	L	68.5	Low	70.2	Confident	11 Å²	11	82.5 Å²	82.5	6%	0.058	45%	0.445	C	S	.	.	H	α-helix	trans	-60.2	-41.2	171.3	-86.6	161.8	0	0	0	113.3	L1089 L1122 N1133 R1134 F1135 L1140	L1089-L1137 HydrophobicContact CD1-CD2 3.38Å; L1089-L1137 HydrophobicContact CD1-CG 4.21Å; L1089-L1137 HydrophobicContact CD2-CD2 3.88Å; L1089-L1137 HydrophobicContact CG-CD2 4.23Å; L1122-L1137 HydrophobicContact CB-CD2 4.17Å; L1122-L1137 HydrophobicContact CD1-CD2 4.31Å; L1122-L1137 HydrophobicContact CD2-CD2 3.58Å; L1122-L1137 HydrophobicContact CG-CD2 4.2Å; N1133-L1137 WeakPolarHBondContact O-CB 3.37Å; N1133-L1137 WeakPolarHBondContact O-CD1 3.48Å; N1133-L1137 WeakPolarHBondContact O-CG 3.39Å; N1133-L1137 PolarHBondContact O-N 2.68Å; R1134-L1137 WeakPolarHBondContact O-CB 3.35Å; R1134-L1137 PolarHBondContact O-N 3.06Å; F1135-L1137 VanDerWaalsContact C-N 3.3Å; F1135-L1137 PolarHBondContact O-N 3.23Å; L1137-L1140 HydrophobicContact CD2-CD1 4.3Å
1138	Q	70.1	Confident	70.9	Confident	149 Å²	149	75.5 Å²	75.5	70%	0.696	41%	0.412	S	S	*	.	H	α-helix	trans	-72.5	-32.6	174.5	-71.4	-178.8	-12.1	0	0	112.1	R1134 F1135 L1140 R1145	R1134-Q1138 PolarHBondContact O-N 2.68Å; R1134-Q1138 VanDerWaalsContact O-N 3.13Å; F1135-Q1138 PolarHBondContact O-N 3.39Å; Q1138-L1140 VanDerWaalsContact C-N 3.33Å; Q1138-R1145 PolarHBondContact O-NH1 3.08Å; Q1138-R1145 VanDerWaalsContact O-NH1 3.16Å
1139	A	71.7	Confident	71.7	Confident	48 Å²	48	72.9 Å²	72.9	40%	0.397	38%	0.38	S	S	.	.	H	α-helix	trans	-76.5	-13.8	178	0	0	0	0	0	114.3	I1082 F1135 F1136 G1141	I1082-A1139 HydrophobicContact CD1-CB 4.14Å; F1135-A1139 WeakPolarHBondContact O-CB 3.39Å; F1135-A1139 PolarHBondContact O-N 2.71Å; F1136-A1139 CarbonylContact O-C 3.55Å; F1136-A1139 PolarHBondContact O-N 3.18Å; A1139-G1141 PolarHBondContact O-N 3.06Å
1140	L	73.3	Confident	72.6	Confident	3 Å²	3	73.5 Å²	73.5	2%	0.016	38%	0.381	C	S	.	.	S	Bend	trans	-61	124.4	175.4	-97.2	140	0	0	0	110.9	I1082 T1085 F1086 L1089 F1136 L1137 Q1138 R1144 R1145	I1082-L1140 HydrophobicContact CG2-CG 4.23Å; T1085-L1140 HydrophobicContact CG2-CD1 4.46Å; F1086-L1140 HydrophobicContact CB-CD2 4Å; F1086-L1140 HydrophobicContact CD2-CD2 3.68Å; F1086-L1140 HydrophobicContact CG-CD2 4.18Å; L1089-L1140 HydrophobicContact CD1-CD1 3.69Å; F1136-L1140 PolarHBondContact O-N 3.28Å; L1137-L1140 HydrophobicContact CD2-CD1 4.3Å; Q1138-L1140 VanDerWaalsContact C-N 3.33Å; L1140-R1144 HydrophobicContact CD2-CB 3.41Å; L1140-R1144 VanDerWaalsContact CD2-CB 3.41Å; L1140-R1144 HydrophobicContact CD2-CG 4.27Å; L1140-R1145 HydrophobicContact CB-CG 3.94Å; L1140-R1145 PolarHBondContact O-NE 2.7Å; L1140-R1145 PolarHBondContact O-NH1 3.42Å
1141	G	75.8	Confident	73.2	Confident	42 Å²	42	72.1 Å²	72.1	43%	0.433	36%	0.364	S	S	.	.			trans	-60.4	155.8	177.4	0	0	0	0	0	112.7	A1139 S1143 R1144 R1145	A1139-G1141 PolarHBondContact O-N 3.06Å; G1141-S1143 PolarHBondContact O-N 3.41Å; G1141-R1144 PolarHBondContact O-N 3.1Å; G1141-R1145 PolarHBondContact O-N 3.2Å
1142	K	74.2	Confident	73.8	Confident	152 Å²	152	65.8 Å²	65.8	66%	0.661	33%	0.33	S	S	*	.	H	α-helix	trans	-51.7	-50.3	-176.9	-171.7	-179.2	176.9	-177.5	0	112.6	R1144 R1145 D1146	K1142-R1144 VanDerWaalsContact C-N 3.29Å; K1142-R1144 PolarHBondContact O-N 3.32Å; K1142-R1145 PolarHBondContact O-N 3.5Å; K1142-R1145 VanDerWaalsContact O-N 3.09Å; K1142-D1146 PolarHBondContact O-N 3.4Å
1143	S	73.7	Confident	74	Confident	97 Å²	97	66.1 Å²	66.1	68%	0.678	33%	0.331	S	S	*	.	H	α-helix	trans	-56.4	-38.1	178.3	166.7	0	0	0	0	113.8	G1141 L1147	G1141-S1143 PolarHBondContact O-N 3.41Å; S1143-L1147 PolarHBondContact O-N 3.04Å; S1143-L1147 VanDerWaalsContact O-N 3.08Å
1144	R	78.5	Confident	74.2	Confident	86 Å²	86	70.2 Å²	70.2	33%	0.325	34%	0.343	S	S	.	.	H	α-helix	trans	-74.2	-38.1	177.4	-68.9	-174	179.8	-171.2	-3.1	112	D1083 F1086 L1140 G1141 K1142 D1146 L1147 V1148	D1083-R1144 IonicContact OD1-CZ 2.67Å; D1083-R1144 IonicContact OD1-NH1 2.98Å; D1083-R1144 PolarHBondContact OD1-NH1 3.09Å; D1083-R1144 IonicContact OD1-NH2 2.79Å; D1083-R1144 PolarHBondContact OD1-NH2 3.31Å; F1086-R1144 HydrophobicContact CD2-CB 3.93Å; F1086-R1144 HydrophobicContact CD2-CG 4.39Å; F1086-R1144 HydrophobicContact CE2-CB 3.76Å; F1086-R1144 HydrophobicContact CE2-CG 4.21Å; F1086-R1144 WeakPolarHBondContact CE2-O 3.32Å; F1086-R1144 HydrophobicContact CZ-CB 4.37Å; F1086-R1144 HydrophobicContact CZ-CG 4.37Å; L1140-R1144 HydrophobicContact CD2-CB 3.41Å; L1140-R1144 VanDerWaalsContact CD2-CB 3.41Å; L1140-R1144 HydrophobicContact CD2-CG 4.27Å; G1141-R1144 PolarHBondContact O-N 3.1Å; K1142-R1144 VanDerWaalsContact C-N 3.29Å; K1142-R1144 PolarHBondContact O-N 3.32Å; R1144-D1146 VanDerWaalsContact C-N 3.35Å; R1144-L1147 PolarHBondContact O-N 3.07Å; R1144-V1148 PolarHBondContact O-N 2.95Å; R1144-V1148 VanDerWaalsContact O-N 3.16Å
1145	R	78	Confident	74.2	Confident	72 Å²	72	65.6 Å²	65.6	27%	0.272	33%	0.326	S	S	.	.	H	α-helix	trans	-60.6	-47.2	172.9	-70.4	-168.1	-72.8	-121.3	0.2	110.8	V1118 L1122 Q1138 L1140 G1141 K1142 L1147 V1148 V1149	V1118-R1145 HydrophobicContact CG1-CB 4.39Å; L1122-R1145 HydrophobicContact CD1-CG 4.27Å; Q1138-R1145 PolarHBondContact O-NH1 3.08Å; Q1138-R1145 VanDerWaalsContact O-NH1 3.16Å; L1140-R1145 HydrophobicContact CB-CG 3.94Å; L1140-R1145 PolarHBondContact O-NE 2.7Å; L1140-R1145 PolarHBondContact O-NH1 3.42Å; G1141-R1145 PolarHBondContact O-N 3.2Å; K1142-R1145 PolarHBondContact O-N 3.5Å; K1142-R1145 VanDerWaalsContact O-N 3.09Å; R1145-L1147 VanDerWaalsContact C-N 3.28Å; R1145-L1147 PolarHBondContact O-N 3.48Å; R1145-V1148 PolarHBondContact O-N 3.15Å; R1145-V1148 VanDerWaalsContact O-N 3.11Å; R1145-V1149 WeakPolarHBondContact O-CG2 3.38Å; R1145-V1149 PolarHBondContact O-N 2.99Å
1146	D	75.7	Confident	73.8	Confident	74 Å²	74	62.6 Å²	62.6	40%	0.396	32%	0.318	S	S	.	.	H	α-helix	trans	-59.4	-39.3	178.1	-61.9	-13.7	0	0	0	110.9	K1142 R1144 V1148 V1149 E1150	K1142-D1146 PolarHBondContact O-N 3.4Å; R1144-D1146 VanDerWaalsContact C-N 3.35Å; D1146-V1148 PolarHBondContact O-N 2.79Å; D1146-V1149 PolarHBondContact O-N 3.09Å; D1146-E1150 WeakPolarHBondContact O-CB 3.28Å; D1146-E1150 PolarHBondContact O-N 3.39Å
1147	L	81.4	Confident	73.2	Confident	83 Å²	83	68.8 Å²	68.8	44%	0.435	35%	0.35	S	S	.	.	H	α-helix	trans	-65.4	-36.3	175.8	-152.5	84.5	0	0	0	113.5	F1086 S1143 R1144 R1145 S1151	F1086-L1147 HydrophobicContact CE1-CD2 4.5Å; F1086-L1147 HydrophobicContact CE2-CB 4.44Å; F1086-L1147 HydrophobicContact CZ-CB 4.3Å; F1086-L1147 HydrophobicContact CZ-CD2 3.66Å; S1143-L1147 PolarHBondContact O-N 3.04Å; S1143-L1147 VanDerWaalsContact O-N 3.08Å; R1144-L1147 PolarHBondContact O-N 3.07Å; R1145-L1147 VanDerWaalsContact C-N 3.28Å; R1145-L1147 PolarHBondContact O-N 3.48Å; L1147-S1151 VanDerWaalsContact O-CB 3.31Å; L1147-S1151 WeakPolarHBondContact O-CB 3.1Å; L1147-S1151 PolarHBondContact O-N 3.21Å
1148	V	76.5	Confident	72.4	Confident	1 Å²	1	70.2 Å²	70.2	1%	0.006	36%	0.361	C	S	.	.	H	α-helix	trans	-67	-41.5	174.4	177.1	0	0	0	0	110.5	F1086 L1089 L1090 V1093 L1122 L1125 R1144 R1145 D1146 S1151 W1152	F1086-V1148 HydrophobicContact CD2-CG2 3.91Å; F1086-V1148 HydrophobicContact CE2-CG2 3.73Å; L1089-V1148 HydrophobicContact CB-CG1 4.46Å; L1089-V1148 HydrophobicContact CB-CG2 4.31Å; L1090-V1148 HydrophobicContact CD2-CG2 4.31Å; V1093-V1148 HydrophobicContact CG2-CG1 4.19Å; L1122-V1148 HydrophobicContact CD2-CG1 4.47Å; L1125-V1148 HydrophobicContact CD1-CG1 3.93Å; R1144-V1148 PolarHBondContact O-N 2.95Å; R1144-V1148 VanDerWaalsContact O-N 3.16Å; R1145-V1148 PolarHBondContact O-N 3.15Å; R1145-V1148 VanDerWaalsContact O-N 3.11Å; D1146-V1148 PolarHBondContact O-N 2.79Å; V1148-S1151 PolarHBondContact O-N 3.31Å; V1148-W1152 PolarHBondContact O-N 3.19Å
1149	V	75.4	Confident	71.2	Confident	24 Å²	24	70.6 Å²	70.6	15%	0.145	36%	0.356	C	S	.	.	H	α-helix	trans	-63.4	-48	176.6	176.7	0	0	0	0	110.3	V1118 L1121 R1145 D1146 S1151 W1152 E1153	V1118-V1149 HydrophobicContact CB-CG2 4.07Å; V1118-V1149 HydrophobicContact CG1-CG2 3.6Å; V1118-V1149 HydrophobicContact CG2-CG2 3.67Å; L1121-V1149 HydrophobicContact CD2-CG2 4.28Å; R1145-V1149 WeakPolarHBondContact O-CG2 3.38Å; R1145-V1149 PolarHBondContact O-N 2.99Å; D1146-V1149 PolarHBondContact O-N 3.09Å; V1149-S1151 VanDerWaalsContact C-N 3.3Å; V1149-S1151 PolarHBondContact O-N 3.35Å; V1149-W1152 WeakPolarHBondContact O-CB 3.14Å; V1149-W1152 PolarHBondContact O-N 3.47Å; V1149-W1152 VanDerWaalsContact O-N 3.09Å; V1149-E1153 HydrophobicContact CG1-CG 4.38Å; V1149-E1153 WeakPolarHBondContact O-CG 3.35Å; V1149-E1153 PolarHBondContact O-N 3.43Å
1150	E	78.4	Confident	69.7	Low	77 Å²	77	71 Å²	71	36%	0.36	35%	0.351	S	S	.	.	H	α-helix	trans	-60.5	-40.4	177.2	-169.2	-175.2	172.6	0	0	111.3	D1146 W1152 E1153 R1154	D1146-E1150 WeakPolarHBondContact O-CB 3.28Å; D1146-E1150 PolarHBondContact O-N 3.39Å; E1150-W1152 VanDerWaalsContact C-N 3.34Å; E1150-W1152 PolarHBondContact O-N 2.64Å; E1150-E1153 PolarHBondContact O-N 2.92Å; E1150-R1154 HydrophobicContact CG-CG 4.5Å; E1150-R1154 VanDerWaalsContact O-CB 3.32Å; E1150-R1154 WeakPolarHBondContact O-CB 3.07Å; E1150-R1154 VanDerWaalsContact O-CG 3.26Å; E1150-R1154 WeakPolarHBondContact O-CG 3.43Å; E1150-R1154 PolarHBondContact O-N 3.35Å; E1150-R1154 IonicContact OE1-CZ 2.69Å; E1150-R1154 VanDerWaalsContact OE1-CZ 3.31Å; E1150-R1154 IonicContact OE1-NE 3.85Å; E1150-R1154 PolarHBondContact OE1-NE 3.47Å; E1150-R1154 IonicContact OE1-NH2 2.73Å; E1150-R1154 PolarHBondContact OE1-NH2 3.34Å
1151	S	76.9	Confident	68.1	Low	19 Å²	19	75.5 Å²	75.5	13%	0.133	38%	0.378	C	S	.	.	H	α-helix	trans	-62.7	-39.8	174.6	-170.8	0	0	0	0	112.3	L1147 V1148 V1149 R1155	L1147-S1151 VanDerWaalsContact O-CB 3.31Å; L1147-S1151 WeakPolarHBondContact O-CB 3.1Å; L1147-S1151 PolarHBondContact O-N 3.21Å; V1148-S1151 PolarHBondContact O-N 3.31Å; V1149-S1151 VanDerWaalsContact C-N 3.3Å; V1149-S1151 PolarHBondContact O-N 3.35Å; S1151-R1155 WeakPolarHBondContact O-CB 3.42Å; S1151-R1155 WeakPolarHBondContact O-CD 3.29Å; S1151-R1155 WeakPolarHBondContact O-CG 3.39Å; S1151-R1155 PolarHBondContact O-N 3.06Å; S1151-R1155 VanDerWaalsContact OG-CZ 3.31Å; S1151-R1155 PolarHBondContact OG-NH1 3.18Å
1152	W	76.3	Confident	66.1	Low	25 Å²	25	77.9 Å²	77.9	10%	0.095	39%	0.394	C	S	.	.	H	α-helix	trans	-66.4	-50.3	174.3	178.9	-95.9	0	0	0	112	V1093 M1096 L1121 V1148 V1149 E1150 R1154 R1155 T1156	V1093-W1152 HydrophobicContact CB-CE3 4.42Å; V1093-W1152 HydrophobicContact CG1-CB 4.16Å; V1093-W1152 HydrophobicContact CG1-CE3 3.85Å; V1093-W1152 HydrophobicContact CG2-CE3 4.17Å; M1096-W1152 HydrophobicContact CB-CZ3 4.35Å; M1096-W1152 HydrophobicContact CE-CE3 4.35Å; M1096-W1152 HydrophobicContact CE-CH2 3.61Å; M1096-W1152 HydrophobicContact CE-CZ3 3.3Å; L1121-W1152 HydrophobicContact CD1-CB 4.36Å; L1121-W1152 HydrophobicContact CD1-CD2 3.38Å; L1121-W1152 VanDerWaalsContact CD1-CE2 3.46Å; L1121-W1152 HydrophobicContact CD1-CE3 3.86Å; L1121-W1152 HydrophobicContact CD1-CG 3.6Å; L1121-W1152 HydrophobicContact CD1-CH2 4.45Å; L1121-W1152 HydrophobicContact CD1-CZ2 4Å; L1121-W1152 HydrophobicContact CD1-CZ3 4.39Å; L1121-W1152 HydrophobicContact CD2-CB 3.61Å; L1121-W1152 HydrophobicContact CD2-CD2 4.31Å; L1121-W1152 HydrophobicContact CD2-CG 3.64Å; L1121-W1152 HydrophobicContact CG-CD2 4.47Å; L1121-W1152 HydrophobicContact CG-CG 4.27Å; V1148-W1152 PolarHBondContact O-N 3.19Å; V1149-W1152 WeakPolarHBondContact O-CB 3.14Å; V1149-W1152 PolarHBondContact O-N 3.47Å; V1149-W1152 VanDerWaalsContact O-N 3.09Å; E1150-W1152 VanDerWaalsContact C-N 3.34Å; E1150-W1152 PolarHBondContact O-N 2.64Å; W1152-R1154 PolarHBondContact O-N 2.77Å; W1152-R1155 PolarHBondContact O-N 3.43Å; W1152-R1155 VanDerWaalsContact O-N 3.12Å; W1152-T1156 HydrophobicContact CD2-CG2 4.25Å; W1152-T1156 HydrophobicContact CG-CG2 4.39Å; W1152-T1156 HydrophobicContact CZ2-CG2 4.18Å; W1152-T1156 WeakPolarHBondContact O-CG2 3.47Å; W1152-T1156 PolarHBondContact O-N 3.33Å; W1152-T1156 PolarHBondContact O-OG1 3.33Å
1153	E	70.8	Confident	64.1	Low	109 Å²	109	76 Å²	76	51%	0.509	40%	0.395	S	S	.	.	H	α-helix	trans	-56.5	-51.1	177.9	-74.6	-176.9	168	0	0	111	V1149 E1150 R1155 T1156 I1157	V1149-E1153 HydrophobicContact CG1-CG 4.38Å; V1149-E1153 WeakPolarHBondContact O-CG 3.35Å; V1149-E1153 PolarHBondContact O-N 3.43Å; E1150-E1153 PolarHBondContact O-N 2.92Å; E1153-R1155 VanDerWaalsContact C-N 3.26Å; E1153-R1155 PolarHBondContact O-N 3.32Å; E1153-T1156 WeakPolarHBondContact CA-OG1 3.39Å; E1153-T1156 PolarHBondContact O-N 3.5Å; E1153-T1156 VanDerWaalsContact O-N 3.15Å; E1153-T1156 PolarHBondContact O-OG1 3.28Å; E1153-I1157 WeakPolarHBondContact O-CD1 3.24Å; E1153-I1157 VanDerWaalsContact O-CG1 3.28Å; E1153-I1157 WeakPolarHBondContact O-CG1 3.45Å; E1153-I1157 PolarHBondContact O-N 2.99Å
1154	R	68.9	Low	62	Low	125 Å²	125	80.7 Å²	80.7	47%	0.472	41%	0.406	S	S	.	.	H	α-helix	trans	-54.7	-40.2	176.5	-75.2	-179.1	-171.6	-150.1	3.6	112.3	E730 E1150 W1152 C1158	E730-R1154 IonicContact OE1-CZ 3.17Å; E730-R1154 IonicContact OE1-NH1 2.84Å; E730-R1154 PolarHBondContact OE1-NH1 2.94Å; E730-R1154 IonicContact OE1-NH2 3.74Å; E730-R1154 PolarHBondContact OE1-NH2 3.14Å; E1150-R1154 HydrophobicContact CG-CG 4.5Å; E1150-R1154 VanDerWaalsContact O-CB 3.32Å; E1150-R1154 WeakPolarHBondContact O-CB 3.07Å; E1150-R1154 VanDerWaalsContact O-CG 3.26Å; E1150-R1154 WeakPolarHBondContact O-CG 3.43Å; E1150-R1154 PolarHBondContact O-N 3.35Å; E1150-R1154 IonicContact OE1-CZ 2.69Å; E1150-R1154 VanDerWaalsContact OE1-CZ 3.31Å; E1150-R1154 IonicContact OE1-NE 3.85Å; E1150-R1154 PolarHBondContact OE1-NE 3.47Å; E1150-R1154 IonicContact OE1-NH2 2.73Å; E1150-R1154 PolarHBondContact OE1-NH2 3.34Å; W1152-R1154 PolarHBondContact O-N 2.77Å; R1154-C1158 PolarHBondContact O-N 3.12Å; R1154-C1158 PolarHBondContact O-SG 2.9Å
1155	R	69.8	Low	59.8	Low	49 Å²	49	80.6 Å²	80.6	19%	0.185	42%	0.423	C	S	.	.	H	α-helix	trans	-75.6	-35.7	179.2	-76.4	168.4	-176.8	154	8.8	113	L1090 V1093 D1094 Y1097 S1151 W1152 E1153 I1157 C1158	L1090-R1155 PolarHBondContact O-NH1 3.09Å; V1093-R1155 VanDerWaalsContact C-NH1 3.31Å; D1094-R1155 IonicContact OD1-CZ 3.42Å; D1094-R1155 IonicContact OD1-NE 3.17Å; D1094-R1155 PolarHBondContact OD1-NE 3.4Å; D1094-R1155 VanDerWaalsContact OD1-NE 3.1Å; D1094-R1155 IonicContact OD1-NH1 3.08Å; D1094-R1155 IonicContact OD1-NH2 2.84Å; D1094-R1155 PolarHBondContact OD1-NH2 3.08Å; D1094-R1155 IonicContact OD2-CZ 2.75Å; D1094-R1155 IonicContact OD2-NH1 3.39Å; D1094-R1155 IonicContact OD2-NH2 3.09Å; D1094-R1155 PolarHBondContact OD2-NH2 3.15Å; Y1097-R1155 HydrophobicContact CD2-CB 3.77Å; Y1097-R1155 HydrophobicContact CD2-CG 4.19Å; Y1097-R1155 WeakPolarHBondContact CD2-O 3.48Å; Y1097-R1155 HydrophobicContact CE2-CB 4.32Å; Y1097-R1155 WeakPolarHBondContact CE2-O 3.44Å; Y1097-R1155 HydrophobicContact CG-CB 4.14Å; Y1097-R1155 HydrophobicContact CG-CG 4.16Å; S1151-R1155 WeakPolarHBondContact O-CB 3.42Å; S1151-R1155 WeakPolarHBondContact O-CD 3.29Å; S1151-R1155 WeakPolarHBondContact O-CG 3.39Å; S1151-R1155 PolarHBondContact O-N 3.06Å; S1151-R1155 VanDerWaalsContact OG-CZ 3.31Å; S1151-R1155 PolarHBondContact OG-NH1 3.18Å; W1152-R1155 PolarHBondContact O-N 3.43Å; W1152-R1155 VanDerWaalsContact O-N 3.12Å; E1153-R1155 VanDerWaalsContact C-N 3.26Å; E1153-R1155 PolarHBondContact O-N 3.32Å; R1155-I1157 VanDerWaalsContact C-N 3.34Å; R1155-C1158 PolarHBondContact O-N 3.06Å
1156	T	63.7	Low	57.3	Low	61 Å²	61	83.8 Å²	83.8	37%	0.374	45%	0.451	S	S	.	.	H	α-helix	trans	-67.9	-31.9	175.5	53.5	0	0	0	0	113.2	W1152 E1153 C1158	W1152-T1156 HydrophobicContact CD2-CG2 4.25Å; W1152-T1156 HydrophobicContact CG-CG2 4.39Å; W1152-T1156 HydrophobicContact CZ2-CG2 4.18Å; W1152-T1156 WeakPolarHBondContact O-CG2 3.47Å; W1152-T1156 PolarHBondContact O-N 3.33Å; W1152-T1156 PolarHBondContact O-OG1 3.33Å; E1153-T1156 WeakPolarHBondContact CA-OG1 3.39Å; E1153-T1156 PolarHBondContact O-N 3.5Å; E1153-T1156 VanDerWaalsContact O-N 3.15Å; E1153-T1156 PolarHBondContact O-OG1 3.28Å; T1156-C1158 VanDerWaalsContact C-N 3.34Å
1157	I	60.1	Low	55.4	Low	138 Å²	138	86.4 Å²	86.4	71%	0.708	47%	0.47	S	S	*	.	H	α-helix	trans	-72.7	-28.8	176.6	-63.7	163.3	0	0	0	111.1	E1153 R1155 R1159	E1153-I1157 WeakPolarHBondContact O-CD1 3.24Å; E1153-I1157 VanDerWaalsContact O-CG1 3.28Å; E1153-I1157 WeakPolarHBondContact O-CG1 3.45Å; E1153-I1157 PolarHBondContact O-N 2.99Å; R1155-I1157 VanDerWaalsContact C-N 3.34Å; I1157-R1159 VanDerWaalsContact C-N 3.34Å; I1157-R1159 PolarHBondContact O-N 3.45Å
1158	C	51.2	Low	52.9	Low	41 Å²	41	91.3 Å²	91.3	28%	0.277	49%	0.49	S	S	.	.			trans	-80.3	66.6	179.5	-67.7	0	0	0	0	113.1	Y1097 R1154 R1155 T1156	Y1097-C1158 HydrophobicContact CE2-CB 4.21Å; R1154-C1158 PolarHBondContact O-N 3.12Å; R1154-C1158 PolarHBondContact O-SG 2.9Å; R1155-C1158 PolarHBondContact O-N 3.06Å; T1156-C1158 VanDerWaalsContact C-N 3.34Å
1159	R	45.6	Very low	50.7	Low	157 Å²	157	99.9 Å²	99.9	59%	0.592	54%	0.535	S	S	*	.			trans	-89.4	104.5	169.5	-156.8	176.4	-173.6	165.6	4.2	109.5	I1157 V1161	I1157-R1159 VanDerWaalsContact C-N 3.34Å; I1157-R1159 PolarHBondContact O-N 3.45Å; R1159-V1161 PolarHBondContact O-N 2.92Å
1160	N	39.3	Very low	48.6	Very low	57 Å²	57	101.9 Å²	101.9	31%	0.305	56%	0.561	S	S	.	*			trans	-72.9	113.9	169.6	-64.7	-44.6	0	0	0	108.5	A1162 Y1190	N1160-A1162 PolarHBondContact O-N 3.42Å; N1160-Y1190 WeakPolarHBondContact ND2-CD1 3.46Å; N1160-Y1190 WeakPolarHBondContact ND2-CE1 3.45Å
1161	V	39.4	Very low	46.2	Very low	97 Å²	97	103.7 Å²	103.7	59%	0.588	58%	0.582	S	S	*	*			trans	-72.9	105.6	167.8	-171.2	0	0	0	0	107.1	R1159 V1163	R1159-V1161 PolarHBondContact O-N 2.92Å; V1161-V1163 HydrophobicContact CB-CG2 4.36Å; V1161-V1163 HydrophobicContact CG1-CG2 3.38Å; V1161-V1163 PolarHBondContact O-N 3.31Å; V1161-V1163 VanDerWaalsContact O-N 3.14Å
1162	A	34.7	Very low	44	Very low	92 Å²	92	108.5 Å²	108.5	76%	0.76	62%	0.615	S	S	*	*			trans	-77.6	89.3	167	0	0	0	0	0	108.2	N1160	N1160-A1162 PolarHBondContact O-N 3.42Å
1163	V	33	Very low	41.8	Very low	112 Å²	112	112.6 Å²	112.6	68%	0.679	65%	0.648	S	S	*	*			trans	-87	109.5	169.5	-176.4	0	0	0	0	108.3	V1161 A1165	V1161-V1163 HydrophobicContact CB-CG2 4.36Å; V1161-V1163 HydrophobicContact CG1-CG2 3.38Å; V1161-V1163 PolarHBondContact O-N 3.31Å; V1161-V1163 VanDerWaalsContact O-N 3.14Å; V1163-A1165 PolarHBondContact O-N 3.07Å
1164	Q	28.1	Very low	39.7	Very low	196 Å²	196	112.7 Å²	112.7	92%	0.916	66%	0.659	S	S	*	*			trans	-68.7	109.8	160.4	-90.5	177.3	-34.6	0	0	108
1165	A	31.7	Very low	37.8	Very low	83 Å²	83	115.6 Å²	115.6	69%	0.686	68%	0.678	S	S	*	*			trans	-116	99.7	167.8	0	0	0	0	0	109.2	V1163	V1163-A1165 PolarHBondContact O-N 3.07Å
1166	T	27.3	Very low	35.8	Very low	140 Å²	140	119.2 Å²	119.2	86%	0.859	71%	0.706	S	S	*	*			trans	-72.4	118.1	164.5	41.7	0	0	0	0	109.4
1167	V	34.5	Very low	34	Very low	129 Å²	129	121.9 Å²	121.9	78%	0.782	72%	0.722	S	S	*	*			trans	-134.8	100.2	163.7	-177.5	0	0	0	0	109.3
1168	E	29.3	Very low	32.6	Very low	186 Å²	186	122.7 Å²	122.7	87%	0.869	73%	0.728	S	S	*	*			trans	25.8	99.5	145	-59.4	-177.9	170.1	0	0	119.1
1169	L	30.5	Very low	31.5	Very low	180 Å²	180	128.6 Å²	128.6	94%	0.942	76%	0.756	S	S	*	*			trans	-107.7	120.1	146.6	-104.7	143.6	0	0	0	107.7
1170	G	30.4	Very low	30.8	Very low	67 Å²	67	130.1 Å²	130.1	69%	0.691	77%	0.769	S	S	*	*			trans	-56.9	137.4	-173.3	0	0	0	0	0	114.2
1171	S	28.6	Very low	30.3	Very low	114 Å²	114	138.4 Å²	138.4	80%	0.797	80%	0.796	S	S	*	*			trans	47.6	94.7	142.1	62.6	0	0	0	0	117.8
1172	S	30.1	Very low	29.9	Very low	120 Å²	120	139.6 Å²	139.6	84%	0.839	81%	0.806	S	S	*	*				179.9	130	108.7	36.3	0	0	0	0	111.4
1173	S	30.3	Very low	30	Very low	111 Å²	111	141.8 Å²	141.8	78%	0.776	81%	0.805	S	S	*	*			trans	69.6	82.4	152	-170.9	0	0	0	0	118.7
1174	C	26.7	Very low	30	Very low	111 Å²	111	146 Å²	146	75%	0.75	81%	0.814	S	S	*	*				12	123.2	122.6	-49.8	0	0	0	0	117.6
1175	Q	30.2	Very low	30.1	Very low	186 Å²	186	145.7 Å²	145.7	87%	0.869	81%	0.81	S	S	*	*				171.6	117.1	105.4	-91	176.2	-16.5	0	0	110.8
1176	T	27	Very low	30	Very low	125 Å²	125	147 Å²	147	77%	0.767	81%	0.809	S	S	*	*			trans	0.2	133.3	150.2	35.7	0	0	0	0	120.4
1177	V	26.7	Very low	30.1	Very low	118 Å²	118	146.8 Å²	146.8	72%	0.715	80%	0.803	S	S	*	*			trans	84.4	107.2	138.9	-179.7	0	0	0	0	117.9
1178	N	30	Very low	29.9	Very low	154 Å²	154	149.2 Å²	149.2	82%	0.824	80%	0.799	S	S	*	*				180	126	110.8	-105.8	-45.6	0	0	0	111.9	H1180	N1178-H1180 PolarHBondContact O-N 3.23Å
1179	L	27.6	Very low	29.9	Very low	166 Å²	166	148.4 Å²	148.4	87%	0.869	80%	0.8	S	S	*	*			trans	-67.7	106.5	167.9	-78.7	116.7	0	0	0	109.3
1180	H	31	Very low	29.8	Very low	189 Å²	189	145.8 Å²	145.8	88%	0.875	78%	0.778	S	S	*	*			trans	163.3	81	148.7	-88.9	-37.1	0	0	0	109.9	N1178	N1178-H1180 PolarHBondContact O-N 3.23Å
1181	R	29.5	Very low	29.8	Very low	231 Å²	231	149.1 Å²	149.1	87%	0.872	78%	0.78	S	S	*	*			trans	-146.3	136.5	154.9	-101	-175.1	-173.5	169.8	1.9	109.8	D1183	R1181-D1183 VanDerWaalsContact C-N 3.25Å; R1181-D1183 PolarHBondContact O-N 3.23Å
1182	P	31.3	Very low	29.9	Very low	122 Å²	122	149 Å²	149	79%	0.792	77%	0.77	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.4	12.4	-167.2	29.9	-25.3	0	0	0	115
1183	D	36	Very low	29.9	Very low	137 Å²	137	149.9 Å²	149.9	73%	0.733	77%	0.765	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.3	15.4	-164.3	-61.2	-38.2	0	0	0	116.2	R1181	R1181-D1183 VanDerWaalsContact C-N 3.25Å; R1181-D1183 PolarHBondContact O-N 3.23Å
1184	F	32.7	Very low	29.8	Very low	201 Å²	201	156.4 Å²	156.4	88%	0.882	79%	0.791	S	S	*	*			trans	-111.9	101.8	171.8	-97	-91.5	0	0	0	111.7	V1186	F1184-V1186 PolarHBondContact O-N 3.36Å
1185	K	30.6	Very low	30	Very low	190 Å²	190	158.7 Å²	158.7	83%	0.826	79%	0.793	S	S	*	*			trans	-72.9	110.5	165.9	-90.8	-179.9	175.8	173.1	0	109.3	N1187	K1185-N1187 PolarHBondContact O-N 2.98Å; K1185-N1187 VanDerWaalsContact O-N 3.11Å
1186	V	30.3	Very low	30	Very low	109 Å²	109	157.2 Å²	157.2	66%	0.661	79%	0.789	S	S	*	*			trans	-64.5	105.7	163	-177.6	0	0	0	0	107.3	F1184 Y1188	F1184-V1186 PolarHBondContact O-N 3.36Å; V1186-Y1188 HydrophobicContact CG1-CE2 4.3Å; V1186-Y1188 PolarHBondContact O-N 2.98Å
1187	N	29.7	Very low	30.1	Very low	136 Å²	136	159 Å²	159	73%	0.727	79%	0.79	S	S	*	*			trans	-75.1	104.2	173.1	-81	-20.6	0	0	0	108.7	K1185 L1189	K1185-N1187 PolarHBondContact O-N 2.98Å; K1185-N1187 VanDerWaalsContact O-N 3.11Å; N1187-L1189 PolarHBondContact O-N 3.47Å
1188	Y	30.5	Very low	30.3	Very low	181 Å²	181	161.4 Å²	161.4	71%	0.71	80%	0.795	S	S	*	*			trans	-69.6	106.3	163.2	-66.4	-87.8	0	0	0	108.2	V1186 Y1190	V1186-Y1188 HydrophobicContact CG1-CE2 4.3Å; V1186-Y1188 PolarHBondContact O-N 2.98Å; Y1188-Y1190 PolarHBondContact O-N 2.94Å
1189	L	27.5	Very low	30.4	Very low	168 Å²	168	161.9 Å²	161.9	88%	0.88	79%	0.793	S	S	*	*			trans	-73.5	104.6	162.2	-102.5	118.1	0	0	0	107.6	N1187 N1191	N1187-L1189 PolarHBondContact O-N 3.47Å; L1189-N1191 PolarHBondContact O-N 2.76Å
1190	Y	29.7	Very low	30.5	Very low	126 Å²	126	161.6 Å²	161.6	49%	0.494	79%	0.788	S	S	.	*			trans	-76.1	114.4	163.1	-74.8	-96.5	0	0	0	107.1	N1160 Y1188 I1192	N1160-Y1190 WeakPolarHBondContact ND2-CD1 3.46Å; N1160-Y1190 WeakPolarHBondContact ND2-CE1 3.45Å; Y1188-Y1190 PolarHBondContact O-N 2.94Å; Y1190-I1192 PolarHBondContact O-N 2.96Å
1191	N	30.2	Very low	30.5	Very low	137 Å²	137	159.6 Å²	159.6	73%	0.733	78%	0.782	S	S	*	*			trans	-68.5	98.6	169.7	-154.5	13.8	0	0	0	107.6	L1189	L1189-N1191 PolarHBondContact O-N 2.76Å
1192	I	31.1	Very low	30.6	Very low	112 Å²	112	154.2 Å²	154.2	57%	0.574	78%	0.775	S	S	*	*			trans	-99.2	93.5	168.6	-58.2	170.9	0	0	0	103.2	Y1190	Y1190-I1192 PolarHBondContact O-N 2.96Å
1193	D	28.9	Very low	30.5	Very low	138 Å²	138	156.8 Å²	156.8	74%	0.738	77%	0.773	S	S	*	*			trans	174.2	93.7	155.1	-82.9	-18.7	0	0	0	110.3
1194	N	29.2	Very low	30	Very low	247 Å²	247	158.6 Å²	158.6	100%	1.321	78%	0.777	S	S	*	*			trans	-168.7	0	140.2	-108.7	-5.5	0	0	0	109.7

Retrieved 1,194 of 1,194 residues in 350 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).