X2JIL6_DROME Loading...

Transcription elongation factor SPT6

Histone H3-H4 chaperone that plays a role in maintenance of chromatin structure during RNA polymerase II transcription elongation.

AlphaFold DB (Q9W420), UniProt , Accession X2JIL6, Species DROME (Drosophila melanogaster, Fruit fly), Gene Spt6, Length 1,831 aa.

						>X2JIL6_DROME|X2JIL6|Spt6
MAEFLDSEAEESEEEEELDVNERKRLKKLKAAVSDSSEEEEDDEERLREELKDLIDDNPIEEDDGSGYDSDGVGSGKKRKKHEDDDLDDRLEDDDYDLIEENLGVKVERRKRFKRLRRIHDNESDGEEQHVDEGLVREQIAEQLFDENDESIGHRSERSHREADDYDDVDTESDADDFIVDDNGRPIAEKKKKRRPIFTDASLQEGQDIFGVDFDYDDFSKYEEDDYEDDSEGDEYDEDLGVGDDTRVKKKKALKKKVVKKTIFDIYEPSELKRGHFTDMDNEIRKTDIPERMQLREVPVTPVPEGSDELDLEAEWIYKYAFCKHTVSEQEKPESREKMRKPPTTVNKIKQTLEFIRNQQLEVPFIAFYRKEYVKPELNIDDLWKVYYYDGIWCQLNERKRKLKVLFEKMRQFQLDTLCADTDQPVPDDVRLILDSDFERLADVQSMEELKDVHMYFLLNYSHELPRMQAEQRRKAIQERREAKARRQAAAAENGDDAAEAIVVPEPEDDDDPELIDYQLKQASNSSPYAVFRKAGICGFAKHFGLTPEQYAENLRDNYQRNEITQESIGPTELAKQYLSPRFMTTDEVIHAAKYVVARQLAQEPLLRKTMREVYFDRARINIRPTKNGMVLIDENSPVYSMKYVAKKPVSDLFGDQFIKLMMAEEEKLLEITFLEEFEGNACANGTPGDYVEESKALYQLDQFAKHVQEWNKLRAECVQLALQKWVIPDLIKELRSTLHEEAQQFVLRSCTGKLYKWLKVAPYKPQLPPDFGYEEWSTLRGIRVLGLAYDPDHSVAAFCAVTTVEGDISDYLRLPNILKRKNSYNLEEKAQKLADLRKLSDFIKMKKPHIVVIGAESRDAQNIQADIKEILHELETSEQFPPIEVEIIDNELAKIYANSKKGESDFKEYPPLLKQAASLARKMQDPLVEYSQLCDADDEILCLRYHPLQERVPREQLLEQLSLQFINRTSEVGLDINLMVQNSRTINLLQYICGLGPRKGQALLKLLKQSNQRLENRTQLVTVCHLGPRVFINCSGFIKIDTSSLGDSTEAYVEVLDGSRVHPETYEWARKMAIDAMEYDDEETNPAGALEEILESPERLKDLDLDAFAVELERQGFGSKSITLYDIRNELSCLYKDYRTPYTKPSAEELFDMLTKETPDSFYVGKCVTAMVTGFTYRRPQGDQLDSANPVRLDSNESWQCPFCHKDDFPELSEVWNHFDANACPGQPSGVRVRLENGLPGFIHIKNLSDRQVRNPEERVRVSQMIHVRIIKIDIDRFSVECSSRTADLKDVNNEWRPRRDNYYDYVTEEQDNRKVSDAKARALKRKIYARRVIAHPSFFNKSYAEVVAMLAEADQGEVALRPSSKSKDHLTATWKVADDIFQHIDVREEGKENDFSLGRSLWIGTEEFEDLDEIIARHIMPMALAARELIQYKYYKPNMVTGDENERDVMEKLLREEKANDPKKIHYFFTASRAMPGKFLLSYLPKTKVRHEYVTVMPEGYRFRGQIFDTVNSLLRWFKEHWLDPTATPASASASNLTPLHLMRPPPTISSSSQTSLGPQAPYSVTGSVTGGTPRSGISSAVGGGGSSAYSITQSITGYGTSGSSAPGAGVSSSHYGSSSTPSFGAINTPYTPSGQTPFMTPYTPHASQTPRYGHNVPSPSSQSSSSQRHHYGSSSGTGSTPRYHDMGGGGGGGVGGGGGSNAYSMQPHHQQRAKENLDWQLANDAWARRRPQQHQSHQSYHAQQQHHHSQQQPHMGMSMNMGITMSLGRGTGGGGGGGYGSTPVNDYSTGGGHNRGMSSKASVRSTPRTNASPHSMNLGDATPLYDEN
					

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(Predicted Aligned Error values between residue pairs)

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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	35.6	Very low	40.8	Very low	155 Å²	155	101.4 Å²	101.4	76%	0.764	53%	0.527	S	S	*	.				0	-44.8	0	-98.1	-164.1	-171.2	0	0	112.1	F4 L5	M1-F4 PolarHBondContact O-N 3.27Å; M1-L5 WeakPolarHBondContact O-CG 3.44Å; M1-L5 PolarHBondContact O-N 2.7Å
2	A	33.4	Very low	40.9	Very low	65 Å²	65	98 Å²	98	54%	0.537	52%	0.519	S	S	.	.	H	α-helix	trans	-51.7	-67.1	169	0	0	0	0	0	110.3	F4 L5 D6	A2-F4 CarbonylContact O-C 3.56Å; A2-F4 PolarHBondContact O-N 3.3Å; A2-L5 CarbonylContact O-C 3.37Å; A2-L5 WeakPolarHBondContact O-CA 3.36Å; A2-L5 WeakPolarHBondContact O-CB 3.45Å; A2-L5 PolarHBondContact O-N 2.8Å; A2-D6 VanDerWaalsContact C-CG 3.49Å; A2-D6 PolarHBondContact O-N 3.1Å
3	E	38.7	Very low	41	Very low	137 Å²	137	100.2 Å²	100.2	64%	0.64	52%	0.524	S	S	*	.	H	α-helix	trans	-46.8	-28.2	179.5	-58.7	168.4	136.4	0	0	115.9	D6 S7	E3-D6 PolarHBondContact N-OD2 2.97Å; E3-S7 VanDerWaalsContact O-CB 3.31Å; E3-S7 WeakPolarHBondContact O-CB 3.48Å; E3-S7 PolarHBondContact O-N 3.19Å; E3-S7 PolarHBondContact O-OG 2.8Å
4	F	37.4	Very low	40.9	Very low	117 Å²	117	104.3 Å²	104.3	51%	0.513	54%	0.539	S	S	.	.	H	α-helix	trans	-87.8	-33.7	177.1	-175.2	-87.2	0	0	0	113.2	M1 A2 D6 S7 E8	M1-F4 PolarHBondContact O-N 3.27Å; A2-F4 CarbonylContact O-C 3.56Å; A2-F4 PolarHBondContact O-N 3.3Å; F4-D6 VanDerWaalsContact C-N 3.32Å; F4-S7 PolarHBondContact O-OG 3.46Å; F4-E8 HydrophobicContact CE1-CB 4.4Å; F4-E8 WeakPolarHBondContact O-CB 3.41Å; F4-E8 PolarHBondContact O-N 2.98Å
5	L	43.6	Very low	41	Very low	110 Å²	110	104.3 Å²	104.3	58%	0.576	54%	0.536	S	S	*	.	H	α-helix	trans	-71.1	-34	169.3	-74.8	167.5	0	0	0	110.9	M1 A2 A9	M1-L5 WeakPolarHBondContact O-CG 3.44Å; M1-L5 PolarHBondContact O-N 2.7Å; A2-L5 CarbonylContact O-C 3.37Å; A2-L5 WeakPolarHBondContact O-CA 3.36Å; A2-L5 WeakPolarHBondContact O-CB 3.45Å; A2-L5 PolarHBondContact O-N 2.8Å; L5-A9 WeakPolarHBondContact O-CB 3.49Å; L5-A9 PolarHBondContact O-N 3.49Å
6	D	45.1	Very low	41.4	Very low	88 Å²	88	105.1 Å²	105.1	47%	0.471	54%	0.537	S	S	.	.	H	α-helix	trans	-70	-47	175.6	-53.5	-32.3	0	0	0	109.1	A2 E3 F4 A9 E10	A2-D6 VanDerWaalsContact C-CG 3.49Å; A2-D6 PolarHBondContact O-N 3.1Å; E3-D6 PolarHBondContact N-OD2 2.97Å; F4-D6 VanDerWaalsContact C-N 3.32Å; D6-A9 CarbonylContact O-C 3.51Å; D6-A9 WeakPolarHBondContact O-CA 3.17Å; D6-A9 WeakPolarHBondContact O-CB 3.1Å; D6-A9 PolarHBondContact O-N 2.68Å; D6-A9 VanDerWaalsContact O-N 3.13Å; D6-E10 WeakPolarHBondContact O-CG 3.49Å; D6-E10 PolarHBondContact O-N 3.1Å
7	S	43.9	Very low	41.7	Very low	48 Å²	48	104.8 Å²	104.8	34%	0.336	53%	0.532	S	S	.	.	H	α-helix	trans	-68.3	-38.3	175.4	72.5	0	0	0	0	114.6	E3 F4 A9 E10 E11	E3-S7 VanDerWaalsContact O-CB 3.31Å; E3-S7 WeakPolarHBondContact O-CB 3.48Å; E3-S7 PolarHBondContact O-N 3.19Å; E3-S7 PolarHBondContact O-OG 2.8Å; F4-S7 PolarHBondContact O-OG 3.46Å; S7-A9 PolarHBondContact O-N 3.46Å; S7-E10 PolarHBondContact O-N 2.85Å; S7-E11 PolarHBondContact O-N 2.76Å
8	E	42.2	Very low	41.8	Very low	80 Å²	80	102.1 Å²	102.1	37%	0.374	52%	0.519	S	S	.	.	H	α-helix	trans	-76.5	-6.9	174.3	-158.9	172.7	-126.2	0	0	111.4	F4 K733	F4-E8 HydrophobicContact CE1-CB 4.4Å; F4-E8 WeakPolarHBondContact O-CB 3.41Å; F4-E8 PolarHBondContact O-N 2.98Å; E8-K733 IonicContact OE1-NZ 2.75Å; E8-K733 PolarHBondContact OE1-NZ 3.34Å
9	A	45.6	Very low	42.6	Very low	32 Å²	32	101.2 Å²	101.2	26%	0.264	52%	0.516	S	S	.	.	H	α-helix	trans	-89.9	-45.6	165.8	0	0	0	0	0	112	L5 D6 S7 E11 S12 E13	L5-A9 WeakPolarHBondContact O-CB 3.49Å; L5-A9 PolarHBondContact O-N 3.49Å; D6-A9 CarbonylContact O-C 3.51Å; D6-A9 WeakPolarHBondContact O-CA 3.17Å; D6-A9 WeakPolarHBondContact O-CB 3.1Å; D6-A9 PolarHBondContact O-N 2.68Å; D6-A9 VanDerWaalsContact O-N 3.13Å; S7-A9 PolarHBondContact O-N 3.46Å; A9-E11 PolarHBondContact O-N 2.87Å; A9-S12 CarbonylContact O-C 3.03Å; A9-S12 VanDerWaalsContact O-CA 3.3Å; A9-S12 WeakPolarHBondContact O-CA 3.26Å; A9-S12 WeakPolarHBondContact O-CB 3.46Å; A9-S12 PolarHBondContact O-N 2.81Å; A9-S12 PolarHBondContact O-OG 2.73Å; A9-E13 WeakPolarHBondContact O-CG 3.44Å; A9-E13 PolarHBondContact O-N 3.27Å
10	E	43.6	Very low	43.1	Very low	127 Å²	127	101 Å²	101	59%	0.593	52%	0.519	S	S	*	.	H	α-helix	trans	-54.8	-49.6	173.3	-73.2	172.9	156.1	0	0	110.9	D6 S7 S12 E13 E14	D6-E10 WeakPolarHBondContact O-CG 3.49Å; D6-E10 PolarHBondContact O-N 3.1Å; S7-E10 PolarHBondContact O-N 2.85Å; E10-S12 PolarHBondContact O-N 2.78Å; E10-E13 PolarHBondContact O-N 2.55Å; E10-E14 PolarHBondContact O-N 2.84Å
11	E	39.7	Very low	43.8	Very low	156 Å²	156	101 Å²	101	73%	0.729	52%	0.52	S	S	*	.	H	α-helix	trans	-60.8	-13.3	172.9	-75.6	-166.8	164.7	0	0	113.9	S7 A9	S7-E11 PolarHBondContact O-N 2.76Å; A9-E11 PolarHBondContact O-N 2.87Å
12	S	42.4	Very low	44.8	Very low	61 Å²	61	97.6 Å²	97.6	43%	0.427	50%	0.503	S	S	.	.	H	α-helix	trans	-100.1	-31.9	176.7	86.9	0	0	0	0	113.4	A9 E10 E15 E16	A9-S12 CarbonylContact O-C 3.03Å; A9-S12 VanDerWaalsContact O-CA 3.3Å; A9-S12 WeakPolarHBondContact O-CA 3.26Å; A9-S12 WeakPolarHBondContact O-CB 3.46Å; A9-S12 PolarHBondContact O-N 2.81Å; A9-S12 PolarHBondContact O-OG 2.73Å; E10-S12 PolarHBondContact O-N 2.78Å; S12-E15 PolarHBondContact O-N 3.25Å; S12-E16 PolarHBondContact O-N 3.36Å
13	E	41.7	Very low	46.1	Very low	126 Å²	126	98.3 Å²	98.3	59%	0.589	49%	0.491	S	S	*	.	H	α-helix	trans	-74	-33.7	177	-70.2	-179.7	167.3	0	0	110.3	A9 E10 E15 E16 E17	A9-E13 WeakPolarHBondContact O-CG 3.44Å; A9-E13 PolarHBondContact O-N 3.27Å; E10-E13 PolarHBondContact O-N 2.55Å; E13-E15 VanDerWaalsContact C-N 3.26Å; E13-E15 PolarHBondContact O-N 3.33Å; E13-E16 WeakPolarHBondContact O-CA 3.13Å; E13-E16 WeakPolarHBondContact O-CB 3.39Å; E13-E16 PolarHBondContact O-N 2.86Å; E13-E17 PolarHBondContact O-N 3.47Å
14	E	39.9	Very low	47.1	Very low	158 Å²	158	97.7 Å²	97.7	74%	0.738	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-26.9	167.6	-73.9	-166.5	166.4	0	0	114	E10	E10-E14 PolarHBondContact O-N 2.84Å
15	E	42.8	Very low	48.1	Very low	105 Å²	105	99.9 Å²	99.9	49%	0.491	49%	0.491	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.2	-3.8	170.8	-98.5	-143.8	156.1	0	0	113.5	S12 E13 R23 K30	S12-E15 PolarHBondContact O-N 3.25Å; E13-E15 VanDerWaalsContact C-N 3.26Å; E13-E15 PolarHBondContact O-N 3.33Å; E15-R23 PolarHBondContact O-NE 3.1Å; E15-R23 PolarHBondContact O-NH2 3.44Å; E15-K30 IonicContact OE1-NZ 3.66Å; E15-K30 PolarHBondContact OE1-NZ 3.4Å
16	E	46.3	Very low	48.4	Very low	117 Å²	117	98.1 Å²	98.1	55%	0.547	48%	0.483	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91	-39.1	179.8	-75.5	-86.9	72.8	0	0	114.4	S12 E13 L18 R23	S12-E16 PolarHBondContact O-N 3.36Å; E13-E16 WeakPolarHBondContact O-CA 3.13Å; E13-E16 WeakPolarHBondContact O-CB 3.39Å; E13-E16 PolarHBondContact O-N 2.86Å; E16-L18 VanDerWaalsContact C-N 3.33Å; E16-L18 PolarHBondContact O-N 3.36Å; E16-R23 PolarHBondContact O-NH1 2.99Å; E16-R23 IonicContact OE1-CZ 2.78Å; E16-R23 IonicContact OE1-NH1 2.77Å; E16-R23 PolarHBondContact OE1-NH1 3.15Å; E16-R23 IonicContact OE1-NH2 2.72Å; E16-R23 PolarHBondContact OE1-NH2 2.93Å
17	E	47.7	Very low	48.8	Very low	99 Å²	99	100.9 Å²	100.9	46%	0.463	49%	0.49	S	S	.	.			trans	-69.7	-14.3	-168.4	-64.8	-154.3	107.4	0	0	116.7	E13 D19 G104	E13-E17 PolarHBondContact O-N 3.47Å; E17-D19 PolarHBondContact O-N 3.36Å; E17-G104 PolarHBondContact OE1-N 3.1Å; E17-G104 VanDerWaalsContact OE1-N 3.11Å
18	L	43.6	Very low	49.1	Very low	57 Å²	57	106.3 Å²	106.3	30%	0.298	51%	0.508	S	S	.	.	S	Bend	trans	-64.4	126.6	-175.8	-66.7	168.8	0	0	0	113.8	E16 R23 L26	E16-L18 VanDerWaalsContact C-N 3.33Å; E16-L18 PolarHBondContact O-N 3.36Å; L18-R23 HydrophobicContact CB-CB 4.16Å; L18-R23 HydrophobicContact CB-CG 3.93Å; L18-R23 VanDerWaalsContact O-CD 3.32Å; L18-R23 WeakPolarHBondContact O-CD 3.26Å; L18-L26 HydrophobicContact CD1-CD1 4.33Å; L18-L26 HydrophobicContact CD1-CD2 3.77Å
19	D	56.5	Low	49.2	Very low	85 Å²	85	108.2 Å²	108.2	46%	0.455	52%	0.52	S	S	.	.			trans	-48.7	151.1	176.9	162.5	60.8	0	0	0	113.2	E17 N21 E22 R23	E17-D19 PolarHBondContact O-N 3.36Å; D19-N21 PolarHBondContact O-N 2.83Å; D19-N21 WeakPolarHBondContact OD2-CA 3.4Å; D19-N21 VanDerWaalsContact OD2-CB 3.24Å; D19-N21 WeakPolarHBondContact OD2-CB 3.26Å; D19-N21 PolarHBondContact OD2-N 3.2Å; D19-N21 PolarHBondContact OD2-ND2 3.27Å; D19-E22 HydrophobicContact CB-CB 4.32Å; D19-E22 HydrophobicContact CB-CG 4.15Å; D19-E22 CarbonylContact O-C 3.58Å; D19-E22 WeakPolarHBondContact O-CA 3.24Å; D19-E22 PolarHBondContact O-N 2.7Å; D19-R23 WeakPolarHBondContact O-CB 3.41Å; D19-R23 PolarHBondContact O-N 2.82Å
20	V	52.4	Low	49.2	Very low	96 Å²	96	112.9 Å²	112.9	58%	0.582	53%	0.534	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	-24.9	-178.3	-178.7	0	0	0	0	113.8	K24	V20-K24 WeakPolarHBondContact O-CB 3.35Å; V20-K24 WeakPolarHBondContact O-CD 3.37Å; V20-K24 WeakPolarHBondContact O-CG 3.24Å
21	N	57.7	Low	49.2	Very low	101 Å²	101	109.8 Å²	109.8	54%	0.54	53%	0.53	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87	-28.8	170.3	-60.2	-62	0	0	0	113.1	D19 K24 R25	D19-N21 PolarHBondContact O-N 2.83Å; D19-N21 WeakPolarHBondContact OD2-CA 3.4Å; D19-N21 VanDerWaalsContact OD2-CB 3.24Å; D19-N21 WeakPolarHBondContact OD2-CB 3.26Å; D19-N21 PolarHBondContact OD2-N 3.2Å; D19-N21 PolarHBondContact OD2-ND2 3.27Å; N21-K24 CarbonylContact O-C 3.48Å; N21-K24 WeakPolarHBondContact O-CB 3.5Å; N21-K24 PolarHBondContact O-N 2.85Å; N21-R25 WeakPolarHBondContact O-CG 3.11Å; N21-R25 PolarHBondContact O-N 2.23Å
22	E	57.3	Low	49.2	Very low	85 Å²	85	106.5 Å²	106.5	40%	0.397	53%	0.53	S	S	.	.	H	α-helix	trans	-80	-44.1	179	-59.1	-125.7	114.8	0	0	111.3	D19 K24 R25 L26	D19-E22 HydrophobicContact CB-CB 4.32Å; D19-E22 HydrophobicContact CB-CG 4.15Å; D19-E22 CarbonylContact O-C 3.58Å; D19-E22 WeakPolarHBondContact O-CA 3.24Å; D19-E22 PolarHBondContact O-N 2.7Å; E22-K24 PolarHBondContact O-N 2.98Å; E22-K24 VanDerWaalsContact O-N 3.17Å; E22-R25 CarbonylContact O-C 3.56Å; E22-R25 WeakPolarHBondContact O-CA 3.42Å; E22-R25 WeakPolarHBondContact O-CB 3.5Å; E22-R25 PolarHBondContact O-N 2.46Å; E22-R25 IonicContact OE1-NH1 3.7Å; E22-R25 PolarHBondContact OE1-NH1 3.34Å; E22-L26 PolarHBondContact O-N 3.06Å
23	R	59.9	Low	49	Very low	79 Å²	79	109.9 Å²	109.9	30%	0.298	55%	0.547	S	S	.	.	H	α-helix	trans	-57.3	-25.8	164.5	-126.4	160.8	176.3	-155.8	-15.6	112.1	E15 E16 L18 D19 K27	E15-R23 PolarHBondContact O-NE 3.1Å; E15-R23 PolarHBondContact O-NH2 3.44Å; E16-R23 PolarHBondContact O-NH1 2.99Å; E16-R23 IonicContact OE1-CZ 2.78Å; E16-R23 IonicContact OE1-NH1 2.77Å; E16-R23 PolarHBondContact OE1-NH1 3.15Å; E16-R23 IonicContact OE1-NH2 2.72Å; E16-R23 PolarHBondContact OE1-NH2 2.93Å; L18-R23 HydrophobicContact CB-CB 4.16Å; L18-R23 HydrophobicContact CB-CG 3.93Å; L18-R23 VanDerWaalsContact O-CD 3.32Å; L18-R23 WeakPolarHBondContact O-CD 3.26Å; D19-R23 WeakPolarHBondContact O-CB 3.41Å; D19-R23 PolarHBondContact O-N 2.82Å; R23-K27 VanDerWaalsContact O-CB 3.25Å; R23-K27 WeakPolarHBondContact O-CB 3.41Å; R23-K27 VanDerWaalsContact O-CG 3.31Å; R23-K27 WeakPolarHBondContact O-CG 3.36Å; R23-K27 PolarHBondContact O-N 2.85Å; R23-K27 VanDerWaalsContact O-N 3.16Å
24	K	58.7	Low	48.6	Very low	124 Å²	124	108.5 Å²	108.5	54%	0.539	55%	0.552	S	S	.	*	H	α-helix	trans	-80.5	-32.7	167.3	-81.2	172.2	-167.2	156.8	0	114	V20 N21 E22 K28	V20-K24 WeakPolarHBondContact O-CB 3.35Å; V20-K24 WeakPolarHBondContact O-CD 3.37Å; V20-K24 WeakPolarHBondContact O-CG 3.24Å; N21-K24 CarbonylContact O-C 3.48Å; N21-K24 WeakPolarHBondContact O-CB 3.5Å; N21-K24 PolarHBondContact O-N 2.85Å; E22-K24 PolarHBondContact O-N 2.98Å; E22-K24 VanDerWaalsContact O-N 3.17Å; K24-K28 WeakPolarHBondContact O-CB 3.23Å; K24-K28 PolarHBondContact O-N 2.95Å
25	R	58.7	Low	48.2	Very low	163 Å²	163	108.4 Å²	108.4	62%	0.615	56%	0.556	S	S	*	*	H	α-helix	trans	-69.6	-48.8	173	-82.1	173.8	161	177.3	-6.2	111	N21 E22 K27 K28 L29	N21-R25 WeakPolarHBondContact O-CG 3.11Å; N21-R25 PolarHBondContact O-N 2.23Å; E22-R25 CarbonylContact O-C 3.56Å; E22-R25 WeakPolarHBondContact O-CA 3.42Å; E22-R25 WeakPolarHBondContact O-CB 3.5Å; E22-R25 PolarHBondContact O-N 2.46Å; E22-R25 IonicContact OE1-NH1 3.7Å; E22-R25 PolarHBondContact OE1-NH1 3.34Å; R25-K27 PolarHBondContact O-N 2.92Å; R25-K28 CarbonylContact O-C 3.56Å; R25-K28 WeakPolarHBondContact O-CA 3.35Å; R25-K28 WeakPolarHBondContact O-CB 3.29Å; R25-K28 PolarHBondContact O-N 3Å; R25-L29 WeakPolarHBondContact O-CD1 3.36Å; R25-L29 PolarHBondContact O-N 2.89Å
26	L	49.9	Very low	47.6	Very low	74 Å²	74	108.3 Å²	108.3	39%	0.387	57%	0.567	S	S	.	*	H	α-helix	trans	-60.7	-42.4	172.6	-93.2	83.8	0	0	0	111.6	L18 E22 K28 L29 K30	L18-L26 HydrophobicContact CD1-CD1 4.33Å; L18-L26 HydrophobicContact CD1-CD2 3.77Å; E22-L26 PolarHBondContact O-N 3.06Å; L26-K28 VanDerWaalsContact C-N 3.29Å; L26-K28 PolarHBondContact O-N 3.45Å; L26-L29 PolarHBondContact O-N 3.13Å; L26-K30 WeakPolarHBondContact O-CB 3.32Å; L26-K30 PolarHBondContact O-N 3.05Å
27	K	54.2	Low	46.9	Very low	145 Å²	145	107.1 Å²	107.1	63%	0.63	57%	0.572	S	S	*	*	H	α-helix	trans	-64.7	-30.8	172.3	-80.4	174.2	175	162.1	0	113	R23 R25 A31	R23-K27 VanDerWaalsContact O-CB 3.25Å; R23-K27 WeakPolarHBondContact O-CB 3.41Å; R23-K27 VanDerWaalsContact O-CG 3.31Å; R23-K27 WeakPolarHBondContact O-CG 3.36Å; R23-K27 PolarHBondContact O-N 2.85Å; R23-K27 VanDerWaalsContact O-N 3.16Å; R25-K27 PolarHBondContact O-N 2.92Å; K27-A31 WeakPolarHBondContact O-CB 3.04Å; K27-A31 PolarHBondContact O-N 2.87Å; K27-A31 VanDerWaalsContact O-N 3.09Å
28	K	49.1	Very low	46.1	Very low	163 Å²	163	111.5 Å²	111.5	71%	0.709	59%	0.593	S	S	*	*	H	α-helix	trans	-71.6	-35.5	169.8	-88.7	-170.6	168.7	-171.3	0	113.5	K24 R25 L26 A32	K24-K28 WeakPolarHBondContact O-CB 3.23Å; K24-K28 PolarHBondContact O-N 2.95Å; R25-K28 CarbonylContact O-C 3.56Å; R25-K28 WeakPolarHBondContact O-CA 3.35Å; R25-K28 WeakPolarHBondContact O-CB 3.29Å; R25-K28 PolarHBondContact O-N 3Å; L26-K28 VanDerWaalsContact C-N 3.29Å; L26-K28 PolarHBondContact O-N 3.45Å; K28-A32 WeakPolarHBondContact O-CB 3.17Å; K28-A32 PolarHBondContact O-N 3Å
29	L	44.3	Very low	45.5	Very low	120 Å²	120	117.9 Å²	117.9	63%	0.628	62%	0.621	S	S	*	*	H	α-helix	trans	-73.2	-53.1	175.7	-94.6	73.5	0	0	0	111.5	R25 L26 A31 A32 V33	R25-L29 WeakPolarHBondContact O-CD1 3.36Å; R25-L29 PolarHBondContact O-N 2.89Å; L26-L29 PolarHBondContact O-N 3.13Å; L29-A31 PolarHBondContact O-N 3.02Å; L29-A32 PolarHBondContact O-N 3.25Å; L29-V33 WeakPolarHBondContact O-CG2 3.14Å; L29-V33 PolarHBondContact O-N 3.33Å
30	K	46.7	Very low	44.3	Very low	130 Å²	130	122 Å²	122	57%	0.565	64%	0.637	S	S	*	*	H	α-helix	trans	-55.8	-34.6	174.9	-77	-174.7	175.5	-179.1	0	111.6	E15 L26 S34	E15-K30 IonicContact OE1-NZ 3.66Å; E15-K30 PolarHBondContact OE1-NZ 3.4Å; L26-K30 WeakPolarHBondContact O-CB 3.32Å; L26-K30 PolarHBondContact O-N 3.05Å; K30-S34 WeakPolarHBondContact O-CB 3.34Å
31	A	42.5	Very low	43.3	Very low	62 Å²	62	127.2 Å²	127.2	51%	0.512	66%	0.655	S	S	.	*	H	α-helix	trans	-78.4	-33.6	174.2	0	0	0	0	0	114.4	K27 L29 V33 S34	K27-A31 WeakPolarHBondContact O-CB 3.04Å; K27-A31 PolarHBondContact O-N 2.87Å; K27-A31 VanDerWaalsContact O-N 3.09Å; L29-A31 PolarHBondContact O-N 3.02Å; A31-V33 PolarHBondContact O-N 3.5Å; A31-S34 PolarHBondContact O-N 3.01Å
32	A	39.7	Very low	42.4	Very low	87 Å²	87	129.9 Å²	129.9	72%	0.719	67%	0.67	S	S	*	*	H	α-helix	trans	-74.4	-7	177.5	0	0	0	0	0	114	K28 L29	K28-A32 WeakPolarHBondContact O-CB 3.17Å; K28-A32 PolarHBondContact O-N 3Å; L29-A32 PolarHBondContact O-N 3.25Å
33	V	38.8	Very low	41.6	Very low	131 Å²	131	129.8 Å²	129.8	79%	0.794	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.9	3.5	-179.6	177.4	0	0	0	0	111.6	L29 A31	L29-V33 WeakPolarHBondContact O-CG2 3.14Å; L29-V33 PolarHBondContact O-N 3.33Å; A31-V33 PolarHBondContact O-N 3.5Å
34	S	34.5	Very low	40.7	Very low	98 Å²	98	133.7 Å²	133.7	69%	0.685	69%	0.694	S	S	*	*	S	Bend	trans	-135.5	7.9	-169	-172.1	0	0	0	0	115.9	K30 A31	K30-S34 WeakPolarHBondContact O-CB 3.34Å; A31-S34 PolarHBondContact O-N 3.01Å
35	D	30.8	Very low	40	Very low	155 Å²	155	135.6 Å²	135.6	83%	0.829	71%	0.705	S	S	*	*	S	Bend	trans	-148.9	72	-176.7	-159.2	6.7	0	0	0	113.6
36	S	30.4	Very low	39.2	Very low	103 Å²	103	134.7 Å²	134.7	72%	0.72	70%	0.701	S	S	*	*			trans	-160.9	131.6	158.6	-168.7	0	0	0	0	110.3
37	S	32.3	Very low	38.8	Very low	93 Å²	93	136.6 Å²	136.6	65%	0.65	71%	0.711	S	S	*	*			trans	35	102.6	150.2	55.6	0	0	0	0	117.1
38	E	30.6	Very low	38.5	Very low	191 Å²	191	138.9 Å²	138.9	89%	0.893	72%	0.716	S	S	*	*	S	Bend		33	117.4	68.8	-69.8	-165.9	165.1	0	0	113.6
39	E	31	Very low	38.5	Very low	190 Å²	190	137.9 Å²	137.9	89%	0.888	71%	0.713	S	S	*	*			trans	78.1	74	-172.1	-55.6	-171.9	-178.2	0	0	117
40	E	30.1	Very low	38.6	Very low	172 Å²	172	138 Å²	138	80%	0.804	71%	0.711	S	S	*	*			trans	175.3	80.8	142.7	-98.9	166.3	-164.2	0	0	112.5
41	E	31.3	Very low	38.5	Very low	205 Å²	205	138.5 Å²	138.5	96%	0.958	72%	0.719	S	S	*	*			trans	-84.2	-0.7	-174.6	-72.5	-171.3	135.8	0	0	116.4
42	D	40	Very low	38.5	Very low	158 Å²	158	142.8 Å²	142.8	85%	0.845	73%	0.726	S	S	*	*	S	Bend	trans	-101.5	-13.9	-169.1	-100.1	-38.5	0	0	0	116
43	D	41	Very low	38.7	Very low	83 Å²	83	146 Å²	146	44%	0.444	73%	0.731	S	S	.	*	S	Bend	trans	-108.4	-12.8	-171	-88.6	-59.9	0	0	0	116.1	R46 L47	D43-R46 WeakPolarHBondContact O-CB 3.39Å; D43-R46 PolarHBondContact O-N 2.92Å; D43-R46 IonicContact OD1-NH1 3.88Å; D43-R46 PolarHBondContact OD1-NH1 2.79Å; D43-L47 PolarHBondContact O-N 3.43Å
44	E	39.7	Very low	38.8	Very low	161 Å²	161	147 Å²	147	75%	0.752	73%	0.731	S	S	*	*	H	α-helix	trans	-70.5	-36	178.1	-75.1	-149.2	138.7	0	0	113.8	R46 L47 R48	E44-R46 PolarHBondContact O-N 2.89Å; E44-L47 PolarHBondContact O-N 2.94Å; E44-R48 PolarHBondContact O-N 3.31Å; E44-R48 VanDerWaalsContact O-N 3.12Å
45	E	43.5	Very low	39.1	Very low	164 Å²	164	148.9 Å²	148.9	77%	0.766	73%	0.732	S	S	*	*	H	α-helix	trans	-65.2	-28.8	177.2	-172.7	161.2	-140.1	0	0	111.2	R48 E49	E45-R48 CarbonylContact O-C 3.51Å; E45-R48 PolarHBondContact O-N 2.97Å; E45-E49 PolarHBondContact O-N 3.29Å
46	R	43.2	Very low	39.6	Very low	143 Å²	143	148 Å²	148	54%	0.54	73%	0.727	S	S	.	*	H	α-helix	trans	-70	-46.5	176.1	-176.3	-178.6	178.1	177.1	0.9	112.6	D43 E44 R48 E49 E50	D43-R46 WeakPolarHBondContact O-CB 3.39Å; D43-R46 PolarHBondContact O-N 2.92Å; D43-R46 IonicContact OD1-NH1 3.88Å; D43-R46 PolarHBondContact OD1-NH1 2.79Å; E44-R46 PolarHBondContact O-N 2.89Å; R46-R48 PolarHBondContact O-N 3.09Å; R46-E49 PolarHBondContact O-N 3.36Å; R46-E50 IonicContact NE-OE1 3.19Å; R46-E50 PolarHBondContact NE-OE1 3.19Å; R46-E50 PolarHBondContact O-N 2.88Å
47	L	40.6	Very low	39.9	Very low	115 Å²	115	149.9 Å²	149.9	60%	0.602	73%	0.73	S	S	*	*	H	α-helix	trans	-59.6	-31.1	171.5	-84.6	160.8	0	0	0	111.8	D43 E44 L51	D43-L47 PolarHBondContact O-N 3.43Å; E44-L47 PolarHBondContact O-N 2.94Å; L47-L51 WeakPolarHBondContact O-CB 3.21Å; L47-L51 PolarHBondContact O-N 3.28Å
48	R	48.1	Very low	40.6	Very low	193 Å²	193	151 Å²	151	73%	0.728	73%	0.728	S	S	*	*	H	α-helix	trans	-77.7	-14.2	173.6	-101.7	-180	171	-177.5	1.6	115.8	E44 E45 R46 K52	E44-R48 PolarHBondContact O-N 3.31Å; E44-R48 VanDerWaalsContact O-N 3.12Å; E45-R48 CarbonylContact O-C 3.51Å; E45-R48 PolarHBondContact O-N 2.97Å; R46-R48 PolarHBondContact O-N 3.09Å; R48-K52 PolarHBondContact O-NZ 2.94Å
49	E	50	Low	40.9	Very low	141 Å²	141	147.2 Å²	147.2	66%	0.659	72%	0.72	S	S	*	*	H	α-helix	trans	-87.8	-41.1	163.5	-71.9	-148	129.8	0	0	111.3	E45 R46 L51 K52	E45-E49 PolarHBondContact O-N 3.29Å; R46-E49 PolarHBondContact O-N 3.36Å; E49-L51 PolarHBondContact O-N 3.03Å; E49-K52 WeakPolarHBondContact O-CB 3.23Å; E49-K52 PolarHBondContact O-N 2.97Å
50	E	45.5	Very low	41.3	Very low	123 Å²	123	145.5 Å²	145.5	58%	0.575	72%	0.716	S	S	*	*	H	α-helix	trans	-69.5	-28.1	-177.6	-69.3	180	-165.4	0	0	113.2	R46 K52	R46-E50 IonicContact NE-OE1 3.19Å; R46-E50 PolarHBondContact NE-OE1 3.19Å; R46-E50 PolarHBondContact O-N 2.88Å; E50-K52 VanDerWaalsContact C-N 3.29Å; E50-K52 PolarHBondContact O-N 3.34Å
51	L	44.9	Very low	41.6	Very low	141 Å²	141	146.1 Å²	146.1	74%	0.738	72%	0.719	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.5	1.8	174.6	-133.5	78.7	0	0	0	115	L47 E49	L47-L51 WeakPolarHBondContact O-CB 3.21Å; L47-L51 PolarHBondContact O-N 3.28Å; E49-L51 PolarHBondContact O-N 3.03Å
52	K	41.6	Very low	41.7	Very low	151 Å²	151	145.4 Å²	145.4	66%	0.657	72%	0.715	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.5	-11.8	-174.2	-102.8	-171.7	-160.5	81.3	0	116	R48 E49 E50 L54	R48-K52 PolarHBondContact O-NZ 2.94Å; E49-K52 WeakPolarHBondContact O-CB 3.23Å; E49-K52 PolarHBondContact O-N 2.97Å; E50-K52 VanDerWaalsContact C-N 3.29Å; E50-K52 PolarHBondContact O-N 3.34Å; K52-L54 VanDerWaalsContact C-N 3.35Å
53	D	45	Very low	41.5	Very low	156 Å²	156	145.5 Å²	145.5	83%	0.834	72%	0.716	S	S	*	*	S	Bend	trans	-96.9	26.1	-177.9	-72.8	-15.7	0	0	0	112.3
54	L	41.1	Very low	41	Very low	151 Å²	151	147 Å²	147	79%	0.791	72%	0.724	S	S	*	*			trans	-125.6	24.4	-170.8	-146.8	79.3	0	0	0	115.9	K52	K52-L54 VanDerWaalsContact C-N 3.35Å
55	I	40.8	Very low	40.7	Very low	138 Å²	138	141.8 Å²	141.8	71%	0.708	71%	0.713	S	S	*	*			trans	-129.4	120.8	166.2	-58.5	-178.8	0	0	0	108.2	D57	I55-D57 WeakPolarHBondContact CG2-OD1 3.45Å; I55-D57 PolarHBondContact O-N 3.36Å
56	D	40	Very low	40	Very low	135 Å²	135	140.2 Å²	140.2	72%	0.722	72%	0.72	S	S	*	*			trans	-97.8	69.5	-174.9	-172.2	36.6	0	0	0	111.4	N58	D56-N58 PolarHBondContact O-N 2.95Å; D56-N58 PolarHBondContact OD1-ND2 3.07Å; D56-N58 PolarHBondContact OD2-ND2 3.15Å; D56-N58 VanDerWaalsContact OD2-ND2 3.08Å
57	D	37.6	Very low	39.5	Very low	144 Å²	144	136.5 Å²	136.5	77%	0.77	73%	0.726	S	S	*	*			trans	-73.8	63.8	176.9	-69.4	-30.5	0	0	0	111.7	I55 P59	I55-D57 WeakPolarHBondContact CG2-OD1 3.45Å; I55-D57 PolarHBondContact O-N 3.36Å; D57-P59 WeakPolarHBondContact O-CD 3.48Å
58	N	46.1	Very low	39.1	Very low	115 Å²	115	141.2 Å²	141.2	62%	0.615	74%	0.738	S	S	*	*	P	Polyproline II helix	trans	-74	118	165	-81.8	-60.1	0	0	0	109.2	D56 I60	D56-N58 PolarHBondContact O-N 2.95Å; D56-N58 PolarHBondContact OD1-ND2 3.07Å; D56-N58 PolarHBondContact OD2-ND2 3.15Å; D56-N58 VanDerWaalsContact OD2-ND2 3.08Å; N58-I60 PolarHBondContact O-N 3.32Å
59	P	37.8	Very low	38.2	Very low	112 Å²	112	139.1 Å²	139.1	73%	0.727	74%	0.741	S	S	*	*	P	Polyproline II helix	trans	-69.4	130.8	175.2	29.2	-33.5	0	0	0	109.9	D57 E61	D57-P59 WeakPolarHBondContact O-CD 3.48Å; P59-E61 PolarHBondContact O-N 3.19Å
60	I	39.4	Very low	37.3	Very low	155 Å²	155	137.4 Å²	137.4	80%	0.795	75%	0.745	S	S	*	*	P	Polyproline II helix	trans	-72.1	121.2	169.4	-68.3	175.1	0	0	0	108.1	N58 E62	N58-I60 PolarHBondContact O-N 3.32Å; I60-E62 PolarHBondContact O-N 3.22Å
61	E	35.6	Very low	36.6	Very low	185 Å²	185	139.3 Å²	139.3	86%	0.864	76%	0.758	S	S	*	*			trans	-78.2	113.5	171.6	-62.7	178.8	140.1	0	0	108.8	P59	P59-E61 PolarHBondContact O-N 3.19Å
62	E	34.6	Very low	35.9	Very low	189 Å²	189	136.2 Å²	136.2	88%	0.883	76%	0.761	S	S	*	*			trans	-87.4	122.7	166	-67.6	-164.5	142.7	0	0	109.6	I60	I60-E62 PolarHBondContact O-N 3.22Å
63	D	35.7	Very low	35.4	Very low	161 Å²	161	136.2 Å²	136.2	86%	0.861	77%	0.773	S	S	*	*			trans	-107.5	114.3	-168.1	-170.2	19.6	0	0	0	111.9	G65	D63-G65 PolarHBondContact O-N 2.79Å
64	D	30.9	Very low	34.8	Very low	115 Å²	115	132.5 Å²	132.5	62%	0.615	77%	0.772	S	S	*	*			trans	-103.4	83	-165.7	-162.2	21.6	0	0	0	110.9
65	G	32	Very low	34.3	Very low	51 Å²	51	130.9 Å²	130.9	53%	0.526	77%	0.773	S	S	.	*			trans	-119.9	4.5	-142.4	0	0	0	0	0	122.1	D63	D63-G65 PolarHBondContact O-N 2.79Å
66	S	30.4	Very low	33.8	Very low	131 Å²	131	127.2 Å²	127.2	92%	0.916	77%	0.77	S	S	*	*			trans	68	163.8	169.9	83.6	0	0	0	0	120.4
67	G	31.8	Very low	33.3	Very low	65 Å²	65	129.9 Å²	129.9	67%	0.67	78%	0.775	S	S	*	*			trans	138.9	68.3	152.3	0	0	0	0	0	122
68	Y	31.8	Very low	32.8	Very low	214 Å²	214	131.7 Å²	131.7	84%	0.839	78%	0.776	S	S	*	*			trans	45.1	130	146.9	-68.5	-83.6	0	0	0	125
69	D	29.9	Very low	32.2	Very low	149 Å²	149	137.6 Å²	137.6	80%	0.797	79%	0.79	S	S	*	*			trans	78.6	136.6	136.7	-67.6	-20.2	0	0	0	125.5
70	S	31	Very low	31.7	Very low	105 Å²	105	142 Å²	142	73%	0.734	80%	0.797	S	S	*	*			trans	84.3	97.3	145.8	-164.1	0	0	0	0	121.9
71	D	29.7	Very low	31.1	Very low	162 Å²	162	141.7 Å²	141.7	87%	0.866	79%	0.79	S	S	*	*			trans	41.3	113.2	132.7	-62.5	-18.3	0	0	0	121.4
72	G	31.7	Very low	30.7	Very low	77 Å²	77	138.9 Å²	138.9	79%	0.794	78%	0.777	S	S	*	*			trans	-152.3	8.5	179.2	0	0	0	0	0	120.1
73	V	30.4	Very low	30.3	Very low	150 Å²	150	137 Å²	137	91%	0.909	77%	0.768	S	S	*	*			trans	31.1	103	164.9	-171.7	0	0	0	0	118.9
74	G	31.7	Very low	30	Very low	79 Å²	79	135.7 Å²	135.7	81%	0.814	76%	0.761	S	S	*	*			trans	-149.3	22.2	-177	0	0	0	0	0	120.8
75	S	30.5	Very low	29.8	Very low	116 Å²	116	137.5 Å²	137.5	81%	0.811	77%	0.771	S	S	*	*			trans	21.4	119.2	164.6	-169.7	0	0	0	0	120.9
76	G	30.7	Very low	29.8	Very low	62 Å²	62	142.8 Å²	142.8	64%	0.639	79%	0.787	S	S	*	*			cis	120.2	155.6	-5.3	0	0	0	0	0	116.3
77	K	29.6	Very low	29.8	Very low	190 Å²	190	144.4 Å²	144.4	83%	0.826	79%	0.785	S	S	*	*			trans	78	147.2	162.8	-61.7	161.3	-171.7	169.4	0	116.4
78	K	28.1	Very low	30	Very low	182 Å²	182	146.1 Å²	146.1	79%	0.791	78%	0.778	S	S	*	*			cis	-159.3	154.5	-1.7	-103.4	159.9	176.9	-172.1	0	106.4
79	R	32.5	Very low	30.5	Very low	240 Å²	240	143.2 Å²	143.2	91%	0.906	78%	0.777	S	S	*	*			cis	85.8	88.4	27.4	-157.1	-174.9	-165.5	-162.3	5.4	116.8
80	K	27.9	Very low	31.4	Very low	203 Å²	203	144.6 Å²	144.6	88%	0.883	77%	0.771	S	S	*	*			trans	178.2	169.3	155.5	-109.8	-161.5	170.2	-161.8	0	109.4
81	K	26.5	Very low	32.9	Very low	150 Å²	150	143.9 Å²	143.9	65%	0.652	76%	0.759	S	S	*	*				178	135.8	-51.9	-174.6	-137.5	177.2	-137.5	0	108
82	H	27.7	Very low	34.4	Very low	125 Å²	125	142.8 Å²	142.8	58%	0.579	75%	0.748	S	S	*	*			trans	82.7	156.3	156.4	-124.3	-127	0	0	0	119.5
83	E	26.9	Very low	35.8	Very low	151 Å²	151	144 Å²	144	71%	0.706	74%	0.736	S	S	*	*			trans	60.6	147	173.4	-65	120.5	-128	0	0	116.6
84	D	27.6	Very low	37.7	Very low	133 Å²	133	142.8 Å²	142.8	71%	0.711	73%	0.725	S	S	*	*			cis	-167.3	170.6	-34.9	-98.7	-25.8	0	0	0	107.4
85	D	28	Very low	39.6	Very low	152 Å²	152	142 Å²	142	81%	0.813	70%	0.702	S	S	*	*			trans	68.6	159.6	164.1	-59.9	-31.9	0	0	0	121.9
86	D	30.6	Very low	41.6	Very low	162 Å²	162	139.8 Å²	139.8	87%	0.866	68%	0.676	S	S	*	*			trans	64.5	116.8	168.8	-68.1	-16.5	0	0	0	121.2
87	L	32.2	Very low	43.7	Very low	166 Å²	166	140.9 Å²	140.9	87%	0.869	67%	0.668	S	S	*	*			trans	-69.8	136.2	167.2	-59.9	156	0	0	0	110.2
88	D	34.3	Very low	45.7	Very low	101 Å²	101	136.1 Å²	136.1	54%	0.54	65%	0.651	S	S	.	*			trans	-125.4	92.4	173	-159.9	5.5	0	0	0	110.4	R90	D88-R90 VanDerWaalsContact CG-CZ 3.45Å; D88-R90 VanDerWaalsContact CG-NH2 3.34Å; D88-R90 PolarHBondContact O-N 3.16Å; D88-R90 IonicContact OD1-CZ 3.24Å; D88-R90 IonicContact OD1-NE 2.7Å; D88-R90 PolarHBondContact OD1-NE 3.37Å; D88-R90 IonicContact OD1-NH1 2.73Å; D88-R90 PolarHBondContact OD1-NH1 2.85Å; D88-R90 IonicContact OD1-NH2 2.7Å; D88-R90 PolarHBondContact OD1-NH2 2.67Å; D88-R90 IonicContact OD2-CZ 2.79Å; D88-R90 IonicContact OD2-NH1 3.73Å; D88-R90 PolarHBondContact OD2-NH1 2.89Å; D88-R90 IonicContact OD2-NH2 2.82Å; D88-R90 PolarHBondContact OD2-NH2 3.36Å
89	D	42.9	Very low	47.7	Very low	152 Å²	152	130 Å²	130	81%	0.813	63%	0.626	S	S	*	*			trans	-68.6	76.6	179.8	-59.7	-53.2	0	0	0	111.5
90	R	48.9	Very low	49.9	Very low	178 Å²	178	120.4 Å²	120.4	67%	0.672	59%	0.592	S	S	*	*			trans	-133.5	107.9	174.6	-65	-164.3	-162.4	106.2	28.7	111.5	D88 E92	D88-R90 VanDerWaalsContact CG-CZ 3.45Å; D88-R90 VanDerWaalsContact CG-NH2 3.34Å; D88-R90 PolarHBondContact O-N 3.16Å; D88-R90 IonicContact OD1-CZ 3.24Å; D88-R90 IonicContact OD1-NE 2.7Å; D88-R90 PolarHBondContact OD1-NE 3.37Å; D88-R90 IonicContact OD1-NH1 2.73Å; D88-R90 PolarHBondContact OD1-NH1 2.85Å; D88-R90 IonicContact OD1-NH2 2.7Å; D88-R90 PolarHBondContact OD1-NH2 2.67Å; D88-R90 IonicContact OD2-CZ 2.79Å; D88-R90 IonicContact OD2-NH1 3.73Å; D88-R90 PolarHBondContact OD2-NH1 2.89Å; D88-R90 IonicContact OD2-NH2 2.82Å; D88-R90 PolarHBondContact OD2-NH2 3.36Å; R90-E92 PolarHBondContact O-N 2.78Å
91	L	62.4	Low	52	Low	90 Å²	90	117.5 Å²	117.5	47%	0.471	58%	0.581	S	S	.	*			trans	-44	128.3	151.8	-64.7	162.7	0	0	0	109.1	D95 Y96 I99	L91-D95 WeakPolarHBondContact CA-OD2 3.48Å; L91-D95 HydrophobicContact CB-CB 3.74Å; L91-D95 HydrophobicContact CD2-CB 3.83Å; L91-D95 HydrophobicContact CG-CB 4.38Å; L91-Y96 HydrophobicContact CB-CD2 4.38Å; L91-Y96 HydrophobicContact CB-CE2 4.17Å; L91-I99 HydrophobicContact CD1-CD1 3.7Å; L91-I99 HydrophobicContact CD2-CD1 4.14Å; L91-I99 HydrophobicContact CG-CD1 4.46Å
92	E	61.3	Low	53.9	Low	139 Å²	139	115 Å²	115	65%	0.65	58%	0.575	S	S	*	*			trans	-70.8	167.7	179.2	-59.4	-161.5	154.2	0	0	110.5	R90 D94 D95 Y96	R90-E92 PolarHBondContact O-N 2.78Å; E92-D94 PolarHBondContact O-N 3.17Å; E92-D95 PolarHBondContact N-OD2 3.38Å; E92-D95 WeakPolarHBondContact O-CB 3.34Å; E92-D95 PolarHBondContact O-N 2.92Å; E92-Y96 WeakPolarHBondContact O-CD2 3.45Å; E92-Y96 PolarHBondContact O-N 2.88Å
93	D	61.4	Low	55.6	Low	102 Å²	102	114 Å²	114	55%	0.545	57%	0.574	S	S	.	*	H	α-helix	trans	-61.5	-27.4	177.6	-94.6	-57.4	0	0	0	111.4	Y96 D97 R109	D93-Y96 PolarHBondContact O-N 2.85Å; D93-D97 PolarHBondContact O-N 3.41Å; D93-R109 IonicContact OD1-CZ 3.36Å; D93-R109 IonicContact OD1-NH1 3.7Å; D93-R109 PolarHBondContact OD1-NH1 2.94Å
94	D	69.1	Low	56.9	Low	126 Å²	126	109.8 Å²	109.8	67%	0.674	57%	0.571	S	S	*	*	H	α-helix	trans	-69.7	-34.3	172.1	-69	17.6	0	0	0	112.1	E92 D97 L98	E92-D94 PolarHBondContact O-N 3.17Å; D94-D97 PolarHBondContact O-N 3.49Å; D94-L98 WeakPolarHBondContact O-CB 3.5Å; D94-L98 PolarHBondContact O-N 2.82Å
95	D	72.3	Confident	58.5	Low	61 Å²	61	108.3 Å²	108.3	33%	0.326	57%	0.566	S	S	.	*	H	α-helix	trans	-71.6	-35.9	171.9	-66.6	-48	0	0	0	111.2	L91 E92 D97 L98 I99	L91-D95 WeakPolarHBondContact CA-OD2 3.48Å; L91-D95 HydrophobicContact CB-CB 3.74Å; L91-D95 HydrophobicContact CD2-CB 3.83Å; L91-D95 HydrophobicContact CG-CB 4.38Å; E92-D95 PolarHBondContact N-OD2 3.38Å; E92-D95 WeakPolarHBondContact O-CB 3.34Å; E92-D95 PolarHBondContact O-N 2.92Å; D95-D97 VanDerWaalsContact C-N 3.32Å; D95-L98 PolarHBondContact O-N 3.13Å; D95-I99 WeakPolarHBondContact O-CB 3.38Å; D95-I99 WeakPolarHBondContact O-CD1 3.47Å; D95-I99 WeakPolarHBondContact O-CG1 3.19Å; D95-I99 PolarHBondContact O-N 3.09Å
96	Y	73.6	Confident	60.3	Low	70 Å²	70	109.2 Å²	109.2	28%	0.275	56%	0.563	S	S	.	*	H	α-helix	trans	-64.7	-37.4	171.4	-85.9	-75.2	0	0	0	111.8	L91 E92 D93 E100 V107 R109	L91-Y96 HydrophobicContact CB-CD2 4.38Å; L91-Y96 HydrophobicContact CB-CE2 4.17Å; E92-Y96 WeakPolarHBondContact O-CD2 3.45Å; E92-Y96 PolarHBondContact O-N 2.88Å; D93-Y96 PolarHBondContact O-N 2.85Å; Y96-E100 VanDerWaalsContact O-CB 3.32Å; Y96-E100 WeakPolarHBondContact O-CB 3.19Å; Y96-E100 WeakPolarHBondContact O-CG 3.4Å; Y96-E100 PolarHBondContact O-N 3.17Å; Y96-V107 HydrophobicContact CD1-CG1 4.07Å; Y96-V107 HydrophobicContact CE1-CG1 3.98Å; Y96-R109 HydrophobicContact CD1-CG 3.99Å; Y96-R109 HydrophobicContact CE1-CG 4.39Å; Y96-R109 HydrophobicContact CG-CG 4.33Å
97	D	73.8	Confident	61.9	Low	86 Å²	86	103.6 Å²	103.6	46%	0.46	53%	0.534	S	S	.	.	H	α-helix	trans	-65	-43.9	171.4	-76.7	13	0	0	0	110.2	D93 D94 D95 I99 E100 E101 R109	D93-D97 PolarHBondContact O-N 3.41Å; D94-D97 PolarHBondContact O-N 3.49Å; D95-D97 VanDerWaalsContact C-N 3.32Å; D97-I99 VanDerWaalsContact C-N 3.33Å; D97-I99 PolarHBondContact O-N 2.81Å; D97-E100 CarbonylContact O-C 3.54Å; D97-E100 PolarHBondContact O-N 2.86Å; D97-E101 WeakPolarHBondContact O-CB 3.47Å; D97-E101 PolarHBondContact O-N 3.16Å; D97-R109 IonicContact OD1-CZ 3.83Å; D97-R109 IonicContact OD1-NH1 2.9Å; D97-R109 PolarHBondContact OD1-NH1 3.39Å; D97-R109 VanDerWaalsContact OD1-NH1 3.14Å; D97-R109 IonicContact OD1-NH2 2.62Å; D97-R109 PolarHBondContact OD1-NH2 2.75Å
98	L	71.3	Confident	63	Low	89 Å²	89	102.1 Å²	102.1	47%	0.466	52%	0.523	S	S	.	.	H	α-helix	trans	-64.1	-32.6	177.3	-153.3	77.2	0	0	0	113.4	D94 D95 E101 N102	D94-L98 WeakPolarHBondContact O-CB 3.5Å; D94-L98 PolarHBondContact O-N 2.82Å; D95-L98 PolarHBondContact O-N 3.13Å; L98-E101 PolarHBondContact O-N 3.39Å; L98-N102 VanDerWaalsContact O-CB 3.28Å; L98-N102 WeakPolarHBondContact O-CB 3.15Å; L98-N102 VanDerWaalsContact O-CG 3.22Å; L98-N102 PolarHBondContact O-N 2.54Å; L98-N102 PolarHBondContact O-ND2 3.04Å
99	I	71	Confident	64	Low	53 Å²	53	101.9 Å²	101.9	27%	0.272	51%	0.514	S	S	.	.	H	α-helix	trans	-84.3	-29.1	176.3	-63	163.7	0	0	0	111.3	L91 D95 D97 L103 V107	L91-I99 HydrophobicContact CD1-CD1 3.7Å; L91-I99 HydrophobicContact CD2-CD1 4.14Å; L91-I99 HydrophobicContact CG-CD1 4.46Å; D95-I99 WeakPolarHBondContact O-CB 3.38Å; D95-I99 WeakPolarHBondContact O-CD1 3.47Å; D95-I99 WeakPolarHBondContact O-CG1 3.19Å; D95-I99 PolarHBondContact O-N 3.09Å; D97-I99 VanDerWaalsContact C-N 3.33Å; D97-I99 PolarHBondContact O-N 2.81Å; I99-L103 HydrophobicContact CG2-CD1 3.51Å; I99-L103 HydrophobicContact CG2-CG 4.08Å; I99-L103 WeakPolarHBondContact O-CB 3.3Å; I99-L103 WeakPolarHBondContact O-CG 3.35Å; I99-L103 PolarHBondContact O-N 3.03Å; I99-V107 HydrophobicContact CG2-CG2 3.88Å
100	E	77.4	Confident	64	Low	40 Å²	40	104.4 Å²	104.4	19%	0.187	51%	0.512	C	S	.	.	H	α-helix	trans	-68.1	-24.7	165.4	-77.8	-177.4	-137.4	0	0	111.9	Y96 D97 K106 V107 R109	Y96-E100 VanDerWaalsContact O-CB 3.32Å; Y96-E100 WeakPolarHBondContact O-CB 3.19Å; Y96-E100 WeakPolarHBondContact O-CG 3.4Å; Y96-E100 PolarHBondContact O-N 3.17Å; D97-E100 CarbonylContact O-C 3.54Å; D97-E100 PolarHBondContact O-N 2.86Å; E100-K106 HydrophobicContact CG-CG 4.29Å; E100-K106 WeakPolarHBondContact OE2-CE 3.2Å; E100-K106 WeakPolarHBondContact OE2-CG 3.31Å; E100-V107 HydrophobicContact CG-CB 4.05Å; E100-V107 HydrophobicContact CG-CG2 4.05Å; E100-R109 VanDerWaalsContact CD-NH2 3.33Å; E100-R109 IonicContact OE1-CZ 3.67Å; E100-R109 VanDerWaalsContact OE1-CZ 3.24Å; E100-R109 IonicContact OE1-NE 3.32Å; E100-R109 PolarHBondContact OE1-NE 3.12Å; E100-R109 IonicContact OE1-NH2 2.74Å; E100-R109 PolarHBondContact OE1-NH2 3.48Å; E100-R109 IonicContact OE2-NH2 2.78Å
101	E	71.9	Confident	63.4	Low	141 Å²	141	105.4 Å²	105.4	66%	0.659	52%	0.522	S	S	*	.	H	α-helix	trans	-82.9	-43.3	175.3	-164.5	159.7	-128.3	0	0	112.4	D97 L98	D97-E101 WeakPolarHBondContact O-CB 3.47Å; D97-E101 PolarHBondContact O-N 3.16Å; L98-E101 PolarHBondContact O-N 3.39Å
102	N	67.3	Low	62.2	Low	99 Å²	99	112.9 Å²	112.9	53%	0.529	54%	0.543	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.7	5.3	-178	-69.1	-24.7	0	0	0	116.2	L98	L98-N102 VanDerWaalsContact O-CB 3.28Å; L98-N102 WeakPolarHBondContact O-CB 3.15Å; L98-N102 VanDerWaalsContact O-CG 3.22Å; L98-N102 PolarHBondContact O-N 2.54Å; L98-N102 PolarHBondContact O-ND2 3.04Å
103	L	62.7	Low	60.8	Low	104 Å²	104	116 Å²	116	55%	0.545	56%	0.555	S	S	.	*	T	Hydrogen-bonded Turn	trans	-124.6	-3.8	176.6	-67.8	-179.2	0	0	0	113.6	I99 V105 V107	I99-L103 HydrophobicContact CG2-CD1 3.51Å; I99-L103 HydrophobicContact CG2-CG 4.08Å; I99-L103 WeakPolarHBondContact O-CB 3.3Å; I99-L103 WeakPolarHBondContact O-CG 3.35Å; I99-L103 PolarHBondContact O-N 3.03Å; L103-V105 WeakPolarHBondContact O-CG2 3.22Å; L103-V105 PolarHBondContact O-N 2.95Å; L103-V107 HydrophobicContact CD1-CG2 4.5Å
104	G	54	Low	59.4	Low	62 Å²	62	121 Å²	121	64%	0.639	57%	0.572	S	S	*	*	S	Bend	trans	55	6.6	-172	0	0	0	0	0	116.1	E17	E17-G104 PolarHBondContact OE1-N 3.1Å; E17-G104 VanDerWaalsContact OE1-N 3.11Å
105	V	62.5	Low	57.6	Low	101 Å²	101	126.4 Å²	126.4	61%	0.612	58%	0.583	S	S	*	*	S	Bend	trans	-132	128.4	-169.3	173.4	0	0	0	0	109.7	L103 V107	L103-V105 WeakPolarHBondContact O-CG2 3.22Å; L103-V105 PolarHBondContact O-N 2.95Å; V105-V107 PolarHBondContact O-N 3.4Å; V105-V107 VanDerWaalsContact O-N 3.08Å
106	K	66.4	Low	55.6	Low	172 Å²	172	131.5 Å²	131.5	75%	0.748	61%	0.609	S	S	*	*			trans	-71	107.3	-172.1	-147.1	175	-169.5	172.3	0	112.5	E100 E108	E100-K106 HydrophobicContact CG-CG 4.29Å; E100-K106 WeakPolarHBondContact OE2-CE 3.2Å; E100-K106 WeakPolarHBondContact OE2-CG 3.31Å; K106-E108 PolarHBondContact O-N 2.89Å
107	V	62.9	Low	53.6	Low	44 Å²	44	140.3 Å²	140.3	27%	0.267	64%	0.642	S	S	.	*			trans	-65.4	128.4	-177.7	-176.5	0	0	0	0	111	Y96 I99 E100 L103 V105 R109	Y96-V107 HydrophobicContact CD1-CG1 4.07Å; Y96-V107 HydrophobicContact CE1-CG1 3.98Å; I99-V107 HydrophobicContact CG2-CG2 3.88Å; E100-V107 HydrophobicContact CG-CB 4.05Å; E100-V107 HydrophobicContact CG-CG2 4.05Å; L103-V107 HydrophobicContact CD1-CG2 4.5Å; V105-V107 PolarHBondContact O-N 3.4Å; V105-V107 VanDerWaalsContact O-N 3.08Å; V107-R109 PolarHBondContact O-N 3.29Å
108	E	55.3	Low	51.5	Low	134 Å²	134	146.9 Å²	146.9	63%	0.626	66%	0.661	S	S	*	*			trans	-75.6	94.9	-179.7	-166.5	-178.1	-121.2	0	0	110.6	K106 R110	K106-E108 PolarHBondContact O-N 2.89Å; E108-R110 HydrophobicContact CG-CG 4.38Å; E108-R110 WeakPolarHBondContact O-CG 3.34Å; E108-R110 PolarHBondContact O-N 3.41Å; E108-R110 IonicContact OE2-CZ 2.77Å; E108-R110 IonicContact OE2-NE 2.74Å; E108-R110 PolarHBondContact OE2-NE 3.03Å; E108-R110 IonicContact OE2-NH2 3.86Å; E108-R110 PolarHBondContact OE2-NH2 2.97Å
109	R	56.4	Low	49.7	Very low	97 Å²	97	149.2 Å²	149.2	37%	0.366	67%	0.672	S	S	.	*			trans	-63.7	86.9	-178	-56.7	-167.2	-160.3	-162.8	3.6	112.6	D93 Y96 D97 E100 V107 K111	D93-R109 IonicContact OD1-CZ 3.36Å; D93-R109 IonicContact OD1-NH1 3.7Å; D93-R109 PolarHBondContact OD1-NH1 2.94Å; Y96-R109 HydrophobicContact CD1-CG 3.99Å; Y96-R109 HydrophobicContact CE1-CG 4.39Å; Y96-R109 HydrophobicContact CG-CG 4.33Å; D97-R109 IonicContact OD1-CZ 3.83Å; D97-R109 IonicContact OD1-NH1 2.9Å; D97-R109 PolarHBondContact OD1-NH1 3.39Å; D97-R109 VanDerWaalsContact OD1-NH1 3.14Å; D97-R109 IonicContact OD1-NH2 2.62Å; D97-R109 PolarHBondContact OD1-NH2 2.75Å; E100-R109 VanDerWaalsContact CD-NH2 3.33Å; E100-R109 IonicContact OE1-CZ 3.67Å; E100-R109 VanDerWaalsContact OE1-CZ 3.24Å; E100-R109 IonicContact OE1-NE 3.32Å; E100-R109 PolarHBondContact OE1-NE 3.12Å; E100-R109 IonicContact OE1-NH2 2.74Å; E100-R109 PolarHBondContact OE1-NH2 3.48Å; E100-R109 IonicContact OE2-NH2 2.78Å; V107-R109 PolarHBondContact O-N 3.29Å; R109-K111 PolarHBondContact O-N 2.95Å
110	R	42.1	Very low	47.7	Very low	204 Å²	204	154.7 Å²	154.7	77%	0.77	70%	0.696	S	S	*	*			trans	-80.4	104.5	-167.9	-84.2	172.6	177.8	-169.9	1	115.1	E108 R112	E108-R110 HydrophobicContact CG-CG 4.38Å; E108-R110 WeakPolarHBondContact O-CG 3.34Å; E108-R110 PolarHBondContact O-N 3.41Å; E108-R110 IonicContact OE2-CZ 2.77Å; E108-R110 IonicContact OE2-NE 2.74Å; E108-R110 PolarHBondContact OE2-NE 3.03Å; E108-R110 IonicContact OE2-NH2 3.86Å; E108-R110 PolarHBondContact OE2-NH2 2.97Å; R110-R112 PolarHBondContact O-N 3.16Å
111	K	37	Very low	45.6	Very low	200 Å²	200	158.2 Å²	158.2	87%	0.87	72%	0.716	S	S	*	*			trans	-89.8	103.1	172.2	-80.7	173.1	175.9	161.9	0	113.9	R109	R109-K111 PolarHBondContact O-N 2.95Å
112	R	36.1	Very low	43.8	Very low	246 Å²	246	157.1 Å²	157.1	93%	0.928	72%	0.715	S	S	*	*			trans	71.3	140.9	157.1	-86.1	-177.2	164.9	-175.3	-3.7	121.2	R110	R110-R112 PolarHBondContact O-N 3.16Å
113	F	32	Very low	42.2	Very low	204 Å²	204	160.7 Å²	160.7	90%	0.895	73%	0.729	S	S	*	*			trans	-68.1	143.1	-175	-54.3	-100.2	0	0	0	117.2
114	K	33.3	Very low	40.8	Very low	209 Å²	209	160 Å²	160	91%	0.909	73%	0.732	S	S	*	*				-170.6	115.5	125.4	-108.4	163.4	-175.3	168.3	0	115.7
115	R	30.8	Very low	39.7	Very low	239 Å²	239	164.7 Å²	164.7	90%	0.902	74%	0.743	S	S	*	*			trans	10.1	123.1	157.6	-70.1	-179.1	169.4	170.6	-3.2	121.2
116	L	30	Very low	38.3	Very low	167 Å²	167	163.7 Å²	163.7	87%	0.874	75%	0.753	S	S	*	*			trans	22.4	122	142.6	-80.7	73.8	0	0	0	119.6
117	R	31.1	Very low	36.6	Very low	256 Å²	256	164.5 Å²	164.5	97%	0.966	76%	0.759	S	S	*	*				-161.1	154	114.6	-114.4	177.1	178.4	-155.6	-4.4	114.6
118	R	29.8	Very low	35.1	Very low	224 Å²	224	169.9 Å²	169.9	85%	0.845	78%	0.781	S	S	*	*			trans	-61.6	146.8	-173.4	-75.5	176.3	170.8	175	-4.7	116.5
119	I	32.9	Very low	33.9	Very low	137 Å²	137	170.6 Å²	170.6	70%	0.703	79%	0.785	S	S	*	*				53.3	120.4	128.3	-54.7	166.2	0	0	0	118.3
120	H	29.9	Very low	32.7	Very low	168 Å²	168	174.4 Å²	174.4	78%	0.778	81%	0.806	S	S	*	*				-169.6	175.9	102.9	-155.9	13.6	0	0	0	111.4
121	D	33.6	Very low	32	Very low	115 Å²	115	170.3 Å²	170.3	62%	0.615	80%	0.804	S	S	*	*			trans	-123.6	161.5	-152.6	-47.3	-88.1	0	0	0	111.9
122	N	33	Very low	32	Very low	118 Å²	118	168 Å²	168	63%	0.631	80%	0.801	S	S	*	*				158.6	137.2	128	-90.5	36.6	0	0	0	113.4
123	E	33.7	Very low	31.7	Very low	174 Å²	174	165.6 Å²	165.6	81%	0.813	80%	0.8	S	S	*	*				39.6	144.3	126.6	-55.9	172.1	150.7	0	0	121
124	S	33.1	Very low	31.8	Very low	89 Å²	89	158.8 Å²	158.8	62%	0.622	79%	0.787	S	S	*	*			cis	-169.2	165.1	-12.8	-168.6	0	0	0	0	109.1
125	D	32.6	Very low	31.9	Very low	161 Å²	161	156.3 Å²	156.3	86%	0.861	78%	0.783	S	S	*	*			trans	56.6	143	158.5	-61.2	-63.9	0	0	0	121.7
126	G	32.3	Very low	32.4	Very low	80 Å²	80	149.8 Å²	149.8	83%	0.825	77%	0.77	S	S	*	*			trans	148.6	123.2	159.2	0	0	0	0	0	115.5
127	E	31.3	Very low	32.7	Very low	189 Å²	189	153.1 Å²	153.1	88%	0.883	77%	0.771	S	S	*	*			trans	-93.5	166.9	175.2	-61.5	-176.9	118	0	0	113.2
128	E	31	Very low	33.2	Very low	156 Å²	156	148.1 Å²	148.1	73%	0.729	76%	0.758	S	S	*	*			trans	78	118.1	155.9	-60.2	-138.2	107.4	0	0	122
129	Q	29.7	Very low	33.7	Very low	150 Å²	150	144.9 Å²	144.9	70%	0.701	75%	0.753	S	S	*	*			trans	68	98.3	131.7	-60.8	-173.2	44.1	0	0	122
130	H	30.9	Very low	34.1	Very low	176 Å²	176	145.3 Å²	145.3	82%	0.815	76%	0.755	S	S	*	*				81.6	145.3	121.2	-133.7	-68.9	0	0	0	120.9
131	V	28.1	Very low	34.4	Very low	119 Å²	119	141.5 Å²	141.5	72%	0.721	75%	0.753	S	S	*	*			trans	82.7	91.6	167.6	-166.2	0	0	0	0	117.8
132	D	35.9	Very low	34.9	Very low	150 Å²	150	144.2 Å²	144.2	80%	0.802	76%	0.762	S	S	*	*				35.6	98.6	121.1	-168.2	20.3	0	0	0	119.6
133	E	29.8	Very low	35.3	Very low	197 Å²	197	146.5 Å²	146.5	92%	0.921	77%	0.769	S	S	*	*			trans	-154.5	108.6	152.3	-131.1	174.4	-138.8	0	0	111.1
134	G	35.1	Very low	35.8	Very low	60 Å²	60	145.1 Å²	145.1	62%	0.619	77%	0.766	S	S	*	*			trans	-138.3	-12.2	-175.8	0	0	0	0	0	117	V136	G134-V136 PolarHBondContact O-N 2.79Å
135	L	36.2	Very low	36.1	Very low	158 Å²	158	150.6 Å²	150.6	83%	0.827	78%	0.779	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.1	58	-174.8	-76.8	165.6	0	0	0	113.5
136	V	39.7	Very low	36.1	Very low	102 Å²	102	149.7 Å²	149.7	62%	0.618	77%	0.774	S	S	*	*	T	Hydrogen-bonded Turn	trans	-135.2	-33.3	179.6	-174.2	0	0	0	0	113.5	G134 E138	G134-V136 PolarHBondContact O-N 2.79Å; V136-E138 VanDerWaalsContact C-N 3.27Å; V136-E138 PolarHBondContact O-N 2.81Å
137	R	38.1	Very low	36.5	Very low	237 Å²	237	154.7 Å²	154.7	89%	0.894	78%	0.776	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78	-9.8	-170.2	-150.2	167.1	-171.3	154.6	1.2	114.8
138	E	40.6	Very low	36.7	Very low	150 Å²	150	151 Å²	151	70%	0.701	76%	0.763	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.6	-18.4	-177.5	-151.7	162.1	-142.1	0	0	113	V136	V136-E138 VanDerWaalsContact C-N 3.27Å; V136-E138 PolarHBondContact O-N 2.81Å
139	Q	40.7	Very low	36.8	Very low	156 Å²	156	149.2 Å²	149.2	73%	0.729	76%	0.758	S	S	*	*	S	Bend	trans	-97.3	7.2	-171.3	-70.9	-172.4	-11	0	0	116.3
140	I	41	Very low	36.9	Very low	146 Å²	146	150 Å²	150	75%	0.749	76%	0.762	S	S	*	*	S	Bend	trans	-112.9	-12.6	-177.1	-61.4	179.1	0	0	0	112.5
141	A	37.2	Very low	37	Very low	89 Å²	89	145.2 Å²	145.2	74%	0.736	75%	0.748	S	S	*	*	S	Bend	trans	-85.8	-20.4	179.2	0	0	0	0	0	114.4	Q143	A141-Q143 PolarHBondContact O-N 2.88Å
142	E	43.3	Very low	37.1	Very low	171 Å²	171	146.8 Å²	146.8	80%	0.799	75%	0.751	S	S	*	*	S	Bend	trans	-92.3	16.6	-169.6	-59.8	-167.4	128.1	0	0	115.6
143	Q	40.6	Very low	36.8	Very low	167 Å²	167	143 Å²	143	78%	0.78	75%	0.746	S	S	*	*	S	Bend	trans	-132.6	13.4	-169.2	-67.2	-164.3	0.6	0	0	117.4	A141	A141-Q143 PolarHBondContact O-N 2.88Å
144	L	44	Very low	36.7	Very low	145 Å²	145	141.2 Å²	141.2	76%	0.759	74%	0.738	S	S	*	*	S	Bend	trans	-138.1	122.7	174.7	-76	171.4	0	0	0	112.2
145	F	39.3	Very low	36.4	Very low	204 Å²	204	148.3 Å²	148.3	90%	0.895	75%	0.746	S	S	*	*			trans	75	50.9	178.1	-48	-68	0	0	0	116.5
146	D	33.8	Very low	36	Very low	142 Å²	142	145.3 Å²	145.3	76%	0.759	74%	0.738	S	S	*	*			trans	-86	134.4	144.4	-172.2	13.7	0	0	0	109
147	E	39.9	Very low	35.5	Very low	184 Å²	184	147.1 Å²	147.1	86%	0.86	74%	0.74	S	S	*	*			trans	-179.8	91.4	149.4	-107.2	179.6	-161.8	0	0	111
148	N	35.8	Very low	35.1	Very low	113 Å²	113	145 Å²	145	60%	0.604	73%	0.732	S	S	*	*				75.4	137	126.9	-85.5	46.8	0	0	0	124.9
149	D	33.1	Very low	34.7	Very low	117 Å²	117	142.4 Å²	142.4	63%	0.626	73%	0.73	S	S	*	*			trans	78.2	110.6	134.1	-64.7	-7	0	0	0	119.7
150	E	32.4	Very low	34.1	Very low	168 Å²	168	142.9 Å²	142.9	79%	0.785	73%	0.732	S	S	*	*				100.2	151	60.9	-93.3	-148.2	-173.5	0	0	110.6
151	S	31.9	Very low	33.5	Very low	74 Å²	74	144.9 Å²	144.9	52%	0.517	73%	0.73	S	S	.	*			cis	-162.9	169.9	-11.4	43.7	0	0	0	0	111.1
152	I	30.2	Very low	33	Very low	153 Å²	153	148 Å²	148	79%	0.785	73%	0.73	S	S	*	*			trans	33.3	129	144.7	-58.7	157.2	0	0	0	118.7
153	G	29.8	Very low	32.4	Very low	69 Å²	69	143.2 Å²	143.2	71%	0.711	72%	0.72	S	S	*	*			cis	144.2	-177.9	1	0	0	0	0	0	113.8
154	H	28.3	Very low	31.8	Very low	160 Å²	160	142.9 Å²	142.9	74%	0.741	72%	0.723	S	S	*	*			trans	70.2	114.2	160.6	-84.9	-45.7	0	0	0	123.4
155	R	27.7	Very low	31.2	Very low	210 Å²	210	141.2 Å²	141.2	79%	0.792	72%	0.715	S	S	*	*				89.8	115.4	122.1	-96.9	178.6	172.2	165.1	-1.5	122.7
156	S	29.7	Very low	30.8	Very low	94 Å²	94	139.8 Å²	139.8	66%	0.657	71%	0.705	S	S	*	*				51.2	143.7	122.1	66.6	0	0	0	0	121.3
157	E	29.1	Very low	30.7	Very low	141 Å²	141	139.5 Å²	139.5	66%	0.659	70%	0.703	S	S	*	*			cis	-167	163	2.7	-124.4	-165.8	134.1	0	0	111
158	R	29.2	Very low	30.4	Very low	192 Å²	192	137.1 Å²	137.1	73%	0.725	70%	0.697	S	S	*	*			trans	65.9	100.1	147.5	-70.7	179.6	-162.8	-176.2	16.2	123.5
159	S	31.1	Very low	30.3	Very low	96 Å²	96	137.5 Å²	137.5	67%	0.671	70%	0.703	S	S	*	*				80.9	159.1	108.1	76.2	0	0	0	0	123.1
160	H	29.1	Very low	30.3	Very low	165 Å²	165	138.1 Å²	138.1	76%	0.764	71%	0.706	S	S	*	*			trans	70.8	153.5	179.3	-74	-107.4	0	0	0	116.3
161	R	27.1	Very low	30.3	Very low	188 Å²	188	135.3 Å²	135.3	71%	0.709	70%	0.7	S	S	*	*			cis	-179.8	154.8	-34.5	-151.1	169.9	-178.3	-132.1	18.1	106.6
162	E	27.3	Very low	30.4	Very low	155 Å²	155	140 Å²	140	72%	0.724	71%	0.714	S	S	*	*			trans	60.4	173.6	176.1	-64.7	127.4	-133.9	0	0	112.7
163	A	30.3	Very low	30.5	Very low	71 Å²	71	137.4 Å²	137.4	59%	0.587	71%	0.71	S	S	*	*			cis	-169.6	158.5	-48.2	0	0	0	0	0	106.3
164	D	28.2	Very low	30.8	Very low	160 Å²	160	141.5 Å²	141.5	86%	0.856	72%	0.715	S	S	*	*			trans	64.4	163.9	166.3	-51.8	-19	0	0	0	115.3
165	D	31.2	Very low	31.1	Very low	110 Å²	110	138.4 Å²	138.4	59%	0.588	72%	0.717	S	S	*	*			cis	-169.5	172.3	-29.9	-173	11.4	0	0	0	106.5
166	Y	32.6	Very low	31.5	Very low	173 Å²	173	135.9 Å²	135.9	68%	0.678	72%	0.719	S	S	*	*			trans	68.4	118.6	174.5	-55.3	-73	0	0	0	116.6
167	D	30.7	Very low	32.1	Very low	137 Å²	137	138.8 Å²	138.8	73%	0.733	73%	0.727	S	S	*	*				114.7	158.3	80.6	-82.8	-6.5	0	0	0	107.8
168	D	33.7	Very low	32.5	Very low	134 Å²	134	140.2 Å²	140.2	72%	0.717	73%	0.732	S	S	*	*			cis	-148.1	-179.8	13.7	-149.9	-10.6	0	0	0	112.3
169	V	33.4	Very low	33.3	Very low	120 Å²	120	138.7 Å²	138.7	73%	0.727	74%	0.736	S	S	*	*			trans	-60.9	179.2	175.1	-61.8	0	0	0	0	114.3
170	D	32.3	Very low	33.7	Very low	131 Å²	131	138.1 Å²	138.1	70%	0.701	73%	0.729	S	S	*	*			cis	-164.6	-174.3	29.6	-158.8	33.3	0	0	0	108.3
171	T	32.6	Very low	34.5	Very low	108 Å²	108	133.7 Å²	133.7	66%	0.663	71%	0.711	S	S	*	*			cis	-153.4	173	12.6	-44	0	0	0	0	110.7
172	E	34.4	Very low	35.9	Very low	173 Å²	173	132.9 Å²	132.9	81%	0.808	72%	0.72	S	S	*	*			trans	-69.7	-172.5	165.5	-44.7	158.7	131.3	0	0	112.4
173	S	32.5	Very low	36.9	Very low	99 Å²	99	131.8 Å²	131.8	69%	0.692	72%	0.72	S	S	*	*			cis	-164.8	176.9	12.2	51.4	0	0	0	0	110.9
174	D	36.2	Very low	37.7	Very low	155 Å²	155	131 Å²	131	83%	0.829	72%	0.718	S	S	*	*			trans	12.1	147.5	149.8	-62.3	-16.3	0	0	0	121
175	A	34	Very low	38.7	Very low	94 Å²	94	132.5 Å²	132.5	78%	0.777	71%	0.712	S	S	*	*				-167.6	-177.2	55.8	0	0	0	0	0	115.3
176	D	36.7	Very low	39.1	Very low	157 Å²	157	133.2 Å²	133.2	84%	0.84	72%	0.723	S	S	*	*			trans	-51.5	151.9	-179.5	-53.9	-77.3	0	0	0	116.5
177	D	42.9	Very low	39.6	Very low	155 Å²	155	132.5 Å²	132.5	83%	0.829	73%	0.729	S	S	*	*				-150.2	132.2	128.7	-141	-20.7	0	0	0	112.4
178	F	36.7	Very low	40.1	Very low	172 Å²	172	130 Å²	130	75%	0.754	73%	0.728	S	S	*	*			trans	-125.1	83.9	-168.1	-179.7	-105.8	0	0	0	110.7	V180	F178-V180 HydrophobicContact CD1-CG2 3.67Å; F178-V180 HydrophobicContact CE1-CG2 3.3Å; F178-V180 HydrophobicContact CZ-CG2 3.99Å; F178-V180 PolarHBondContact O-N 2.78Å; F178-V180 VanDerWaalsContact O-N 3.08Å
179	I	46.9	Very low	40.3	Very low	159 Å²	159	131.9 Å²	131.9	82%	0.815	73%	0.732	S	S	*	*			trans	-78	98.8	-174.8	-56.4	-179.3	0	0	0	111.1
180	V	38.3	Very low	40.3	Very low	85 Å²	85	135 Å²	135	52%	0.515	74%	0.736	S	S	.	*			trans	-96.6	154.6	156.2	-161.6	0	0	0	0	108.1	F178	F178-V180 HydrophobicContact CD1-CG2 3.67Å; F178-V180 HydrophobicContact CE1-CG2 3.3Å; F178-V180 HydrophobicContact CZ-CG2 3.99Å; F178-V180 PolarHBondContact O-N 2.78Å; F178-V180 VanDerWaalsContact O-N 3.08Å
181	D	47.4	Very low	40.3	Very low	71 Å²	71	138.8 Å²	138.8	38%	0.38	75%	0.746	S	S	.	*			trans	-76.7	157.1	174.8	80.1	-56.6	0	0	0	112.5	N183 G184 R185	D181-N183 PolarHBondContact O-N 2.88Å; D181-N183 WeakPolarHBondContact OD2-CB 3.3Å; D181-N183 PolarHBondContact OD2-N 2.83Å; D181-G184 PolarHBondContact O-N 2.85Å; D181-G184 WeakPolarHBondContact OD1-CA 3.34Å; D181-G184 PolarHBondContact OD1-N 2.78Å; D181-G184 VanDerWaalsContact OD1-N 3.1Å; D181-R185 PolarHBondContact OD1-N 3.07Å
182	D	55.8	Low	40.2	Very low	171 Å²	171	143.8 Å²	143.8	91%	0.914	76%	0.758	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.2	-5	-179.5	-70.2	-44.7	0	0	0	115.1
183	N	47.9	Very low	40.1	Very low	133 Å²	133	145.5 Å²	145.5	71%	0.711	76%	0.763	S	S	*	*	T	Hydrogen-bonded Turn	trans	-119	0.1	177.1	-59.3	-84.7	0	0	0	114.4	D181	D181-N183 PolarHBondContact O-N 2.88Å; D181-N183 WeakPolarHBondContact OD2-CB 3.3Å; D181-N183 PolarHBondContact OD2-N 2.83Å
184	G	47.9	Very low	40.2	Very low	54 Å²	54	152.6 Å²	152.6	56%	0.557	78%	0.775	S	S	*	*			trans	63.7	45.5	176.8	0	0	0	0	0	114.5	D181	D181-G184 PolarHBondContact O-N 2.85Å; D181-G184 WeakPolarHBondContact OD1-CA 3.34Å; D181-G184 PolarHBondContact OD1-N 2.78Å; D181-G184 VanDerWaalsContact OD1-N 3.1Å
185	R	47.6	Very low	40	Very low	191 Å²	191	156.3 Å²	156.3	72%	0.721	78%	0.777	S	S	*	*			trans	-133.1	116.6	-178.5	-70.9	-171.9	174.6	-155.7	-2.6	112.9	D181	D181-R185 PolarHBondContact OD1-N 3.07Å
186	P	41.5	Very low	40	Very low	126 Å²	126	157.9 Å²	157.9	82%	0.818	78%	0.779	S	S	*	*			trans	-72.9	147.4	176	31.4	-35.1	0	0	0	112.2
187	I	41.4	Very low	39.7	Very low	158 Å²	158	157.7 Å²	157.7	81%	0.81	78%	0.777	S	S	*	*			trans	-127.7	96.4	175.4	-56.8	177.5	0	0	0	106.2
188	A	41.4	Very low	39.4	Very low	85 Å²	85	160 Å²	160	70%	0.702	78%	0.78	S	S	*	*				72.9	129.4	71.2	0	0	0	0	0	112.7
189	E	37.7	Very low	39.4	Very low	173 Å²	173	158.3 Å²	158.3	81%	0.808	78%	0.784	S	S	*	*			cis	-169.6	141.5	-8.7	-160.8	-174.9	-118.7	0	0	109.9
190	K	33.3	Very low	39.5	Very low	185 Å²	185	155 Å²	155	80%	0.804	77%	0.768	S	S	*	*			trans	172.1	125.2	135.8	-97	158.6	-172.4	175.4	0	115.5
191	K	33.9	Very low	40.1	Very low	211 Å²	211	154.7 Å²	154.7	92%	0.917	77%	0.774	S	S	*	*			trans	54.6	139.9	157.4	-64.6	-170.4	173.6	-173.6	0	118.9
192	K	29.9	Very low	40.4	Very low	212 Å²	212	155.2 Å²	155.2	92%	0.922	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-103.3	134.1	-164.4	-57.8	170.1	-179.9	175.4	0	111.7
193	K	31.9	Very low	40.5	Very low	210 Å²	210	151.9 Å²	151.9	91%	0.913	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-85.5	141	149.1	-74.9	-167.3	173.2	-168.6	0	108.6
194	R	33.9	Very low	40.8	Very low	248 Å²	248	150.3 Å²	150.3	94%	0.936	75%	0.753	S	S	*	*	P	Polyproline II helix	trans	-75.8	148.8	161.6	-91.8	-177.7	164	-173.7	-4.2	108.4
195	R	32.8	Very low	41.2	Very low	233 Å²	233	151.2 Å²	151.2	88%	0.879	74%	0.743	S	S	*	*	P	Polyproline II helix	trans	-86.2	133.4	170.1	-70	178.7	169.8	-173.7	-5.6	109.3
196	P	34	Very low	41.8	Very low	126 Å²	126	143.4 Å²	143.4	82%	0.818	72%	0.722	S	S	*	*	P	Polyproline II helix	trans	-72.7	150.2	153.4	32.2	-31	0	0	0	109.5
197	I	31	Very low	42.5	Very low	154 Å²	154	141.5 Å²	141.5	79%	0.79	70%	0.702	S	S	*	*			trans	-121.3	105.9	167.5	-61.8	171.6	0	0	0	105.4
198	F	36.8	Very low	43	Very low	203 Å²	203	139.5 Å²	139.5	89%	0.89	69%	0.693	S	S	*	*			trans	-171.1	151.6	149.3	-116.1	-77.4	0	0	0	109.3
199	T	36.3	Very low	44	Very low	136 Å²	136	140.9 Å²	140.9	83%	0.834	69%	0.687	S	S	*	*			trans	-106.7	104.5	171.9	48.6	0	0	0	0	108.1
200	D	48	Very low	44.7	Very low	91 Å²	91	139 Å²	139	49%	0.487	68%	0.677	S	S	.	*			trans	-101.5	113	176.5	-177.2	3.1	0	0	0	110.2	S202 L203 Q204	D200-S202 VanDerWaalsContact C-N 3.31Å; D200-S202 WeakPolarHBondContact OD1-CB 3.49Å; D200-S202 PolarHBondContact OD1-N 2.72Å; D200-L203 HydrophobicContact CB-CB 3.94Å; D200-L203 PolarHBondContact O-N 3.07Å; D200-Q204 PolarHBondContact O-N 3Å
201	A	51.1	Low	44.9	Very low	77 Å²	77	133.2 Å²	133.2	64%	0.636	67%	0.67	S	S	*	*	H	α-helix	trans	-67.9	-30.1	178	0	0	0	0	0	112.3	L203 Q204 E205	A201-L203 VanDerWaalsContact C-N 3.29Å; A201-L203 PolarHBondContact O-N 3.03Å; A201-Q204 PolarHBondContact O-N 3.21Å; A201-E205 VanDerWaalsContact O-CB 3.24Å; A201-E205 WeakPolarHBondContact O-CB 3.17Å; A201-E205 PolarHBondContact O-N 3.05Å
202	S	55.4	Low	45.2	Very low	82 Å²	82	128.7 Å²	128.7	57%	0.573	66%	0.66	S	S	*	*	H	α-helix	trans	-73.9	-21.5	176.8	-64.1	0	0	0	0	112.7	D200 G206	D200-S202 VanDerWaalsContact C-N 3.31Å; D200-S202 WeakPolarHBondContact OD1-CB 3.49Å; D200-S202 PolarHBondContact OD1-N 2.72Å; S202-G206 PolarHBondContact O-N 2.86Å
203	L	57.5	Low	45.7	Very low	101 Å²	101	125.2 Å²	125.2	53%	0.529	65%	0.651	S	S	.	*	H	α-helix	trans	-78.7	-41.8	173.1	-144.8	168.3	0	0	0	110.5	D200 A201 G206 Q207	D200-L203 HydrophobicContact CB-CB 3.94Å; D200-L203 PolarHBondContact O-N 3.07Å; A201-L203 VanDerWaalsContact C-N 3.29Å; A201-L203 PolarHBondContact O-N 3.03Å; L203-G206 PolarHBondContact O-N 3.3Å; L203-Q207 HydrophobicContact CD2-CG 4.26Å; L203-Q207 WeakPolarHBondContact O-CG 3.27Å; L203-Q207 PolarHBondContact O-N 2.65Å
204	Q	53.9	Low	46.4	Very low	100 Å²	100	120.2 Å²	120.2	47%	0.467	63%	0.63	S	S	.	*	H	α-helix	trans	-62.2	-45.7	170.5	-173	65.9	61.9	0	0	111.4	D200 A201 G206 Q207 D208	D200-Q204 PolarHBondContact O-N 3Å; A201-Q204 PolarHBondContact O-N 3.21Å; Q204-G206 VanDerWaalsContact C-N 3.3Å; Q204-G206 PolarHBondContact O-N 2.68Å; Q204-Q207 CarbonylContact O-C 3.56Å; Q204-Q207 WeakPolarHBondContact O-CA 3.12Å; Q204-Q207 WeakPolarHBondContact O-CB 3.3Å; Q204-Q207 PolarHBondContact O-N 3.44Å; Q204-D208 PolarHBondContact NE2-OD1 2.9Å; Q204-D208 WeakPolarHBondContact O-CB 3.18Å; Q204-D208 PolarHBondContact O-N 2.99Å
205	E	55.5	Low	46.9	Very low	74 Å²	74	113.5 Å²	113.5	35%	0.346	61%	0.613	S	S	.	*	H	α-helix	trans	-62.7	-35.9	176.9	-175.3	166.6	-136.2	0	0	112	A201 D208 I209 K908	A201-E205 VanDerWaalsContact O-CB 3.24Å; A201-E205 WeakPolarHBondContact O-CB 3.17Å; A201-E205 PolarHBondContact O-N 3.05Å; E205-D208 PolarHBondContact O-N 3.33Å; E205-I209 HydrophobicContact CG-CD1 3.96Å; E205-I209 WeakPolarHBondContact O-CB 3.39Å; E205-I209 WeakPolarHBondContact O-CD1 3.45Å; E205-I209 WeakPolarHBondContact O-CG1 3.38Å; E205-I209 PolarHBondContact O-N 3.34Å; E205-K908 IonicContact OE1-NZ 2.74Å; E205-K908 PolarHBondContact OE1-NZ 2.81Å
206	G	60.6	Low	47.7	Very low	27 Å²	27	106.7 Å²	106.7	28%	0.278	59%	0.588	S	S	.	*	H	α-helix	trans	-64.8	-38.2	169.3	0	0	0	0	0	113.5	S202 L203 Q204 F210	S202-G206 PolarHBondContact O-N 2.86Å; L203-G206 PolarHBondContact O-N 3.3Å; Q204-G206 VanDerWaalsContact C-N 3.3Å; Q204-G206 PolarHBondContact O-N 2.68Å; G206-F210 WeakPolarHBondContact O-CB 3.12Å; G206-F210 WeakPolarHBondContact O-CD2 3.41Å; G206-F210 PolarHBondContact O-N 3.38Å
207	Q	55.5	Low	48.5	Very low	86 Å²	86	106 Å²	106	40%	0.402	58%	0.577	S	S	.	*	H	α-helix	trans	-70.1	-38	175.5	-72.9	175.1	-47.7	0	0	112	L203 Q204 I209 G211	L203-Q207 HydrophobicContact CD2-CG 4.26Å; L203-Q207 WeakPolarHBondContact O-CG 3.27Å; L203-Q207 PolarHBondContact O-N 2.65Å; Q204-Q207 CarbonylContact O-C 3.56Å; Q204-Q207 WeakPolarHBondContact O-CA 3.12Å; Q204-Q207 WeakPolarHBondContact O-CB 3.3Å; Q204-Q207 PolarHBondContact O-N 3.44Å; Q207-I209 VanDerWaalsContact C-N 3.34Å; Q207-G211 WeakPolarHBondContact O-CA 3.42Å; Q207-G211 PolarHBondContact O-N 2.73Å
208	D	53.5	Low	49.3	Very low	116 Å²	116	101.5 Å²	101.5	62%	0.62	56%	0.555	S	S	*	*	H	α-helix	trans	-71.7	-27.6	178.2	-63.2	-11.4	0	0	0	112	Q204 E205	Q204-D208 PolarHBondContact NE2-OD1 2.9Å; Q204-D208 WeakPolarHBondContact O-CB 3.18Å; Q204-D208 PolarHBondContact O-N 2.99Å; E205-D208 PolarHBondContact O-N 3.33Å
209	I	62.4	Low	49.9	Very low	114 Å²	114	97.7 Å²	97.7	59%	0.585	54%	0.538	S	S	*	.	H	α-helix	trans	-81.9	-41.7	174.2	-70.5	167.1	0	0	0	112.4	E205 Q207	E205-I209 HydrophobicContact CG-CD1 3.96Å; E205-I209 WeakPolarHBondContact O-CB 3.39Å; E205-I209 WeakPolarHBondContact O-CD1 3.45Å; E205-I209 WeakPolarHBondContact O-CG1 3.38Å; E205-I209 PolarHBondContact O-N 3.34Å; Q207-I209 VanDerWaalsContact C-N 3.34Å
210	F	51.8	Low	50.6	Low	132 Å²	132	94.6 Å²	94.6	58%	0.579	52%	0.522	S	S	*	.	H	α-helix	trans	-103	-6.2	-171.8	-67	-71.1	0	0	0	115.4	G206 V212	G206-F210 WeakPolarHBondContact O-CB 3.12Å; G206-F210 WeakPolarHBondContact O-CD2 3.41Å; G206-F210 PolarHBondContact O-N 3.38Å; F210-V212 VanDerWaalsContact C-N 3.25Å; F210-V212 PolarHBondContact O-N 3.27Å
211	G	36.8	Very low	50.3	Low	65 Å²	65	96.1 Å²	96.1	67%	0.67	52%	0.524	S	S	*	.			trans	67.6	-3.6	158	0	0	0	0	0	119	Q207	Q207-G211 WeakPolarHBondContact O-CA 3.42Å; Q207-G211 PolarHBondContact O-N 2.73Å
212	V	41.3	Very low	50	Low	116 Å²	116	100.3 Å²	100.3	70%	0.703	52%	0.524	S	S	*	.	S	Bend	trans	-142.8	135.4	-175.8	-166.4	0	0	0	0	111.7	F210 F214	F210-V212 VanDerWaalsContact C-N 3.25Å; F210-V212 PolarHBondContact O-N 3.27Å; V212-F214 PolarHBondContact O-N 3.04Å
213	D	40.5	Very low	49.4	Very low	139 Å²	139	103.6 Å²	103.6	74%	0.743	53%	0.531	S	S	*	.			trans	-62	98	168.5	-80.1	-39.2	0	0	0	111	D215	D213-D215 PolarHBondContact O-N 2.67Å
214	F	46.4	Very low	48.4	Very low	104 Å²	104	107 Å²	107	46%	0.456	54%	0.544	S	S	.	.			trans	-89.8	81.8	179.5	-147.9	-67.5	0	0	0	111.1	V212 Y216 F219	V212-F214 PolarHBondContact O-N 3.04Å; F214-Y216 HydrophobicContact CB-CE2 4.13Å; F214-Y216 HydrophobicContact CD1-CD1 4.01Å; F214-Y216 AromaticContact CD1-CD2 3.85Å; F214-Y216 HydrophobicContact CD1-CD2 3.85Å; F214-Y216 AromaticContact CD1-CE1 3.61Å; F214-Y216 HydrophobicContact CD1-CE1 3.61Å; F214-Y216 AromaticContact CD1-CE2 3.45Å; F214-Y216 HydrophobicContact CD1-CE2 3.45Å; F214-Y216 VanDerWaalsContact CD1-CE2 3.45Å; F214-Y216 HydrophobicContact CD1-CG 4.11Å; F214-Y216 AromaticContact CD1-CZ 3.3Å; F214-Y216 AromaticContact CE1-CD1 3.96Å; F214-Y216 HydrophobicContact CE1-CD1 3.96Å; F214-Y216 AromaticContact CE1-CE1 3.45Å; F214-Y216 HydrophobicContact CE1-CE1 3.45Å; F214-Y216 VanDerWaalsContact CE1-CE1 3.45Å; F214-Y216 HydrophobicContact CE1-CE2 4.19Å; F214-Y216 AromaticContact CE1-CZ 3.57Å; F214-Y216 HydrophobicContact CG-CE2 4.04Å; F214-Y216 HydrophobicContact CZ-CE1 4.44Å; F214-Y216 WeakPolarHBondContact O-CD2 3.27Å; F214-Y216 PolarHBondContact O-N 2.67Å; F214-Y216 VanDerWaalsContact O-N 3.15Å; F214-F219 HydrophobicContact CE1-CD2 4.04Å; F214-F219 AromaticContact CE1-CE2 3.61Å; F214-F219 HydrophobicContact CE1-CE2 3.61Å; F214-F219 HydrophobicContact CE1-CZ 4.43Å; F214-F219 AromaticContact CZ-CE2 3.87Å; F214-F219 HydrophobicContact CZ-CE2 3.87Å; F214-F219 HydrophobicContact CZ-CZ 4.33Å
215	D	43.5	Very low	47.3	Very low	108 Å²	108	109.2 Å²	109.2	58%	0.578	56%	0.559	S	S	*	*			trans	-74	99.9	177.6	-165	-8.5	0	0	0	111.3	D213 D217 D218	D213-D215 PolarHBondContact O-N 2.67Å; D215-D217 VanDerWaalsContact C-N 3.28Å; D215-D217 PolarHBondContact O-N 2.87Å; D215-D217 PolarHBondContact OD1-N 3.45Å; D215-D218 WeakPolarHBondContact O-CB 3.35Å; D215-D218 PolarHBondContact O-N 3.29Å
216	Y	49.4	Very low	46.2	Very low	90 Å²	90	112.7 Å²	112.7	35%	0.353	58%	0.58	S	S	.	*	G	3₁₀ helix	trans	-72.4	-17	-179	-75.2	-83.7	0	0	0	113.5	F214 D218 F219 K1006	F214-Y216 HydrophobicContact CB-CE2 4.13Å; F214-Y216 HydrophobicContact CD1-CD1 4.01Å; F214-Y216 AromaticContact CD1-CD2 3.85Å; F214-Y216 HydrophobicContact CD1-CD2 3.85Å; F214-Y216 AromaticContact CD1-CE1 3.61Å; F214-Y216 HydrophobicContact CD1-CE1 3.61Å; F214-Y216 AromaticContact CD1-CE2 3.45Å; F214-Y216 HydrophobicContact CD1-CE2 3.45Å; F214-Y216 VanDerWaalsContact CD1-CE2 3.45Å; F214-Y216 HydrophobicContact CD1-CG 4.11Å; F214-Y216 AromaticContact CD1-CZ 3.3Å; F214-Y216 AromaticContact CE1-CD1 3.96Å; F214-Y216 HydrophobicContact CE1-CD1 3.96Å; F214-Y216 AromaticContact CE1-CE1 3.45Å; F214-Y216 HydrophobicContact CE1-CE1 3.45Å; F214-Y216 VanDerWaalsContact CE1-CE1 3.45Å; F214-Y216 HydrophobicContact CE1-CE2 4.19Å; F214-Y216 AromaticContact CE1-CZ 3.57Å; F214-Y216 HydrophobicContact CG-CE2 4.04Å; F214-Y216 HydrophobicContact CZ-CE1 4.44Å; F214-Y216 WeakPolarHBondContact O-CD2 3.27Å; F214-Y216 PolarHBondContact O-N 2.67Å; F214-Y216 VanDerWaalsContact O-N 3.15Å; Y216-D218 PolarHBondContact O-N 3.26Å; Y216-F219 PolarHBondContact O-N 2.95Å; Y216-K1006 PolarHBondContact OH-NZ 3.46Å
217	D	51.3	Low	45	Very low	112 Å²	112	122.6 Å²	122.6	60%	0.599	61%	0.611	S	S	*	*	G	3₁₀ helix	trans	-70.2	-9.6	174.1	-80.3	-0.1	0	0	0	112.7	D215 K221	D215-D217 VanDerWaalsContact C-N 3.28Å; D215-D217 PolarHBondContact O-N 2.87Å; D215-D217 PolarHBondContact OD1-N 3.45Å; D217-K221 PolarHBondContact O-NZ 3.37Å
218	D	47.9	Very low	43.7	Very low	59 Å²	59	127.5 Å²	127.5	32%	0.316	63%	0.634	S	S	.	*	G	3₁₀ helix	trans	-88	-12.7	172.3	-151.4	48.1	0	0	0	112.1	D215 Y216 Y222 K260	D215-D218 WeakPolarHBondContact O-CB 3.35Å; D215-D218 PolarHBondContact O-N 3.29Å; Y216-D218 PolarHBondContact O-N 3.26Å; D218-Y222 WeakPolarHBondContact O-CD2 3.26Å; D218-Y222 WeakPolarHBondContact O-CE2 3.45Å; D218-K260 IonicContact OD2-NZ 2.84Å; D218-K260 PolarHBondContact OD2-NZ 3.32Å
219	F	49	Very low	42.5	Very low	122 Å²	122	128.9 Å²	128.9	54%	0.535	64%	0.641	S	S	.	*	T	Hydrogen-bonded Turn	trans	-91.9	-38.9	178.1	-93.8	-90.7	0	0	0	113.4	F214 Y216 K221 Y222	F214-F219 HydrophobicContact CE1-CD2 4.04Å; F214-F219 AromaticContact CE1-CE2 3.61Å; F214-F219 HydrophobicContact CE1-CE2 3.61Å; F214-F219 HydrophobicContact CE1-CZ 4.43Å; F214-F219 AromaticContact CZ-CE2 3.87Å; F214-F219 HydrophobicContact CZ-CE2 3.87Å; F214-F219 HydrophobicContact CZ-CZ 4.33Å; Y216-F219 PolarHBondContact O-N 2.95Å; F219-K221 PolarHBondContact O-N 3.4Å; F219-Y222 PolarHBondContact O-N 3.34Å
220	S	51.5	Low	40.9	Very low	72 Å²	72	131.2 Å²	131.2	50%	0.503	66%	0.655	S	S	.	*	G	3₁₀ helix	trans	-64.1	-19	178.9	49.3	0	0	0	0	113.8	Y222	S220-Y222 VanDerWaalsContact C-N 3.32Å; S220-Y222 PolarHBondContact O-N 3.27Å
221	K	42.4	Very low	39.9	Very low	123 Å²	123	130.8 Å²	130.8	54%	0.535	67%	0.668	S	S	.	*	G	3₁₀ helix	trans	-86.6	9	177.3	-62.1	-168	-171.9	73.6	0	115	D217 F219	D217-K221 PolarHBondContact O-NZ 3.37Å; F219-K221 PolarHBondContact O-N 3.4Å
222	Y	44.2	Very low	39.7	Very low	164 Å²	164	136.8 Å²	136.8	64%	0.643	68%	0.678	S	S	*	*	G	3₁₀ helix	trans	-121.8	7.8	178.5	-63.2	-51.7	0	0	0	113.9	D218 F219 S220	D218-Y222 WeakPolarHBondContact O-CD2 3.26Å; D218-Y222 WeakPolarHBondContact O-CE2 3.45Å; F219-Y222 PolarHBondContact O-N 3.34Å; S220-Y222 VanDerWaalsContact C-N 3.32Å; S220-Y222 PolarHBondContact O-N 3.27Å
223	E	43.1	Very low	39.3	Very low	151 Å²	151	134.4 Å²	134.4	71%	0.706	68%	0.678	S	S	*	*	S	Bend	trans	-109.3	-1.2	169.4	-68.2	-170	169.9	0	0	113.3	K286	E223-K286 IonicContact OE1-NZ 2.78Å; E223-K286 PolarHBondContact OE1-NZ 2.87Å; E223-K286 IonicContact OE2-NZ 2.6Å; E223-K286 PolarHBondContact OE2-NZ 2.79Å
224	E	35.9	Very low	38.8	Very low	173 Å²	173	135.9 Å²	135.9	81%	0.808	69%	0.686	S	S	*	*	S	Bend	trans	-112.5	-6.1	-177	-75.5	-172.2	147.5	0	0	115.9
225	D	31.3	Very low	38.1	Very low	146 Å²	146	138.9 Å²	138.9	78%	0.781	70%	0.701	S	S	*	*	S	Bend	trans	-110.8	6.1	-163.2	-114.7	6	0	0	0	115.2
226	D	32.7	Very low	37.7	Very low	147 Å²	147	143.6 Å²	143.6	79%	0.786	71%	0.712	S	S	*	*	S	Bend	trans	-132.7	15.2	-166.6	-106.1	-39	0	0	0	115.8
227	Y	34.4	Very low	37	Very low	235 Å²	235	145.8 Å²	145.8	92%	0.922	73%	0.73	S	S	*	*			trans	-145.1	49.2	175.4	-75.8	-66.2	0	0	0	114.7
228	E	28.6	Very low	36.2	Very low	189 Å²	189	149 Å²	149	88%	0.883	74%	0.741	S	S	*	*			trans	-118.7	134.3	166.4	-74.3	-161.2	146.3	0	0	113.1
229	D	28.3	Very low	35.6	Very low	145 Å²	145	152.5 Å²	152.5	78%	0.775	76%	0.76	S	S	*	*			trans	60.7	104.7	155.6	-149.3	12.6	0	0	0	120.8
230	D	28	Very low	34.9	Very low	164 Å²	164	154.2 Å²	154.2	88%	0.877	77%	0.774	S	S	*	*			trans	-165	49.8	153.8	-125.8	-12.9	0	0	0	111.6
231	S	32.2	Very low	34.1	Very low	122 Å²	122	154 Å²	154	85%	0.853	78%	0.783	S	S	*	*			trans	-157.9	42.1	176.1	-90.6	0	0	0	0	117.4
232	E	32.3	Very low	33.6	Very low	191 Å²	191	155.3 Å²	155.3	89%	0.893	80%	0.801	S	S	*	*			trans	-125.3	144.6	147.4	-63.6	-169.9	175.1	0	0	107.1
233	G	33.2	Very low	33.1	Very low	67 Å²	67	151.1 Å²	151.1	69%	0.691	81%	0.808	S	S	*	*			cis	168.1	144.5	-2.9	0	0	0	0	0	109.2
234	D	29.7	Very low	32.6	Very low	169 Å²	169	151 Å²	151	90%	0.904	81%	0.812	S	S	*	*			trans	60.5	129	164.3	-68	-20.8	0	0	0	122.5
235	E	32.2	Very low	32.5	Very low	167 Å²	167	148.5 Å²	148.5	78%	0.78	80%	0.804	S	S	*	*			trans	84.3	95.7	131.4	-150.4	167	-134.7	0	0	123.5
236	Y	34.2	Very low	32.5	Very low	208 Å²	208	147 Å²	147	82%	0.816	80%	0.8	S	S	*	*			trans	65.1	160.2	141.5	-71.7	-54.8	0	0	0	125
237	D	35.4	Very low	32.3	Very low	136 Å²	136	150.8 Å²	150.8	73%	0.727	80%	0.804	S	S	*	*			trans	72.2	93.6	161.1	-67.5	-0.7	0	0	0	122.9
238	E	33.3	Very low	32.3	Very low	178 Å²	178	145.6 Å²	145.6	83%	0.832	80%	0.796	S	S	*	*				60.6	158.7	119	-67.2	-165.4	149.3	0	0	124.2
239	D	35	Very low	32.4	Very low	134 Å²	134	146.6 Å²	146.6	72%	0.717	80%	0.798	S	S	*	*			trans	75.9	84.5	159.5	-90.2	9	0	0	0	122.8
240	L	35.9	Very low	32.6	Very low	158 Å²	158	148.8 Å²	148.8	83%	0.827	80%	0.8	S	S	*	*				57.4	104.8	114.5	-65.6	175.7	0	0	0	120.5
241	G	34.4	Very low	32.9	Very low	67 Å²	67	150.5 Å²	150.5	69%	0.691	80%	0.8	S	S	*	*				110.4	144.1	85.9	0	0	0	0	0	121
242	V	31.6	Very low	32.8	Very low	150 Å²	150	154.3 Å²	154.3	91%	0.909	80%	0.801	S	S	*	*			trans	59.1	102.2	152.6	-168.4	0	0	0	0	116.8
243	G	34	Very low	32.7	Very low	76 Å²	76	150 Å²	150	78%	0.784	80%	0.798	S	S	*	*				105	170.6	87.5	0	0	0	0	0	111
244	D	32.3	Very low	32.9	Very low	148 Å²	148	155.3 Å²	155.3	79%	0.791	81%	0.81	S	S	*	*			cis	-160.8	167.4	-1.1	-170.1	18.9	0	0	0	110.5
245	D	32.8	Very low	33.1	Very low	121 Å²	121	157 Å²	157	65%	0.647	81%	0.809	S	S	*	*			trans	58.8	94.7	149.7	-125.2	30.4	0	0	0	122.9
246	T	31.4	Very low	33.2	Very low	114 Å²	114	158.8 Å²	158.8	70%	0.699	81%	0.814	S	S	*	*				81.9	148.9	128.1	73.8	0	0	0	0	125.2
247	R	29.1	Very low	33.6	Very low	228 Å²	228	158.5 Å²	158.5	86%	0.86	82%	0.817	S	S	*	*			trans	89.2	87.3	135.6	-128.6	171.4	-174	170.7	3.1	121.4
248	V	34.9	Very low	33.8	Very low	126 Å²	126	158.4 Å²	158.4	76%	0.764	82%	0.821	S	S	*	*			trans	52.6	107.2	132.1	-174.3	0	0	0	0	118.2
249	K	29.9	Very low	34.3	Very low	210 Å²	210	156.3 Å²	156.3	91%	0.913	82%	0.82	S	S	*	*			trans	-154.6	157.5	140.4	-105.2	135.7	-170.5	170.3	0	112.4
250	K	33.1	Very low	35	Very low	191 Å²	191	157 Å²	157	83%	0.83	82%	0.817	S	S	*	*			trans	-95.9	163.1	-173.6	-62.8	-178.3	175.8	-177.3	0	112.4
251	K	33.2	Very low	35.9	Very low	200 Å²	200	156.1 Å²	156.1	87%	0.87	81%	0.806	S	S	*	*			trans	81.8	148.4	170.2	-50.1	178.3	-180	-177.5	0	113.3
252	K	30.9	Very low	37.7	Very low	201 Å²	201	156.3 Å²	156.3	87%	0.874	79%	0.794	S	S	*	*			cis	-122.9	168.3	14.9	-68.1	172.7	179.9	172.4	0	112.9
253	A	31	Very low	39.6	Very low	101 Å²	101	151.7 Å²	151.7	84%	0.835	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-79.2	142.4	178.9	0	0	0	0	0	112.7
254	L	36.1	Very low	41.4	Very low	178 Å²	178	152.9 Å²	152.9	93%	0.932	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-100.5	149.4	160.6	-85.2	146.5	0	0	0	109.2
255	K	34.5	Very low	43.4	Very low	204 Å²	204	150.2 Å²	150.2	89%	0.887	73%	0.733	S	S	*	*	P	Polyproline II helix	trans	-75.5	142.6	-173.7	-63	176.4	179.7	178.1	0	110.4	K257	K255-K257 PolarHBondContact O-N 2.93Å
256	K	35.2	Very low	45.6	Very low	206 Å²	206	149.1 Å²	149.1	90%	0.896	73%	0.726	S	S	*	*	P	Polyproline II helix	trans	-59.8	122.4	162.4	-74.6	-177.8	172.2	-177.4	0	108.6
257	K	41	Very low	47.7	Very low	202 Å²	202	147.7 Å²	147.7	88%	0.878	71%	0.709	S	S	*	*	P	Polyproline II helix	trans	-62.4	143	154.1	-78.6	-174.4	173.7	-176.7	0	107.4	K255	K255-K257 PolarHBondContact O-N 2.93Å
258	V	40.3	Very low	50.3	Low	134 Å²	134	142 Å²	142	81%	0.812	69%	0.692	S	S	*	*	P	Polyproline II helix	trans	-75.9	131.7	166.2	177.8	0	0	0	0	106.7	K260	V258-K260 PolarHBondContact O-N 2.94Å
259	V	44.6	Very low	52.4	Low	134 Å²	134	140.7 Å²	140.7	81%	0.812	69%	0.686	S	S	*	*			trans	-72.4	112.8	169.3	179.2	0	0	0	0	106.2	K261	V259-K261 PolarHBondContact O-N 3.21Å
260	K	49	Very low	54.8	Low	147 Å²	147	133.6 Å²	133.6	64%	0.639	66%	0.663	S	S	*	*	P	Polyproline II helix	trans	-59.6	130.8	166.5	-73	-175.3	-179.1	179.1	0	106.7	D218 V258	D218-K260 IonicContact OD2-NZ 2.84Å; D218-K260 PolarHBondContact OD2-NZ 3.32Å; V258-K260 PolarHBondContact O-N 2.94Å
261	K	55.1	Low	57	Low	141 Å²	141	129.2 Å²	129.2	61%	0.613	65%	0.645	S	S	*	*	P	Polyproline II helix	trans	-59	141.5	166.6	-84	-170.1	167.4	-154.6	0	109	V259 D265 I266	V259-K261 PolarHBondContact O-N 3.21Å; K261-D265 HydrophobicContact CB-CB 3.87Å; K261-D265 HydrophobicContact CD-CB 4.05Å; K261-D265 WeakPolarHBondContact CD-O 3.35Å; K261-D265 WeakPolarHBondContact CE-O 3.28Å; K261-D265 HydrophobicContact CG-CB 3.88Å; K261-D265 PolarHBondContact NZ-O 3.45Å; K261-I266 HydrophobicContact CB-CD1 3.95Å; K261-I266 HydrophobicContact CB-CG1 3.95Å; K261-I266 HydrophobicContact CD-CD1 4.37Å; K261-I266 HydrophobicContact CD-CG1 3.71Å
262	T	71.2	Confident	59.3	Low	70 Å²	70	120 Å²	120	43%	0.429	61%	0.605	S	S	.	*	P	Polyproline II helix	trans	-75.6	167.9	166.6	69	0	0	0	0	110.1	F264 D265 I266	T262-F264 PolarHBondContact O-N 3.12Å; T262-F264 PolarHBondContact OG1-N 3.15Å; T262-D265 WeakPolarHBondContact CB-OD2 3.19Å; T262-D265 PolarHBondContact N-OD2 3.21Å; T262-D265 WeakPolarHBondContact O-CB 3.27Å; T262-D265 PolarHBondContact O-N 3.49Å; T262-D265 PolarHBondContact OG1-N 2.99Å; T262-D265 PolarHBondContact OG1-OD2 2.9Å; T262-I266 WeakPolarHBondContact O-CG1 3.39Å
263	I	71.8	Confident	61.6	Low	54 Å²	54	117.8 Å²	117.8	28%	0.277	60%	0.596	S	S	.	*	G	3₁₀ helix	trans	-62	-31.7	175.2	-159.4	177.3	0	0	0	111.5	D265 I266 Y267 L272 F277	I263-D265 VanDerWaalsContact C-N 3.27Å; I263-D265 PolarHBondContact O-N 3.34Å; I263-I266 PolarHBondContact O-N 3.18Å; I263-I266 VanDerWaalsContact O-N 3.14Å; I263-Y267 HydrophobicContact CD1-CD2 4.44Å; I263-Y267 HydrophobicContact CG1-CD2 3.69Å; I263-Y267 HydrophobicContact CG1-CE2 4.14Å; I263-Y267 PolarHBondContact O-N 2.95Å; I263-L272 HydrophobicContact CD1-CD2 3.84Å; I263-L272 HydrophobicContact CG1-CD2 3.91Å; I263-L272 HydrophobicContact CG2-CD2 4.43Å; I263-F277 HydrophobicContact CD1-CB 4.27Å
264	F	72.2	Confident	63.8	Low	101 Å²	101	119.7 Å²	119.7	44%	0.443	58%	0.582	S	S	.	*	G	3₁₀ helix	trans	-71.5	-13.2	174.6	-45.2	-73.6	0	0	0	114.1	T262 L272 D279	T262-F264 PolarHBondContact O-N 3.12Å; T262-F264 PolarHBondContact OG1-N 3.15Å; F264-L272 HydrophobicContact CD1-CD1 3.54Å; F264-L272 HydrophobicContact CE1-CD1 4Å; F264-D279 WeakPolarHBondContact CZ-OD1 3.46Å; F264-D279 WeakPolarHBondContact CZ-OD2 3.46Å
265	D	74.5	Confident	65.7	Low	91 Å²	91	112.4 Å²	112.4	49%	0.487	55%	0.55	S	S	.	.	G	3₁₀ helix	trans	-92.9	4.1	171.1	-63.4	-76.6	0	0	0	112.6	K261 T262 I263	K261-D265 HydrophobicContact CB-CB 3.87Å; K261-D265 HydrophobicContact CD-CB 4.05Å; K261-D265 WeakPolarHBondContact CD-O 3.35Å; K261-D265 WeakPolarHBondContact CE-O 3.28Å; K261-D265 HydrophobicContact CG-CB 3.88Å; K261-D265 PolarHBondContact NZ-O 3.45Å; T262-D265 WeakPolarHBondContact CB-OD2 3.19Å; T262-D265 PolarHBondContact N-OD2 3.21Å; T262-D265 WeakPolarHBondContact O-CB 3.27Å; T262-D265 PolarHBondContact O-N 3.49Å; T262-D265 PolarHBondContact OG1-N 2.99Å; T262-D265 PolarHBondContact OG1-OD2 2.9Å; I263-D265 VanDerWaalsContact C-N 3.27Å; I263-D265 PolarHBondContact O-N 3.34Å
266	I	78.3	Confident	68	Low	98 Å²	98	104.8 Å²	104.8	50%	0.503	52%	0.517	S	S	.	.	T	Hydrogen-bonded Turn	trans	-126.2	-48.8	-170.2	-61.5	171.4	0	0	0	112	K261 T262 I263	K261-I266 HydrophobicContact CB-CD1 3.95Å; K261-I266 HydrophobicContact CB-CG1 3.95Å; K261-I266 HydrophobicContact CD-CD1 4.37Å; K261-I266 HydrophobicContact CD-CG1 3.71Å; T262-I266 WeakPolarHBondContact O-CG1 3.39Å; I263-I266 PolarHBondContact O-N 3.18Å; I263-I266 VanDerWaalsContact O-N 3.14Å
267	Y	76.8	Confident	70.3	Confident	85 Å²	85	99.1 Å²	99.1	33%	0.333	49%	0.493	S	S	.	.	S	Bend	trans	-108.9	154.8	-175.9	-65.9	-84.7	0	0	0	112	I263	I263-Y267 HydrophobicContact CD1-CD2 4.44Å; I263-Y267 HydrophobicContact CG1-CD2 3.69Å; I263-Y267 HydrophobicContact CG1-CE2 4.14Å; I263-Y267 PolarHBondContact O-N 2.95Å
268	E	82.8	Confident	72.5	Confident	107 Å²	107	91 Å²	91	50%	0.5	46%	0.46	S	S	.	.			trans	-71.5	145.8	176.2	-150.3	-150.1	109	0	0	111.1	S270 E271 L272	E268-S270 PolarHBondContact O-N 2.97Å; E268-S270 VanDerWaalsContact O-N 3.13Å; E268-S270 WeakPolarHBondContact OE1-CB 3.49Å; E268-S270 PolarHBondContact OE1-OG 3.27Å; E268-S270 PolarHBondContact OE2-OG 2.82Å; E268-E271 HydrophobicContact CB-CB 4.47Å; E268-E271 HydrophobicContact CB-CG 4.01Å; E268-E271 PolarHBondContact N-OE2 2.84Å; E268-E271 WeakPolarHBondContact O-CB 3.28Å; E268-E271 PolarHBondContact O-N 3.31Å; E268-E271 VanDerWaalsContact O-N 3.08Å; E268-L272 WeakPolarHBondContact O-CG 3.19Å; E268-L272 PolarHBondContact O-N 2.8Å
269	P	80.2	Confident	74.7	Confident	100 Å²	100	89.5 Å²	89.5	65%	0.649	45%	0.447	S	S	*	.	H	α-helix	trans	-54.7	-28	173	-32.4	38.5	0	0	0	115.1	K273	P269-K273 WeakPolarHBondContact O-CB 3.4Å; P269-K273 PolarHBondContact O-N 2.69Å
270	S	79.9	Confident	76.7	Confident	60 Å²	60	88.5 Å²	88.5	42%	0.42	44%	0.435	S	S	.	.	H	α-helix	trans	-69.2	-44	173.6	71.2	0	0	0	0	112.4	E268 K273 R274	E268-S270 PolarHBondContact O-N 2.97Å; E268-S270 VanDerWaalsContact O-N 3.13Å; E268-S270 WeakPolarHBondContact OE1-CB 3.49Å; E268-S270 PolarHBondContact OE1-OG 3.27Å; E268-S270 PolarHBondContact OE2-OG 2.82Å; S270-K273 PolarHBondContact O-N 3.27Å; S270-R274 WeakPolarHBondContact O-CB 3.34Å; S270-R274 PolarHBondContact O-N 2.93Å
271	E	79.3	Confident	78.7	Confident	99 Å²	99	81.7 Å²	81.7	46%	0.463	41%	0.406	S	S	.	.	H	α-helix	trans	-61.8	-43.9	174.2	-61.9	-177.1	113.8	0	0	111.3	E268 K273 R274 G275	E268-E271 HydrophobicContact CB-CB 4.47Å; E268-E271 HydrophobicContact CB-CG 4.01Å; E268-E271 PolarHBondContact N-OE2 2.84Å; E268-E271 WeakPolarHBondContact O-CB 3.28Å; E268-E271 PolarHBondContact O-N 3.31Å; E268-E271 VanDerWaalsContact O-N 3.08Å; E271-K273 VanDerWaalsContact C-N 3.34Å; E271-K273 PolarHBondContact O-N 3.02Å; E271-R274 PolarHBondContact O-N 3.23Å; E271-G275 PolarHBondContact O-N 2.96Å
272	L	80.2	Confident	80.2	Confident	6 Å²	6	77.6 Å²	77.6	3%	0.031	39%	0.391	C	S	.	.	H	α-helix	trans	-62.5	-40	176.7	-67.1	174.7	0	0	0	111.8	I263 F264 E268 H276 F277 T278	I263-L272 HydrophobicContact CD1-CD2 3.84Å; I263-L272 HydrophobicContact CG1-CD2 3.91Å; I263-L272 HydrophobicContact CG2-CD2 4.43Å; F264-L272 HydrophobicContact CD1-CD1 3.54Å; F264-L272 HydrophobicContact CE1-CD1 4Å; E268-L272 WeakPolarHBondContact O-CG 3.19Å; E268-L272 PolarHBondContact O-N 2.8Å; L272-H276 PolarHBondContact O-N 2.58Å; L272-F277 HydrophobicContact CD2-CB 3.84Å; L272-F277 PolarHBondContact O-N 3.47Å; L272-T278 HydrophobicContact CB-CG2 4.23Å
273	K	79.5	Confident	81.2	Confident	156 Å²	156	80.3 Å²	80.3	68%	0.678	40%	0.398	S	S	*	.	H	α-helix	trans	-65.1	-43.7	173.7	-173.2	178.7	179	-176.6	0	111.6	P269 S270 E271 H276 T278	P269-K273 WeakPolarHBondContact O-CB 3.4Å; P269-K273 PolarHBondContact O-N 2.69Å; S270-K273 PolarHBondContact O-N 3.27Å; E271-K273 VanDerWaalsContact C-N 3.34Å; E271-K273 PolarHBondContact O-N 3.02Å; K273-H276 PolarHBondContact O-N 3.36Å; K273-H276 PolarHBondContact O-ND1 3.31Å; K273-H276 VanDerWaalsContact O-ND1 3.11Å; K273-T278 HydrophobicContact CB-CG2 4.3Å
274	R	77.5	Confident	82.1	Confident	141 Å²	141	78.2 Å²	78.2	53%	0.532	39%	0.387	S	S	.	.	H	α-helix	trans	-67.7	-35.1	179.4	-170	170.6	-179.1	-115.7	-3.3	113	S270 E271 D938	S270-R274 WeakPolarHBondContact O-CB 3.34Å; S270-R274 PolarHBondContact O-N 2.93Å; E271-R274 PolarHBondContact O-N 3.23Å; R274-D938 IonicContact CZ-OD1 2.66Å; R274-D938 IonicContact NE-OD1 2.66Å; R274-D938 VanDerWaalsContact NH2-CG 3.3Å; R274-D938 IonicContact NH2-OD1 2.79Å; R274-D938 PolarHBondContact NH2-OD1 3.35Å; R274-D938 IonicContact NH2-OD2 3.71Å; R274-D938 PolarHBondContact NH2-OD2 3.26Å
275	G	76.5	Confident	83	Confident	25 Å²	25	76.6 Å²	76.6	26%	0.258	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.2	-3.5	174.5	0	0	0	0	0	115.1	E271 F277	E271-G275 PolarHBondContact O-N 2.96Å; G275-F277 VanDerWaalsContact O-CD2 3.24Å; G275-F277 WeakPolarHBondContact O-CD2 3.36Å; G275-F277 VanDerWaalsContact O-CE2 3.23Å; G275-F277 WeakPolarHBondContact O-CE2 3.44Å
276	H	83.2	Confident	83.8	Confident	43 Å²	43	79.3 Å²	79.3	20%	0.199	39%	0.386	C	S	.	.	T	Hydrogen-bonded Turn	trans	57.4	46.5	-174.3	-51.4	-26.2	0	0	0	114.3	L272 K273 D281 R285 R999	L272-H276 PolarHBondContact O-N 2.58Å; K273-H276 PolarHBondContact O-N 3.36Å; K273-H276 PolarHBondContact O-ND1 3.31Å; K273-H276 VanDerWaalsContact O-ND1 3.11Å; H276-D281 VanDerWaalsContact C-CB 3.48Å; H276-D281 VanDerWaalsContact CA-OD2 3.27Å; H276-D281 WeakPolarHBondContact CA-OD2 3.06Å; H276-D281 HydrophobicContact CB-CB 4.2Å; H276-D281 WeakPolarHBondContact O-CB 3.15Å; H276-R285 PolarHBondContact O-NH2 3.05Å; H276-R999 HydrophobicContact CB-CG 3.52Å
277	F	82.4	Confident	84.4	Confident	88 Å²	88	76.7 Å²	76.7	39%	0.386	38%	0.375	S	S	.	.			trans	-114.2	14.2	179.4	-65.8	-64.1	0	0	0	114	I263 L272 G275 D281	I263-F277 HydrophobicContact CD1-CB 4.27Å; L272-F277 HydrophobicContact CD2-CB 3.84Å; L272-F277 PolarHBondContact O-N 3.47Å; G275-F277 VanDerWaalsContact O-CD2 3.24Å; G275-F277 WeakPolarHBondContact O-CD2 3.36Å; G275-F277 VanDerWaalsContact O-CE2 3.23Å; G275-F277 WeakPolarHBondContact O-CE2 3.44Å; F277-D281 PolarHBondContact N-OD2 2.95Å
278	T	86.6	Confident	85.2	Confident	32 Å²	32	75 Å²	75	20%	0.196	37%	0.371	C	S	.	.	S	Bend	trans	-72.2	165.6	171.2	73.2	0	0	0	0	111.5	L272 K273 M280 D281 N282	L272-T278 HydrophobicContact CB-CG2 4.23Å; K273-T278 HydrophobicContact CB-CG2 4.3Å; T278-M280 VanDerWaalsContact C-N 3.29Å; T278-M280 PolarHBondContact O-N 3.03Å; T278-D281 VanDerWaalsContact CB-OD2 3.31Å; T278-D281 WeakPolarHBondContact CB-OD2 3.46Å; T278-D281 WeakPolarHBondContact CG2-OD2 3.33Å; T278-D281 PolarHBondContact N-OD2 2.89Å; T278-D281 WeakPolarHBondContact O-CA 3.2Å; T278-D281 WeakPolarHBondContact O-CB 3.41Å; T278-D281 PolarHBondContact O-N 3.48Å; T278-D281 PolarHBondContact OG1-N 3.49Å; T278-D281 PolarHBondContact OG1-OD2 2.87Å; T278-N282 PolarHBondContact O-N 2.99Å; T278-N282 PolarHBondContact O-ND2 2.79Å
279	D	86.5	Confident	85.7	Confident	101 Å²	101	72 Å²	72	54%	0.54	36%	0.358	S	S	.	.	H	α-helix	trans	-63.2	-34.8	176.2	-68.8	-46	0	0	0	113	F264 D281 N282 E283	F264-D279 WeakPolarHBondContact CZ-OD1 3.46Å; F264-D279 WeakPolarHBondContact CZ-OD2 3.46Å; D279-D281 VanDerWaalsContact C-N 3.28Å; D279-D281 PolarHBondContact O-N 3.29Å; D279-N282 WeakPolarHBondContact O-CA 3.27Å; D279-N282 WeakPolarHBondContact O-CB 3.43Å; D279-N282 PolarHBondContact O-N 3.12Å; D279-N282 VanDerWaalsContact O-N 3.11Å; D279-N282 PolarHBondContact OD1-ND2 3Å; D279-E283 PolarHBondContact O-N 2.94Å
280	M	87.8	Confident	86.4	Confident	114 Å²	114	67.2 Å²	67.2	56%	0.562	33%	0.327	S	S	*	.	H	α-helix	trans	-61.5	-37.3	170.7	-173.3	-174.1	70	0	0	111.4	T278 N282 E283 I284	T278-M280 VanDerWaalsContact C-N 3.29Å; T278-M280 PolarHBondContact O-N 3.03Å; M280-N282 VanDerWaalsContact C-N 3.34Å; M280-E283 PolarHBondContact O-N 3.38Å; M280-I284 HydrophobicContact CE-CD1 4.43Å; M280-I284 HydrophobicContact CG-CD1 4.01Å; M280-I284 WeakPolarHBondContact O-CB 3.39Å; M280-I284 WeakPolarHBondContact O-CD1 3.38Å; M280-I284 WeakPolarHBondContact O-CG1 3.19Å; M280-I284 PolarHBondContact O-N 2.88Å
281	D	89.7	Confident	87.1	Confident	4 Å²	4	64.3 Å²	64.3	2%	0.021	31%	0.307	C	S	.	.	H	α-helix	trans	-71	-30	174.9	-55.9	-57.9	0	0	0	112.4	H276 F277 T278 D279 R285 R999	H276-D281 VanDerWaalsContact C-CB 3.48Å; H276-D281 VanDerWaalsContact CA-OD2 3.27Å; H276-D281 WeakPolarHBondContact CA-OD2 3.06Å; H276-D281 HydrophobicContact CB-CB 4.2Å; H276-D281 WeakPolarHBondContact O-CB 3.15Å; F277-D281 PolarHBondContact N-OD2 2.95Å; T278-D281 VanDerWaalsContact CB-OD2 3.31Å; T278-D281 WeakPolarHBondContact CB-OD2 3.46Å; T278-D281 WeakPolarHBondContact CG2-OD2 3.33Å; T278-D281 PolarHBondContact N-OD2 2.89Å; T278-D281 WeakPolarHBondContact O-CA 3.2Å; T278-D281 WeakPolarHBondContact O-CB 3.41Å; T278-D281 PolarHBondContact O-N 3.48Å; T278-D281 PolarHBondContact OG1-N 3.49Å; T278-D281 PolarHBondContact OG1-OD2 2.87Å; D279-D281 VanDerWaalsContact C-N 3.28Å; D279-D281 PolarHBondContact O-N 3.29Å; D281-R285 WeakPolarHBondContact O-CB 3.27Å; D281-R285 WeakPolarHBondContact O-CG 3.48Å; D281-R285 PolarHBondContact O-N 3.2Å; D281-R285 PolarHBondContact O-NE 3.03Å; D281-R999 HydrophobicContact CB-CG 4.32Å; D281-R999 VanDerWaalsContact OD1-CD 3.3Å; D281-R999 WeakPolarHBondContact OD1-CD 3.46Å; D281-R999 IonicContact OD1-CZ 2.71Å; D281-R999 IonicContact OD1-NE 3.56Å; D281-R999 IonicContact OD1-NH1 3.2Å; D281-R999 PolarHBondContact OD1-NH1 3.39Å
282	N	88.2	Confident	87.7	Confident	55 Å²	55	61.6 Å²	61.6	29%	0.294	29%	0.292	S	S	.	.	H	α-helix	trans	-66.8	-44.5	171.6	-64.9	-38.4	0	0	0	111	T278 D279 M280 R285 K286	T278-N282 PolarHBondContact O-N 2.99Å; T278-N282 PolarHBondContact O-ND2 2.79Å; D279-N282 WeakPolarHBondContact O-CA 3.27Å; D279-N282 WeakPolarHBondContact O-CB 3.43Å; D279-N282 PolarHBondContact O-N 3.12Å; D279-N282 VanDerWaalsContact O-N 3.11Å; D279-N282 PolarHBondContact OD1-ND2 3Å; M280-N282 VanDerWaalsContact C-N 3.34Å; N282-R285 PolarHBondContact O-N 2.86Å; N282-R285 VanDerWaalsContact OD1-CZ 3.23Å; N282-R285 PolarHBondContact OD1-NH1 2.88Å; N282-R285 PolarHBondContact OD1-NH2 3.03Å; N282-K286 PolarHBondContact O-N 3.29Å
283	E	91.4	Very high	88.3	Confident	126 Å²	126	61.4 Å²	61.4	59%	0.589	29%	0.291	S	S	*	.	H	α-helix	trans	-60.8	-51.1	173.8	-173.6	179	-179.5	0	0	111.2	D279 M280 R285 K286 T287	D279-E283 PolarHBondContact O-N 2.94Å; M280-E283 PolarHBondContact O-N 3.38Å; E283-R285 PolarHBondContact O-N 2.83Å; E283-K286 PolarHBondContact O-N 3.33Å; E283-T287 WeakPolarHBondContact O-CB 3.31Å; E283-T287 PolarHBondContact O-N 3.12Å; E283-T287 PolarHBondContact O-OG1 3.28Å; E283-T287 VanDerWaalsContact O-OG1 3.13Å
284	I	91.6	Very high	88.9	Confident	10 Å²	10	56.1 Å²	56.1	5%	0.051	27%	0.269	C	S	.	.	H	α-helix	trans	-56.2	-36.1	176.8	-70.6	163.2	0	0	0	111.6	M280 E291 Q294 L295 K1000	M280-I284 HydrophobicContact CE-CD1 4.43Å; M280-I284 HydrophobicContact CG-CD1 4.01Å; M280-I284 WeakPolarHBondContact O-CB 3.39Å; M280-I284 WeakPolarHBondContact O-CD1 3.38Å; M280-I284 WeakPolarHBondContact O-CG1 3.19Å; M280-I284 PolarHBondContact O-N 2.88Å; I284-E291 HydrophobicContact CG2-CG 3.79Å; I284-Q294 PolarHBondContact O-NE2 2.77Å; I284-L295 HydrophobicContact CD1-CD2 3.93Å; I284-K1000 VanDerWaalsContact O-CE 3.24Å; I284-K1000 WeakPolarHBondContact O-CE 3.27Å; I284-K1000 PolarHBondContact O-NZ 3.17Å
285	R	90.6	Very high	89.4	Confident	68 Å²	68	53.3 Å²	53.3	26%	0.257	26%	0.264	S	S	.	.	H	α-helix	trans	-67.7	-50.6	173.4	-77.1	-175.7	-96.9	97.2	1.1	112.1	H276 D281 N282 E283 R999 K1000	H276-R285 PolarHBondContact O-NH2 3.05Å; D281-R285 WeakPolarHBondContact O-CB 3.27Å; D281-R285 WeakPolarHBondContact O-CG 3.48Å; D281-R285 PolarHBondContact O-N 3.2Å; D281-R285 PolarHBondContact O-NE 3.03Å; N282-R285 PolarHBondContact O-N 2.86Å; N282-R285 VanDerWaalsContact OD1-CZ 3.23Å; N282-R285 PolarHBondContact OD1-NH1 2.88Å; N282-R285 PolarHBondContact OD1-NH2 3.03Å; E283-R285 PolarHBondContact O-N 2.83Å; R285-R999 HydrophobicContact CG-CB 3.74Å; R285-R999 HydrophobicContact CG-CG 4.39Å; R285-K1000 PolarHBondContact O-NZ 3.4Å
286	K	90.2	Very high	90	Very high	147 Å²	147	53.7 Å²	53.7	64%	0.639	26%	0.258	S	S	*	.	H	α-helix	trans	-68.4	-34.8	-177.8	-71.6	-168	179.4	-170.5	0	113.9	E223 N282 E283	E223-K286 IonicContact OE1-NZ 2.78Å; E223-K286 PolarHBondContact OE1-NZ 2.87Å; E223-K286 IonicContact OE2-NZ 2.6Å; E223-K286 PolarHBondContact OE2-NZ 2.79Å; N282-K286 PolarHBondContact O-N 3.29Å; E283-K286 PolarHBondContact O-N 3.33Å
287	T	92.6	Very high	90.1	Very high	44 Å²	44	60.1 Å²	60.1	27%	0.27	29%	0.288	S	S	.	.	S	Bend	trans	-72	128.6	-173.3	-66.9	0	0	0	0	114.1	E283 I289 K1000	E283-T287 WeakPolarHBondContact O-CB 3.31Å; E283-T287 PolarHBondContact O-N 3.12Å; E283-T287 PolarHBondContact O-OG1 3.28Å; E283-T287 VanDerWaalsContact O-OG1 3.13Å; T287-I289 HydrophobicContact CG2-CB 4.07Å; T287-I289 HydrophobicContact CG2-CD1 3.92Å; T287-I289 HydrophobicContact CG2-CG1 3.81Å; T287-I289 PolarHBondContact O-N 3.25Å; T287-K1000 PolarHBondContact O-NZ 3.17Å
288	D	93.8	Very high	90.2	Very high	49 Å²	49	57.2 Å²	57.2	26%	0.262	28%	0.278	S	S	.	.	S	Bend	trans	-79.6	61.1	177.3	-173	35.8	0	0	0	113.2	G1028 P1029 R1030 V1031	D288-G1028 VanDerWaalsContact CG-C 3.47Å; D288-G1028 VanDerWaalsContact CG-CA 3.46Å; D288-G1028 VanDerWaalsContact OD1-CA 3.3Å; D288-G1028 WeakPolarHBondContact OD1-CA 3.33Å; D288-P1029 VanDerWaalsContact OD2-CD 3.26Å; D288-P1029 WeakPolarHBondContact OD2-CD 3.42Å; D288-P1029 VanDerWaalsContact OD2-N 3.11Å; D288-R1030 WeakPolarHBondContact O-CB 3.34Å; D288-R1030 PolarHBondContact OD1-N 2.93Å; D288-R1030 WeakPolarHBondContact OD2-CB 3.11Å; D288-R1030 WeakPolarHBondContact OD2-CG 3.26Å; D288-R1030 PolarHBondContact OD2-N 2.7Å; D288-V1031 WeakPolarHBondContact OD1-CG2 3.42Å; D288-V1031 PolarHBondContact OD1-N 3.44Å
289	I	93	Very high	90	Very high	43 Å²	43	59.6 Å²	59.6	22%	0.221	29%	0.293	C	S	.	.	S	Bend	trans	-132.6	140.2	171.2	-61.5	178.5	0	0	0	107.2	T287 E291 M293 Q294 K1000	T287-I289 HydrophobicContact CG2-CB 4.07Å; T287-I289 HydrophobicContact CG2-CD1 3.92Å; T287-I289 HydrophobicContact CG2-CG1 3.81Å; T287-I289 PolarHBondContact O-N 3.25Å; I289-E291 PolarHBondContact O-N 3.47Å; I289-M293 HydrophobicContact CG2-CB 3.86Å; I289-Q294 HydrophobicContact CB-CG 3.81Å; I289-Q294 HydrophobicContact CG2-CG 3.71Å; I289-Q294 PolarHBondContact O-NE2 3.26Å; I289-K1000 VanDerWaalsContact O-CE 3.24Å; I289-K1000 WeakPolarHBondContact O-CE 3.39Å
290	P	94.6	Very high	90	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	27%	0.272	C	S	.	.			trans	-50.2	132.1	173.9	-29.9	37.2	0	0	0	112.5	R292 M293 Q294 Q360 E362	P290-R292 VanDerWaalsContact C-N 3.26Å; P290-R292 PolarHBondContact O-N 2.81Å; P290-R292 VanDerWaalsContact O-N 3.14Å; P290-M293 HydrophobicContact CB-CB 4.47Å; P290-M293 HydrophobicContact CB-CG 4.16Å; P290-M293 HydrophobicContact CB-SD 4.25Å; P290-M293 HydrophobicContact CG-SD 3.98Å; P290-M293 WeakPolarHBondContact O-CB 3.48Å; P290-M293 PolarHBondContact O-N 2.76Å; P290-Q294 PolarHBondContact O-N 3.46Å; P290-Q360 WeakPolarHBondContact CG-O 3.37Å; P290-E362 HydrophobicContact CB-CG 3.84Å; P290-E362 HydrophobicContact CG-CG 4.27Å
291	E	93.3	Very high	89.9	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-57.2	-37.7	-169.1	-175.6	169.6	157.9	0	0	112.8	I284 I289 M293 Q294 L295 G997 P998 R999 K1000	I284-E291 HydrophobicContact CG2-CG 3.79Å; I289-E291 PolarHBondContact O-N 3.47Å; E291-M293 VanDerWaalsContact C-N 3.33Å; E291-M293 PolarHBondContact O-N 2.82Å; E291-Q294 PolarHBondContact O-N 3.49Å; E291-L295 HydrophobicContact CG-CD1 3.85Å; E291-L295 HydrophobicContact CG-CG 4.48Å; E291-L295 WeakPolarHBondContact O-CG 3.29Å; E291-L295 PolarHBondContact O-N 2.8Å; E291-L295 VanDerWaalsContact O-N 3.15Å; E291-G997 VanDerWaalsContact CD-CA 3.43Å; E291-G997 WeakPolarHBondContact OE2-CA 3.44Å; E291-G997 PolarHBondContact OE2-N 2.82Å; E291-P998 VanDerWaalsContact OE1-CD 3.22Å; E291-P998 WeakPolarHBondContact OE1-CD 3.42Å; E291-P998 WeakPolarHBondContact OE1-CG 3.29Å; E291-R999 WeakPolarHBondContact OE1-CB 3.34Å; E291-R999 IonicContact OE1-CZ 3.66Å; E291-R999 PolarHBondContact OE1-N 2.81Å; E291-R999 VanDerWaalsContact OE1-N 3.14Å; E291-R999 IonicContact OE1-NE 2.71Å; E291-R999 PolarHBondContact OE1-NE 3.42Å; E291-R999 IonicContact OE1-NH2 3.33Å; E291-R999 PolarHBondContact OE1-NH2 3.33Å; E291-R999 PolarHBondContact OE2-N 2.92Å; E291-K1000 HydrophobicContact CB-CD 4.26Å; E291-K1000 HydrophobicContact CB-CG 4.49Å; E291-K1000 PolarHBondContact OE2-N 2.81Å
292	R	92.2	Very high	89.9	Confident	41 Å²	41	57.5 Å²	57.5	16%	0.155	29%	0.293	C	S	.	.	H	α-helix	trans	-67.7	-24.6	176.1	-75.9	176.9	-71	-82.4	-14.4	114.9	P290 E362 Y387 I967 Q991 I993 L996	P290-R292 VanDerWaalsContact C-N 3.26Å; P290-R292 PolarHBondContact O-N 2.81Å; P290-R292 VanDerWaalsContact O-N 3.14Å; R292-E362 IonicContact CZ-OE1 3.2Å; R292-E362 IonicContact CZ-OE2 2.85Å; R292-E362 IonicContact NE-OE1 2.67Å; R292-E362 IonicContact NE-OE2 2.81Å; R292-E362 PolarHBondContact NE-OE2 3.32Å; R292-E362 IonicContact NH2-OE1 2.64Å; R292-E362 PolarHBondContact NH2-OE1 2.81Å; R292-E362 IonicContact NH2-OE2 3.97Å; R292-E362 PolarHBondContact NH2-OE2 3.23Å; R292-Y387 PolarHBondContact O-OH 2.94Å; R292-I967 VanDerWaalsContact CD-CD1 3.45Å; R292-Q991 PolarHBondContact NH1-O 2.82Å; R292-I993 PolarHBondContact NH2-O 2.89Å; R292-L996 PolarHBondContact NH1-O 2.7Å; R292-L996 PolarHBondContact NH2-O 3.02Å
293	M	93.1	Very high	90	Very high	2 Å²	2	55.3 Å²	55.3	1%	0.01	28%	0.281	C	S	.	.	H	α-helix	trans	-78.3	-26.4	174.1	-68.4	-175.6	169.9	0	0	112.1	I289 P290 E291 V300 I356 Q360 L361 E362 Y387	I289-M293 HydrophobicContact CG2-CB 3.86Å; P290-M293 HydrophobicContact CB-CB 4.47Å; P290-M293 HydrophobicContact CB-CG 4.16Å; P290-M293 HydrophobicContact CB-SD 4.25Å; P290-M293 HydrophobicContact CG-SD 3.98Å; P290-M293 WeakPolarHBondContact O-CB 3.48Å; P290-M293 PolarHBondContact O-N 2.76Å; E291-M293 VanDerWaalsContact C-N 3.33Å; E291-M293 PolarHBondContact O-N 2.82Å; M293-V300 HydrophobicContact CB-CB 4.39Å; M293-V300 HydrophobicContact CB-CG2 3.87Å; M293-V300 HydrophobicContact CG-CG2 3.98Å; M293-V300 HydrophobicContact SD-CG2 4.4Å; M293-I356 HydrophobicContact CE-CG2 4.23Å; M293-Q360 HydrophobicContact SD-CB 4.21Å; M293-L361 VanDerWaalsContact CE-C 3.46Å; M293-L361 VanDerWaalsContact CE-O 3.27Å; M293-L361 WeakPolarHBondContact CE-O 2.81Å; M293-E362 HydrophobicContact CE-CG 4.05Å; M293-Y387 HydrophobicContact CG-CE2 4.45Å
294	Q	91.3	Very high	89.9	Confident	45 Å²	45	53.6 Å²	53.6	21%	0.21	28%	0.281	C	S	.	.	H	α-helix	trans	-77.4	-35.1	175	-57.3	-171.8	55	0	0	111.9	I284 I289 P290 E291 R296	I284-Q294 PolarHBondContact O-NE2 2.77Å; I289-Q294 HydrophobicContact CB-CG 3.81Å; I289-Q294 HydrophobicContact CG2-CG 3.71Å; I289-Q294 PolarHBondContact O-NE2 3.26Å; P290-Q294 PolarHBondContact O-N 3.46Å; E291-Q294 PolarHBondContact O-N 3.49Å; Q294-R296 VanDerWaalsContact C-N 3.35Å
295	L	89.1	Confident	89.4	Confident	82 Å²	82	62.6 Å²	62.6	43%	0.429	32%	0.323	S	S	.	.	S	Bend	trans	-83.6	-1.8	-178.2	-65	167.7	0	0	0	114.7	I284 E291	I284-L295 HydrophobicContact CD1-CD2 3.93Å; E291-L295 HydrophobicContact CG-CD1 3.85Å; E291-L295 HydrophobicContact CG-CG 4.48Å; E291-L295 WeakPolarHBondContact O-CG 3.29Å; E291-L295 PolarHBondContact O-N 2.8Å; E291-L295 VanDerWaalsContact O-N 3.15Å
296	R	88.1	Confident	89.1	Confident	33 Å²	33	63.4 Å²	63.4	13%	0.125	35%	0.352	C	S	.	.	S	Bend	trans	-73	133.7	-178.7	-165.1	175.6	77.3	161.9	5.5	110.1	Q294 V298 Y387 D390	Q294-R296 VanDerWaalsContact C-N 3.35Å; R296-V298 PolarHBondContact NE-O 3.27Å; R296-V298 PolarHBondContact NH2-O 2.77Å; R296-V298 VanDerWaalsContact NH2-O 3.16Å; R296-V298 CarbonylContact O-C 3.53Å; R296-V298 PolarHBondContact O-N 3.42Å; R296-Y387 PolarHBondContact NH1-O 3.32Å; R296-D390 IonicContact CZ-OD2 3.75Å; R296-D390 IonicContact NH1-OD2 2.73Å; R296-D390 PolarHBondContact NH1-OD2 2.74Å; R296-D390 IonicContact NH2-OD2 2.77Å; R296-D390 PolarHBondContact NH2-OD2 3.01Å
297	E	85.1	Confident	89	Confident	178 Å²	178	58.8 Å²	58.8	83%	0.832	34%	0.338	S	S	*	.	S	Bend	trans	-44.5	-36.1	179.8	-67.5	-174.8	-178.6	0	0	114.1
298	V	85.9	Confident	89	Confident	28 Å²	28	62.3 Å²	62.3	17%	0.17	36%	0.356	C	S	.	.	S	Bend	trans	-115.6	104.8	174.8	-176.4	0	0	0	0	107.3	R296 C394 Q395	R296-V298 PolarHBondContact NE-O 3.27Å; R296-V298 PolarHBondContact NH2-O 2.77Å; R296-V298 VanDerWaalsContact NH2-O 3.16Å; R296-V298 CarbonylContact O-C 3.53Å; R296-V298 PolarHBondContact O-N 3.42Å; V298-C394 HydrophobicContact CG1-CB 3.62Å; V298-Q395 HydrophobicContact CG2-CB 3.96Å; V298-Q395 HydrophobicContact CG2-CG 4.09Å
299	P	82.3	Confident	88.9	Confident	81 Å²	81	61.9 Å²	61.9	53%	0.526	35%	0.352	S	S	.	.			trans	-53.7	145.1	-177	-30.2	36.4	0	0	0	113.2	T301	P299-T301 PolarHBondContact O-N 3.38Å
300	V	86.8	Confident	88.9	Confident	15 Å²	15	60.5 Å²	60.5	9%	0.091	35%	0.345	C	S	.	.			trans	-72.5	108.5	176.3	179.5	0	0	0	0	109.3	M293 I356 R357	M293-V300 HydrophobicContact CB-CB 4.39Å; M293-V300 HydrophobicContact CB-CG2 3.87Å; M293-V300 HydrophobicContact CG-CG2 3.98Å; M293-V300 HydrophobicContact SD-CG2 4.4Å; V300-I356 HydrophobicContact CG1-CG2 4.27Å; V300-R357 HydrophobicContact CG1-CG 4.39Å
301	T	86	Confident	88.9	Confident	72 Å²	72	63.5 Å²	63.5	44%	0.442	36%	0.361	S	S	.	.	P	Polyproline II helix	trans	-102.3	136.2	177.5	56.7	0	0	0	0	111.6	P299 R357	P299-T301 PolarHBondContact O-N 3.38Å; T301-R357 PolarHBondContact O-NE 3.36Å; T301-R357 PolarHBondContact O-NH2 3.46Å; T301-R357 PolarHBondContact OG1-NH2 3.24Å
302	P	89.8	Confident	88.9	Confident	88 Å²	88	68.6 Å²	68.6	57%	0.571	39%	0.388	S	S	*	.	P	Polyproline II helix	trans	-70.1	142.9	174.7	30.4	-34.8	0	0	0	110.8	R357	P302-R357 WeakPolarHBondContact CA-O 3.39Å
303	V	89.7	Confident	89	Confident	10 Å²	10	66.6 Å²	66.6	6%	0.061	38%	0.38	C	S	.	.	P	Polyproline II helix	trans	-86.5	131.2	178	178.7	0	0	0	0	109.8	E309 L310 N358	V303-E309 HydrophobicContact CG1-CB 3.87Å; V303-E309 HydrophobicContact CG1-CG 4.01Å; V303-E309 HydrophobicContact CG2-CG 3.94Å; V303-L310 HydrophobicContact CB-CD1 4.37Å; V303-L310 HydrophobicContact CB-CD2 4.46Å; V303-L310 HydrophobicContact CB-CG 4.17Å; V303-L310 HydrophobicContact CG1-CG 4.17Å; V303-L310 HydrophobicContact CG2-CD2 3.75Å; V303-L310 HydrophobicContact CG2-CG 3.93Å; V303-N358 PolarHBondContact N-OD1 2.88Å
304	P	88.3	Confident	89.2	Confident	89 Å²	89	66.5 Å²	66.5	58%	0.578	38%	0.38	S	S	*	.	P	Polyproline II helix	trans	-57.3	140	175.5	-25.3	34.7	0	0	0	113.1	G306 S307	P304-G306 PolarHBondContact O-N 3.46Å; P304-S307 VanDerWaalsContact O-CB 3.29Å; P304-S307 WeakPolarHBondContact O-CB 3.38Å; P304-S307 PolarHBondContact O-N 2.91Å; P304-S307 VanDerWaalsContact O-N 3.11Å
305	E	81.8	Confident	89.4	Confident	200 Å²	200	70.4 Å²	70.4	94%	0.935	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	129.6	175.9	-65.1	-175.2	177.5	0	0	111.1
306	G	84.2	Confident	89.7	Confident	85 Å²	85	67.2 Å²	67.2	88%	0.876	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	83	9.6	-176.7	0	0	0	0	0	115.6	P304	P304-G306 PolarHBondContact O-N 3.46Å
307	S	88.9	Confident	90.1	Very high	49 Å²	49	65.7 Å²	65.7	34%	0.343	37%	0.374	S	S	.	.			trans	-85	129.9	170	-172.6	0	0	0	0	112	P304 E309	P304-S307 VanDerWaalsContact O-CB 3.29Å; P304-S307 WeakPolarHBondContact O-CB 3.38Å; P304-S307 PolarHBondContact O-N 2.91Å; P304-S307 VanDerWaalsContact O-N 3.11Å; S307-E309 PolarHBondContact O-N 3.39Å; S307-E309 VanDerWaalsContact O-N 3.11Å; S307-E309 VanDerWaalsContact OG-CB 3.23Å; S307-E309 WeakPolarHBondContact OG-CB 3.37Å; S307-E309 PolarHBondContact OG-N 2.99Å
308	D	91.1	Very high	90.5	Very high	119 Å²	119	58.8 Å²	58.8	64%	0.636	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70	1.5	172.6	-58.5	-39.4	0	0	0	113.1	L310 D311 L312	D308-L310 VanDerWaalsContact C-N 3.34Å; D308-L310 PolarHBondContact O-N 2.96Å; D308-D311 PolarHBondContact O-N 3.42Å; D308-D311 VanDerWaalsContact O-N 3.07Å; D308-L312 PolarHBondContact O-N 3.19Å; D308-L312 VanDerWaalsContact O-N 3.1Å
309	E	92.1	Very high	90.8	Very high	39 Å²	39	62 Å²	62	18%	0.182	35%	0.353	C	S	.	.	H	α-helix	trans	-51.1	-45.7	-179	165	161.7	-170.2	0	0	113.3	V303 S307 D311 L312 E313 R357 W393	V303-E309 HydrophobicContact CG1-CB 3.87Å; V303-E309 HydrophobicContact CG1-CG 4.01Å; V303-E309 HydrophobicContact CG2-CG 3.94Å; S307-E309 PolarHBondContact O-N 3.39Å; S307-E309 VanDerWaalsContact O-N 3.11Å; S307-E309 VanDerWaalsContact OG-CB 3.23Å; S307-E309 WeakPolarHBondContact OG-CB 3.37Å; S307-E309 PolarHBondContact OG-N 2.99Å; E309-D311 VanDerWaalsContact C-N 3.3Å; E309-D311 PolarHBondContact O-N 3.04Å; E309-L312 PolarHBondContact O-N 2.69Å; E309-E313 WeakPolarHBondContact O-CB 3.42Å; E309-E313 PolarHBondContact O-N 2.96Å; E309-R357 IonicContact OE1-CZ 3.21Å; E309-R357 VanDerWaalsContact OE1-CZ 3.28Å; E309-R357 IonicContact OE1-NH1 3.49Å; E309-R357 PolarHBondContact OE1-NH1 2.84Å; E309-R357 IonicContact OE1-NH2 3.24Å; E309-R357 PolarHBondContact OE1-NH2 3.31Å; E309-W393 HydrophobicContact CG-CH2 3.6Å; E309-W393 HydrophobicContact CG-CZ3 3.93Å; E309-W393 VanDerWaalsContact OE1-CZ3 3.31Å; E309-W393 WeakPolarHBondContact OE1-CZ3 3.46Å
310	L	93.1	Very high	91.3	Very high	14 Å²	14	60 Å²	60	7%	0.073	34%	0.335	C	S	.	.	H	α-helix	trans	-68.5	-26.4	180	-68	174.4	0	0	0	113.3	V303 D308 A314 K350 L353 E354	V303-L310 HydrophobicContact CB-CD1 4.37Å; V303-L310 HydrophobicContact CB-CD2 4.46Å; V303-L310 HydrophobicContact CB-CG 4.17Å; V303-L310 HydrophobicContact CG1-CG 4.17Å; V303-L310 HydrophobicContact CG2-CD2 3.75Å; V303-L310 HydrophobicContact CG2-CG 3.93Å; D308-L310 VanDerWaalsContact C-N 3.34Å; D308-L310 PolarHBondContact O-N 2.96Å; L310-A314 WeakPolarHBondContact O-CB 3.26Å; L310-A314 PolarHBondContact O-N 3.01Å; L310-K350 HydrophobicContact CB-CG 4.2Å; L310-L353 HydrophobicContact CD2-CB 3.74Å; L310-E354 HydrophobicContact CD1-CB 4.4Å
311	D	94.2	Very high	91.4	Very high	64 Å²	64	59.5 Å²	59.5	34%	0.342	33%	0.332	S	S	.	.	H	α-helix	trans	-75.5	-47.4	175.2	-66.6	-83.5	0	0	0	110.7	D308 E309 E313 A314 E315 K350	D308-D311 PolarHBondContact O-N 3.42Å; D308-D311 VanDerWaalsContact O-N 3.07Å; E309-D311 VanDerWaalsContact C-N 3.3Å; E309-D311 PolarHBondContact O-N 3.04Å; D311-E313 VanDerWaalsContact C-N 3.32Å; D311-E313 PolarHBondContact O-N 3.43Å; D311-A314 PolarHBondContact O-N 3.01Å; D311-E315 PolarHBondContact O-N 3.45Å; D311-K350 WeakPolarHBondContact OD1-CD 3.42Å; D311-K350 WeakPolarHBondContact OD1-CE 3.45Å; D311-K350 IonicContact OD1-NZ 3.42Å; D311-K350 PolarHBondContact OD1-NZ 2.98Å; D311-K350 VanDerWaalsContact OD2-CE 3.3Å; D311-K350 WeakPolarHBondContact OD2-CE 3.43Å; D311-K350 IonicContact OD2-NZ 2.7Å; D311-K350 PolarHBondContact OD2-NZ 3.16Å
312	L	93.9	Very high	91.6	Very high	106 Å²	106	57.2 Å²	57.2	56%	0.555	32%	0.316	S	S	*	.	H	α-helix	trans	-63.8	-37.9	176.9	-62.6	176.1	0	0	0	112	D308 E309 W316	D308-L312 PolarHBondContact O-N 3.19Å; D308-L312 VanDerWaalsContact O-N 3.1Å; E309-L312 PolarHBondContact O-N 2.69Å; L312-W316 VanDerWaalsContact O-CB 3.24Å; L312-W316 WeakPolarHBondContact O-CB 3.27Å; L312-W316 PolarHBondContact O-N 2.68Å
313	E	94.9	Very high	91.5	Very high	0 Å²	0	55.1 Å²	55.1	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-65.5	-48.1	172.4	-173.2	168.6	-146.3	0	0	110.9	E309 D311 E315 W316 I317 L353 R357 D390 W393	E309-E313 WeakPolarHBondContact O-CB 3.42Å; E309-E313 PolarHBondContact O-N 2.96Å; D311-E313 VanDerWaalsContact C-N 3.32Å; D311-E313 PolarHBondContact O-N 3.43Å; E313-E315 PolarHBondContact O-N 3.17Å; E313-W316 PolarHBondContact O-N 2.99Å; E313-I317 HydrophobicContact CG-CD1 3.94Å; E313-I317 HydrophobicContact CG-CG1 4.33Å; E313-I317 WeakPolarHBondContact O-CB 3.46Å; E313-I317 VanDerWaalsContact O-CG1 3.29Å; E313-I317 WeakPolarHBondContact O-CG1 3.5Å; E313-I317 PolarHBondContact O-N 2.82Å; E313-L353 HydrophobicContact CB-CD1 3.99Å; E313-L353 HydrophobicContact CG-CD1 3.64Å; E313-L353 HydrophobicContact CG-CD2 4.23Å; E313-R357 IonicContact OE1-NH1 2.75Å; E313-R357 IonicContact OE2-CZ 2.76Å; E313-R357 IonicContact OE2-NH1 3.61Å; E313-R357 PolarHBondContact OE2-NH1 3.16Å; E313-D390 WeakPolarHBondContact OE1-CA 3.4Å; E313-W393 HydrophobicContact CB-CD2 3.87Å; E313-W393 HydrophobicContact CB-CE3 4.26Å; E313-W393 HydrophobicContact CB-CG 4.21Å; E313-W393 HydrophobicContact CB-CZ2 4.29Å; E313-W393 HydrophobicContact CG-CB 4.14Å; E313-W393 HydrophobicContact CG-CD2 3.68Å; E313-W393 HydrophobicContact CG-CE3 3.98Å; E313-W393 HydrophobicContact CG-CG 3.71Å
314	A	96.3	Very high	91.3	Very high	0 Å²	0	60.7 Å²	60.7	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-62.6	-41.2	179.3	0	0	0	0	0	113.6	L310 D311 Y318 V346 I349 K350 L353	L310-A314 WeakPolarHBondContact O-CB 3.26Å; L310-A314 PolarHBondContact O-N 3.01Å; D311-A314 PolarHBondContact O-N 3.01Å; A314-Y318 WeakPolarHBondContact O-CB 3.21Å; A314-Y318 PolarHBondContact O-N 2.84Å; A314-V346 HydrophobicContact CB-CG1 4.03Å; A314-I349 HydrophobicContact CB-CB 4.24Å; A314-I349 HydrophobicContact CB-CG2 3.95Å; A314-K350 HydrophobicContact CB-CB 3.84Å; A314-L353 HydrophobicContact CB-CD1 4.14Å
315	E	95.6	Very high	91.1	Very high	126 Å²	126	62.4 Å²	62.4	59%	0.589	33%	0.327	S	S	*	.	H	α-helix	trans	-64.7	-42.1	173.2	-74.5	-162.7	166.9	0	0	111.9	D311 E313 Y318 K319 V346	D311-E315 PolarHBondContact O-N 3.45Å; E313-E315 PolarHBondContact O-N 3.17Å; E315-Y318 PolarHBondContact O-N 3.48Å; E315-K319 VanDerWaalsContact O-CB 3.31Å; E315-K319 WeakPolarHBondContact O-CB 3.35Å; E315-K319 PolarHBondContact O-N 3.44Å; E315-V346 HydrophobicContact CG-CG1 3.98Å
316	W	95.6	Very high	91.3	Very high	16 Å²	16	56.2 Å²	56.2	6%	0.061	30%	0.303	C	S	.	.	H	α-helix	trans	-64.6	-46.3	177.6	-175.8	94.8	0	0	0	111.6	L312 E313 Y318 K319 Y320 Y389 I392 W393 L396 Q445	L312-W316 VanDerWaalsContact O-CB 3.24Å; L312-W316 WeakPolarHBondContact O-CB 3.27Å; L312-W316 PolarHBondContact O-N 2.68Å; E313-W316 PolarHBondContact O-N 2.99Å; W316-Y318 PolarHBondContact O-N 3.1Å; W316-K319 PolarHBondContact O-N 2.88Å; W316-Y320 AromaticContact CD1-CD2 3.55Å; W316-Y320 AromaticContact CD1-CE2 3.63Å; W316-Y320 AromaticContact CD2-CD2 3.9Å; W316-Y320 HydrophobicContact CD2-CD2 3.9Å; W316-Y320 HydrophobicContact CD2-CG 4.32Å; W316-Y320 AromaticContact CE2-CD2 3.55Å; W316-Y320 AromaticContact CE2-CG 3.81Å; W316-Y320 AromaticContact CG-CD2 3.89Å; W316-Y320 HydrophobicContact CG-CD2 3.89Å; W316-Y320 HydrophobicContact CG-CE2 4.39Å; W316-Y320 HydrophobicContact CZ2-CD1 4.36Å; W316-Y320 HydrophobicContact CZ2-CD2 4.17Å; W316-Y320 AromaticContact CZ2-CG 3.96Å; W316-Y320 HydrophobicContact CZ2-CG 3.96Å; W316-Y320 AromaticContact NE1-CD2 3.31Å; W316-Y320 VanDerWaalsContact NE1-CD2 3.31Å; W316-Y320 AromaticContact NE1-CE2 3.4Å; W316-Y320 AromaticContact NE1-CG 3.98Å; W316-Y320 WeakPolarHBondContact O-CB 3.36Å; W316-Y320 WeakPolarHBondContact O-CD2 3.36Å; W316-Y320 PolarHBondContact O-N 2.86Å; W316-Y389 HydrophobicContact CH2-CD1 4.05Å; W316-Y389 AromaticContact CZ3-CD1 3.75Å; W316-Y389 HydrophobicContact CZ3-CD1 3.75Å; W316-Y389 HydrophobicContact CZ3-CG 4.44Å; W316-I392 HydrophobicContact CH2-CB 4.2Å; W316-I392 HydrophobicContact CH2-CG2 3.73Å; W316-I392 HydrophobicContact CZ2-CG2 4.47Å; W316-W393 AromaticContact CD2-CD1 3.65Å; W316-W393 HydrophobicContact CE3-CB 3.9Å; W316-W393 AromaticContact CE3-CD1 3.66Å; W316-W393 HydrophobicContact CE3-CG 4.18Å; W316-W393 AromaticContact CG-CD1 3.71Å; W316-W393 HydrophobicContact CZ3-CB 3.9Å; W316-L396 HydrophobicContact CZ2-CD2 4.27Å; W316-Q445 PolarHBondContact NE1-O 2.86Å
317	I	95.9	Very high	91.6	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-62.4	-43.9	176.4	-65.1	-176.4	0	0	0	110.4	E313 K319 Y320 A321 F322 I349 L353 V386 D390	E313-I317 HydrophobicContact CG-CD1 3.94Å; E313-I317 HydrophobicContact CG-CG1 4.33Å; E313-I317 WeakPolarHBondContact O-CB 3.46Å; E313-I317 VanDerWaalsContact O-CG1 3.29Å; E313-I317 WeakPolarHBondContact O-CG1 3.5Å; E313-I317 PolarHBondContact O-N 2.82Å; I317-K319 VanDerWaalsContact C-N 3.3Å; I317-K319 PolarHBondContact O-N 2.78Å; I317-Y320 PolarHBondContact O-N 2.77Å; I317-A321 HydrophobicContact CG2-CB 4.07Å; I317-A321 WeakPolarHBondContact O-CA 3.29Å; I317-A321 WeakPolarHBondContact O-CB 3.49Å; I317-A321 PolarHBondContact O-N 2.99Å; I317-F322 HydrophobicContact CG2-CE2 4.29Å; I317-I349 HydrophobicContact CB-CG2 4.04Å; I317-I349 HydrophobicContact CD1-CG2 4.42Å; I317-I349 HydrophobicContact CG2-CD1 4.4Å; I317-I349 HydrophobicContact CG2-CG2 3.97Å; I317-L353 HydrophobicContact CD1-CD1 4.21Å; I317-L353 HydrophobicContact CD1-CD2 3.85Å; I317-L353 HydrophobicContact CD1-CG 4.5Å; I317-V386 HydrophobicContact CD1-CG1 4.25Å; I317-V386 HydrophobicContact CG2-CG2 4.23Å; I317-D390 HydrophobicContact CD1-CB 4.44Å
318	Y	95	Very high	91.7	Very high	34 Å²	34	51.3 Å²	51.3	13%	0.133	25%	0.254	C	S	.	.	I	π-helix	trans	-57.6	-43.4	174.6	177.1	-101.4	0	0	0	112.3	A314 E315 W316 F322 C323 K341 P342 P343 V346 I349	A314-Y318 WeakPolarHBondContact O-CB 3.21Å; A314-Y318 PolarHBondContact O-N 2.84Å; E315-Y318 PolarHBondContact O-N 3.48Å; W316-Y318 PolarHBondContact O-N 3.1Å; Y318-F322 WeakPolarHBondContact O-CB 3.32Å; Y318-F322 PolarHBondContact O-N 2.79Å; Y318-C323 VanDerWaalsContact CE1-SG 3.52Å; Y318-C323 PolarHBondContact O-N 3.41Å; Y318-C323 PolarHBondContact O-SG 3.11Å; Y318-K341 HydrophobicContact CE2-CB 4.19Å; Y318-K341 PolarHBondContact OH-O 3.25Å; Y318-P342 WeakPolarHBondContact CE2-O 3.47Å; Y318-P343 WeakPolarHBondContact OH-CA 3.47Å; Y318-V346 HydrophobicContact CD1-CG2 3.81Å; Y318-V346 HydrophobicContact CD2-CG2 4.06Å; Y318-V346 HydrophobicContact CE1-CG2 4.49Å; Y318-V346 HydrophobicContact CG-CG2 3.57Å; Y318-I349 HydrophobicContact CD2-CD1 4.34Å
319	K	92.4	Very high	91.4	Very high	95 Å²	95	48.3 Å²	48.3	41%	0.413	24%	0.236	S	C	.	.	I	π-helix	trans	-67.4	-50.1	178.2	-179.6	-179.7	168	-167.2	0	112.5	E315 W316 I317 C323 K324	E315-K319 VanDerWaalsContact O-CB 3.31Å; E315-K319 WeakPolarHBondContact O-CB 3.35Å; E315-K319 PolarHBondContact O-N 3.44Å; W316-K319 PolarHBondContact O-N 2.88Å; I317-K319 VanDerWaalsContact C-N 3.3Å; I317-K319 PolarHBondContact O-N 2.78Å; K319-C323 CarbonylContact O-C 3.59Å; K319-C323 WeakPolarHBondContact O-CB 3.31Å; K319-C323 PolarHBondContact O-N 2.78Å; K319-K324 PolarHBondContact O-N 3.18Å
320	Y	91.2	Very high	91	Very high	38 Å²	38	46.8 Å²	46.8	15%	0.149	23%	0.229	C	C	.	.	I	π-helix	trans	-88.2	-30.4	-171.3	-78.5	-92.6	0	0	0	114.2	W316 I317 K324 Q445	W316-Y320 AromaticContact CD1-CD2 3.55Å; W316-Y320 AromaticContact CD1-CE2 3.63Å; W316-Y320 AromaticContact CD2-CD2 3.9Å; W316-Y320 HydrophobicContact CD2-CD2 3.9Å; W316-Y320 HydrophobicContact CD2-CG 4.32Å; W316-Y320 AromaticContact CE2-CD2 3.55Å; W316-Y320 AromaticContact CE2-CG 3.81Å; W316-Y320 AromaticContact CG-CD2 3.89Å; W316-Y320 HydrophobicContact CG-CD2 3.89Å; W316-Y320 HydrophobicContact CG-CE2 4.39Å; W316-Y320 HydrophobicContact CZ2-CD1 4.36Å; W316-Y320 HydrophobicContact CZ2-CD2 4.17Å; W316-Y320 AromaticContact CZ2-CG 3.96Å; W316-Y320 HydrophobicContact CZ2-CG 3.96Å; W316-Y320 AromaticContact NE1-CD2 3.31Å; W316-Y320 VanDerWaalsContact NE1-CD2 3.31Å; W316-Y320 AromaticContact NE1-CE2 3.4Å; W316-Y320 AromaticContact NE1-CG 3.98Å; W316-Y320 WeakPolarHBondContact O-CB 3.36Å; W316-Y320 WeakPolarHBondContact O-CD2 3.36Å; W316-Y320 PolarHBondContact O-N 2.86Å; I317-Y320 PolarHBondContact O-N 2.77Å; Y320-K324 HydrophobicContact CD1-CD 4.05Å; Y320-K324 HydrophobicContact CE1-CD 4.44Å; Y320-Q445 HydrophobicContact CE2-CB 3.99Å; Y320-Q445 WeakPolarHBondContact OH-CB 3.38Å
321	A	89.5	Confident	90	Very high	5 Å²	5	48.5 Å²	48.5	4%	0.041	24%	0.237	C	C	.	.	I	π-helix	trans	-91.4	-31.7	178.5	0	0	0	0	0	113.7	I317 K385 Y389	I317-A321 HydrophobicContact CG2-CB 4.07Å; I317-A321 WeakPolarHBondContact O-CA 3.29Å; I317-A321 WeakPolarHBondContact O-CB 3.49Å; I317-A321 PolarHBondContact O-N 2.99Å; A321-K385 HydrophobicContact CB-CD 4.13Å; A321-K385 HydrophobicContact CB-CG 4.26Å; A321-K385 WeakPolarHBondContact O-CE 3.44Å; A321-K385 PolarHBondContact O-NZ 3.18Å; A321-Y389 HydrophobicContact CB-CD1 3.71Å; A321-Y389 HydrophobicContact CB-CD2 3.86Å; A321-Y389 HydrophobicContact CB-CE1 3.66Å; A321-Y389 HydrophobicContact CB-CE2 3.84Å; A321-Y389 HydrophobicContact CB-CG 3.8Å
322	F	89.3	Confident	88.6	Confident	24 Å²	24	48.2 Å²	48.2	11%	0.105	23%	0.233	C	C	.	.	I	π-helix	trans	-118.6	-15.5	-172	-59.4	-81.2	0	0	0	115	I317 Y318 K341 I349 L378 D382 K385 V386	I317-F322 HydrophobicContact CG2-CE2 4.29Å; Y318-F322 WeakPolarHBondContact O-CB 3.32Å; Y318-F322 PolarHBondContact O-N 2.79Å; F322-K341 HydrophobicContact CB-CG 4.11Å; F322-K341 HydrophobicContact CD1-CD 4.35Å; F322-K341 HydrophobicContact CD1-CG 3.49Å; F322-K341 VanDerWaalsContact CD1-CG 3.49Å; F322-K341 HydrophobicContact CE1-CG 4.11Å; F322-K341 HydrophobicContact CG-CG 3.92Å; F322-I349 HydrophobicContact CD2-CD1 4.04Å; F322-I349 HydrophobicContact CE2-CD1 3.89Å; F322-L378 HydrophobicContact CZ-CD2 4.15Å; F322-D382 HydrophobicContact CE1-CB 4.19Å; F322-D382 WeakPolarHBondContact CE1-OD1 3.49Å; F322-D382 HydrophobicContact CZ-CB 4.17Å; F322-K385 HydrophobicContact CE1-CD 4.32Å; F322-K385 HydrophobicContact CZ-CD 4.38Å; F322-V386 HydrophobicContact CE2-CG2 4.35Å
323	C	87.9	Confident	86.8	Confident	44 Å²	44	46.3 Å²	46.3	30%	0.297	23%	0.227	S	C	.	.	I	π-helix	trans	-115	-32.1	179.1	-61.2	0	0	0	0	114.9	Y318 K319 H325	Y318-C323 VanDerWaalsContact CE1-SG 3.52Å; Y318-C323 PolarHBondContact O-N 3.41Å; Y318-C323 PolarHBondContact O-SG 3.11Å; K319-C323 CarbonylContact O-C 3.59Å; K319-C323 WeakPolarHBondContact O-CB 3.31Å; K319-C323 PolarHBondContact O-N 2.78Å; C323-H325 PolarHBondContact O-CE1 2.67Å; C323-H325 PolarHBondContact O-N 2.82Å; C323-H325 PolarHBondContact O-ND1 2.69Å
324	K	85.7	Confident	84.9	Confident	128 Å²	128	53.4 Å²	53.4	56%	0.557	26%	0.259	S	S	*	.	P	Polyproline II helix	trans	-61.9	128	172.3	-172.3	-176.7	176.3	-170.8	0	108.6	K319 Y320	K319-K324 PolarHBondContact O-N 3.18Å; Y320-K324 HydrophobicContact CD1-CD 4.05Å; Y320-K324 HydrophobicContact CE1-CD 4.44Å
325	H	84.1	Confident	83.2	Confident	124 Å²	124	55.1 Å²	55.1	57%	0.574	27%	0.272	S	S	*	.	P	Polyproline II helix	trans	-88.3	150.3	174	-67.5	48.6	0	0	0	109.1	C323	C323-H325 PolarHBondContact O-CE1 2.67Å; C323-H325 PolarHBondContact O-N 2.82Å; C323-H325 PolarHBondContact O-ND1 2.69Å
326	T	86.8	Confident	81.5	Confident	71 Å²	71	56.1 Å²	56.1	44%	0.436	27%	0.27	S	S	.	.	P	Polyproline II helix	trans	-64.5	151.2	165.5	47.8	0	0	0	0	110.2	S328 Q330 E742	T326-S328 VanDerWaalsContact C-N 3.3Å; T326-S328 WeakPolarHBondContact CB-O 3.34Å; T326-S328 PolarHBondContact OG1-O 2.83Å; T326-Q330 HydrophobicContact CG2-CB 4.2Å; T326-Q330 HydrophobicContact CG2-CG 4.09Å; T326-E742 WeakPolarHBondContact CA-OE1 3.34Å; T326-E742 VanDerWaalsContact CB-CD 3.47Å; T326-E742 VanDerWaalsContact CB-OE1 3.28Å; T326-E742 WeakPolarHBondContact CB-OE1 3.17Å; T326-E742 HydrophobicContact CG2-CG 3.98Å
327	V	89.8	Confident	79.7	Confident	25 Å²	25	63.9 Å²	63.9	15%	0.152	31%	0.307	C	S	.	.	S	Bend	trans	-69.7	-33.6	176	-165.6	0	0	0	0	110.2	F616 V650 S651 L735 T738 L739 E742	V327-F616 HydrophobicContact CG1-CB 4.32Å; V327-F616 HydrophobicContact CG2-CD2 3.92Å; V327-V650 HydrophobicContact CG1-CG1 3.84Å; V327-S651 WeakPolarHBondContact O-CA 3.42Å; V327-S651 WeakPolarHBondContact O-CB 3.35Å; V327-L735 HydrophobicContact CG1-CD1 3.95Å; V327-T738 HydrophobicContact CG2-CG2 3.74Å; V327-L739 HydrophobicContact CB-CD2 4.29Å; V327-E742 PolarHBondContact N-OE1 2.85Å; V327-E742 PolarHBondContact N-OE2 3.42Å
328	S	91	Very high	78.1	Confident	6 Å²	6	70.7 Å²	70.7	4%	0.042	34%	0.336	C	S	.	.	S	Bend	trans	-102.7	162.1	175.7	61.2	0	0	0	0	113.7	T326 Q330 L653 E742	T326-S328 VanDerWaalsContact C-N 3.3Å; T326-S328 WeakPolarHBondContact CB-O 3.34Å; T326-S328 PolarHBondContact OG1-O 2.83Å; S328-Q330 VanDerWaalsContact C-N 3.35Å; S328-Q330 PolarHBondContact O-N 3.47Å; S328-Q330 WeakPolarHBondContact OG-CG 3.49Å; S328-Q330 PolarHBondContact OG-NE2 2.8Å; S328-L653 WeakPolarHBondContact CB-O 3.41Å; S328-E742 WeakPolarHBondContact CB-OE2 3.22Å; S328-E742 PolarHBondContact N-OE2 2.82Å; S328-E742 PolarHBondContact OG-OE2 2.7Å
329	E	86	Confident	76.6	Confident	56 Å²	56	73.1 Å²	73.1	26%	0.262	35%	0.35	S	S	.	.	B	Isolated β-bridge	trans	-75.8	81.1	176.4	-168.2	-172.4	-161.5	0	0	110.5	E331 P333 L653 F654 G655	E329-E331 VanDerWaalsContact C-N 3.31Å; E329-E331 WeakPolarHBondContact CG-O 3.41Å; E329-E331 PolarHBondContact O-N 3.1Å; E329-P333 WeakPolarHBondContact OE1-CD 3.44Å; E329-L653 PolarHBondContact N-O 2.73Å; E329-F654 HydrophobicContact CB-CD2 4.09Å; E329-F654 HydrophobicContact CG-CD2 3.88Å; E329-F654 HydrophobicContact CG-CE2 4.35Å; E329-F654 WeakPolarHBondContact O-CA 3.24Å; E329-F654 WeakPolarHBondContact O-CD2 3.5Å; E329-G655 PolarHBondContact O-N 2.72Å
330	Q	81.8	Confident	75.6	Confident	7 Å²	7	78 Å²	78	3%	0.033	37%	0.366	C	S	.	.			trans	-83.2	-0.9	-179.4	-67.5	-58.9	-21.6	0	0	114.9	T326 S328 G655 E742 R749	T326-Q330 HydrophobicContact CG2-CB 4.2Å; T326-Q330 HydrophobicContact CG2-CG 4.09Å; S328-Q330 VanDerWaalsContact C-N 3.35Å; S328-Q330 PolarHBondContact O-N 3.47Å; S328-Q330 WeakPolarHBondContact OG-CG 3.49Å; S328-Q330 PolarHBondContact OG-NE2 2.8Å; Q330-G655 PolarHBondContact NE2-O 2.85Å; Q330-G655 VanDerWaalsContact OE1-CA 3.28Å; Q330-E742 HydrophobicContact CG-CB 3.97Å; Q330-E742 HydrophobicContact CG-CG 4.49Å; Q330-E742 PolarHBondContact OE1-O 3.11Å; Q330-R749 PolarHBondContact O-NH2 3.27Å
331	E	72.6	Confident	75.2	Confident	50 Å²	50	77.5 Å²	77.5	23%	0.234	37%	0.365	C	S	.	.	S	Bend	trans	-149.8	147.1	-178.3	-66.8	-179	-175.7	0	0	112.1	E329 M339 R749	E329-E331 VanDerWaalsContact C-N 3.31Å; E329-E331 WeakPolarHBondContact CG-O 3.41Å; E329-E331 PolarHBondContact O-N 3.1Å; E331-M339 VanDerWaalsContact OE1-CE 3.24Å; E331-M339 WeakPolarHBondContact OE1-CE 3.24Å; E331-R749 IonicContact OE1-CZ 2.8Å; E331-R749 IonicContact OE1-NH1 3.31Å; E331-R749 PolarHBondContact OE1-NH1 2.81Å
332	K	65.6	Low	75.2	Confident	58 Å²	58	80 Å²	80	25%	0.252	38%	0.38	S	S	.	.			trans	-59.1	142.9	171.1	-65.9	176.1	-179.7	173.1	0	110.1	E334 S335 R336 L1724	K332-E334 PolarHBondContact O-N 2.89Å; K332-E334 VanDerWaalsContact O-N 3.13Å; K332-S335 WeakPolarHBondContact O-CB 3.35Å; K332-S335 PolarHBondContact O-N 3.33Å; K332-R336 PolarHBondContact O-N 3.06Å; K332-L1724 PolarHBondContact NZ-O 2.84Å
333	P	56.5	Low	75.1	Confident	66 Å²	66	83.5 Å²	83.5	43%	0.429	41%	0.406	S	S	.	.	H	α-helix	trans	-61.8	-28.7	-176.7	23.1	-33.8	0	0	0	113.6	E329 S335 R336 E337	E329-P333 WeakPolarHBondContact OE1-CD 3.44Å; P333-S335 PolarHBondContact O-N 3.37Å; P333-R336 PolarHBondContact O-N 2.87Å; P333-E337 PolarHBondContact O-N 2.93Å
334	E	53.6	Low	75.2	Confident	148 Å²	148	85.3 Å²	85.3	69%	0.692	42%	0.415	S	S	*	.	H	α-helix	trans	-68.2	-17.7	174.1	-64.1	-176.9	-159.9	0	0	114.2	K332 K338	K332-E334 PolarHBondContact O-N 2.89Å; K332-E334 VanDerWaalsContact O-N 3.13Å; E334-K338 WeakPolarHBondContact O-CD 3.34Å; E334-K338 WeakPolarHBondContact O-CE 3.34Å; E334-K338 PolarHBondContact O-NZ 2.99Å
335	S	61.9	Low	75.6	Confident	37 Å²	37	79.2 Å²	79.2	26%	0.259	39%	0.389	S	S	.	.	H	α-helix	trans	-86.6	-39.1	171	-61.4	0	0	0	0	110.8	K332 P333 E337 K338 M339	K332-S335 WeakPolarHBondContact O-CB 3.35Å; K332-S335 PolarHBondContact O-N 3.33Å; P333-S335 PolarHBondContact O-N 3.37Å; S335-E337 VanDerWaalsContact C-N 3.31Å; S335-E337 PolarHBondContact O-N 2.89Å; S335-K338 WeakPolarHBondContact O-CA 3.24Å; S335-K338 WeakPolarHBondContact O-CB 3.29Å; S335-K338 PolarHBondContact O-N 3.47Å; S335-M339 PolarHBondContact O-N 3.41Å; S335-M339 VanDerWaalsContact O-N 3.09Å
336	R	59.7	Low	76.1	Confident	147 Å²	147	74.5 Å²	74.5	56%	0.555	37%	0.369	S	S	*	.	H	α-helix	trans	-58.8	-37	-176.7	-157.1	174.9	76.6	-176	7.3	113.6	K332 P333 K338	K332-R336 PolarHBondContact O-N 3.06Å; P333-R336 PolarHBondContact O-N 2.87Å; R336-K338 VanDerWaalsContact C-N 3.33Å; R336-K338 PolarHBondContact O-N 3.25Å
337	E	57.9	Low	76.4	Confident	178 Å²	178	76.3 Å²	76.3	83%	0.832	38%	0.376	S	S	*	.	H	α-helix	trans	-68	-28.9	173.6	-70.2	-165.9	157.1	0	0	113.5	P333 S335	P333-E337 PolarHBondContact O-N 2.93Å; S335-E337 VanDerWaalsContact C-N 3.31Å; S335-E337 PolarHBondContact O-N 2.89Å
338	K	60.7	Low	76.7	Confident	143 Å²	143	77 Å²	77	62%	0.622	38%	0.377	S	S	*	.	H	α-helix	trans	-80.8	-27.9	179.6	-56.6	169.2	-171.4	134.5	0	112.6	E334 S335 R336	E334-K338 WeakPolarHBondContact O-CD 3.34Å; E334-K338 WeakPolarHBondContact O-CE 3.34Å; E334-K338 PolarHBondContact O-NZ 2.99Å; S335-K338 WeakPolarHBondContact O-CA 3.24Å; S335-K338 WeakPolarHBondContact O-CB 3.29Å; S335-K338 PolarHBondContact O-N 3.47Å; R336-K338 VanDerWaalsContact C-N 3.33Å; R336-K338 PolarHBondContact O-N 3.25Å
339	M	63.8	Low	76.9	Confident	85 Å²	85	76.7 Å²	76.7	42%	0.419	38%	0.375	S	S	.	.	H	α-helix	trans	-88.2	-13.5	-174.4	-74.6	176.7	54.1	0	0	114.1	E331 S335 K341	E331-M339 VanDerWaalsContact OE1-CE 3.24Å; E331-M339 WeakPolarHBondContact OE1-CE 3.24Å; S335-M339 PolarHBondContact O-N 3.41Å; S335-M339 VanDerWaalsContact O-N 3.09Å; M339-K341 PolarHBondContact O-N 3.22Å
340	R	71.5	Confident	77.4	Confident	197 Å²	197	77 Å²	77	74%	0.743	38%	0.375	S	S	*	.			trans	-69.4	101.5	174	-172.3	178.6	-175.3	173.6	4.6	111
341	K	84	Confident	77.9	Confident	29 Å²	29	79.9 Å²	79.9	13%	0.126	39%	0.388	C	S	.	.			trans	-66.4	151.7	175.4	-52.8	-59.4	-175.8	170.5	0	111.9	Y318 F322 M339 T345 E377 D382	Y318-K341 HydrophobicContact CE2-CB 4.19Å; Y318-K341 PolarHBondContact OH-O 3.25Å; F322-K341 HydrophobicContact CB-CG 4.11Å; F322-K341 HydrophobicContact CD1-CD 4.35Å; F322-K341 HydrophobicContact CD1-CG 3.49Å; F322-K341 VanDerWaalsContact CD1-CG 3.49Å; F322-K341 HydrophobicContact CE1-CG 4.11Å; F322-K341 HydrophobicContact CG-CG 3.92Å; M339-K341 PolarHBondContact O-N 3.22Å; K341-T345 HydrophobicContact CB-CG2 4.22Å; K341-T345 HydrophobicContact CG-CG2 4.39Å; K341-E377 WeakPolarHBondContact CE-O 3.28Å; K341-E377 PolarHBondContact NZ-O 2.89Å; K341-D382 WeakPolarHBondContact CE-OD1 3.48Å; K341-D382 IonicContact NZ-OD1 3.58Å; K341-D382 PolarHBondContact NZ-OD1 3.19Å; K341-D382 IonicContact NZ-OD2 2.71Å; K341-D382 PolarHBondContact NZ-OD2 3.24Å
342	P	88.2	Confident	79	Confident	57 Å²	57	77.5 Å²	77.5	37%	0.37	38%	0.377	S	S	.	.			trans	-75.9	158.8	170.7	32.4	-36.3	0	0	0	112.2	Y318 T344 T345 E377	Y318-P342 WeakPolarHBondContact CE2-O 3.47Å; P342-T344 VanDerWaalsContact CG-OG1 3.31Å; P342-T344 WeakPolarHBondContact CG-OG1 2.77Å; P342-T344 PolarHBondContact O-N 3.24Å; P342-T344 VanDerWaalsContact O-N 3.12Å; P342-T345 WeakPolarHBondContact CD-OG1 3.32Å; P342-T345 VanDerWaalsContact O-CB 3.28Å; P342-T345 WeakPolarHBondContact O-CB 3.49Å; P342-T345 PolarHBondContact O-N 3.43Å; P342-T345 PolarHBondContact O-OG1 3.42Å; P342-T345 VanDerWaalsContact O-OG1 3.08Å; P342-E377 HydrophobicContact CG-CG 4.09Å; P342-E377 WeakPolarHBondContact CG-OE2 3.34Å
343	P	88.5	Confident	80.5	Confident	98 Å²	98	74.7 Å²	74.7	64%	0.636	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-22.2	177.6	-25.6	35.3	0	0	0	115.1	Y318 T345 V346	Y318-P343 WeakPolarHBondContact OH-CA 3.47Å; P343-T345 PolarHBondContact O-N 3.46Å; P343-T345 VanDerWaalsContact O-N 3.16Å; P343-V346 WeakPolarHBondContact O-CG2 3.36Å; P343-V346 PolarHBondContact O-N 3.39Å
344	T	90.3	Very high	82.3	Confident	82 Å²	82	75.2 Å²	75.2	50%	0.503	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-21.9	173.5	47.3	0	0	0	0	113.3	P342 V346 N347 E377	P342-T344 VanDerWaalsContact CG-OG1 3.31Å; P342-T344 WeakPolarHBondContact CG-OG1 2.77Å; P342-T344 PolarHBondContact O-N 3.24Å; P342-T344 VanDerWaalsContact O-N 3.12Å; T344-V346 PolarHBondContact O-N 3.18Å; T344-N347 PolarHBondContact O-N 3.22Å; T344-E377 WeakPolarHBondContact CB-OE2 3.37Å; T344-E377 PolarHBondContact OG1-OE2 2.96Å
345	T	92.7	Very high	84.3	Confident	0 Å²	0	68.6 Å²	68.6	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-67.9	-20.1	-178	-56.3	0	0	0	0	112.6	K341 P342 P343 N347 K348 I349 E377 L378	K341-T345 HydrophobicContact CB-CG2 4.22Å; K341-T345 HydrophobicContact CG-CG2 4.39Å; P342-T345 WeakPolarHBondContact CD-OG1 3.32Å; P342-T345 VanDerWaalsContact O-CB 3.28Å; P342-T345 WeakPolarHBondContact O-CB 3.49Å; P342-T345 PolarHBondContact O-N 3.43Å; P342-T345 PolarHBondContact O-OG1 3.42Å; P342-T345 VanDerWaalsContact O-OG1 3.08Å; P343-T345 PolarHBondContact O-N 3.46Å; P343-T345 VanDerWaalsContact O-N 3.16Å; T345-N347 VanDerWaalsContact C-N 3.31Å; T345-N347 PolarHBondContact O-N 2.87Å; T345-K348 PolarHBondContact O-N 3.35Å; T345-I349 HydrophobicContact CG2-CD1 4.13Å; T345-I349 HydrophobicContact CG2-CG1 4.23Å; T345-I349 WeakPolarHBondContact O-CG1 3.26Å; T345-I349 PolarHBondContact O-N 2.95Å; T345-E377 WeakPolarHBondContact CA-OE2 3.47Å; T345-E377 HydrophobicContact CG2-CB 4.29Å; T345-E377 PolarHBondContact N-OE2 3.14Å; T345-E377 PolarHBondContact OG1-OE2 3.12Å; T345-L378 HydrophobicContact CG2-CD2 3.63Å; T345-L378 HydrophobicContact CG2-CG 4.06Å
346	V	95.2	Very high	85.8	Confident	25 Å²	25	66.9 Å²	66.9	15%	0.152	32%	0.319	C	S	.	.	H	α-helix	trans	-53.8	-47	173.1	177	0	0	0	0	111.1	A314 E315 Y318 P343 T344 K348 I349 K350	A314-V346 HydrophobicContact CB-CG1 4.03Å; E315-V346 HydrophobicContact CG-CG1 3.98Å; Y318-V346 HydrophobicContact CD1-CG2 3.81Å; Y318-V346 HydrophobicContact CD2-CG2 4.06Å; Y318-V346 HydrophobicContact CE1-CG2 4.49Å; Y318-V346 HydrophobicContact CG-CG2 3.57Å; P343-V346 WeakPolarHBondContact O-CG2 3.36Å; P343-V346 PolarHBondContact O-N 3.39Å; T344-V346 PolarHBondContact O-N 3.18Å; V346-K348 PolarHBondContact O-N 3.02Å; V346-I349 PolarHBondContact O-N 2.88Å; V346-K350 PolarHBondContact O-N 3.2Å
347	N	94	Very high	87.4	Confident	109 Å²	109	60 Å²	60	58%	0.583	29%	0.293	S	S	*	.	H	α-helix	trans	-61.5	-31.4	179.7	-65.3	0.3	0	0	0	112.4	T344 T345 Q351	T344-N347 PolarHBondContact O-N 3.22Å; T345-N347 VanDerWaalsContact C-N 3.31Å; T345-N347 PolarHBondContact O-N 2.87Å; N347-Q351 WeakPolarHBondContact O-CG 3.43Å; N347-Q351 PolarHBondContact O-N 3.38Å; N347-Q351 VanDerWaalsContact O-N 3.09Å
348	K	94.7	Very high	89	Confident	38 Å²	38	54.1 Å²	54.1	17%	0.165	27%	0.267	C	S	.	.	H	α-helix	trans	-83.4	-30.1	-179.8	-59.4	-167.6	164.7	168.5	0	112.4	T345 V346 T352 Y373 K375 E377 L378	T345-K348 PolarHBondContact O-N 3.35Å; V346-K348 PolarHBondContact O-N 3.02Å; K348-T352 WeakPolarHBondContact O-CB 3.4Å; K348-T352 PolarHBondContact O-N 2.87Å; K348-T352 PolarHBondContact O-OG1 2.84Å; K348-Y373 WeakPolarHBondContact CD-O 3.1Å; K348-Y373 WeakPolarHBondContact CE-O 3.47Å; K348-Y373 WeakPolarHBondContact CG-O 3.47Å; K348-K375 PolarHBondContact NZ-O 3.33Å; K348-E377 HydrophobicContact CD-CB 4.23Å; K348-E377 WeakPolarHBondContact CD-OE1 3.25Å; K348-E377 VanDerWaalsContact CE-OE1 3.3Å; K348-E377 WeakPolarHBondContact CE-OE1 3.29Å; K348-E377 IonicContact NZ-OE1 3.81Å; K348-E377 PolarHBondContact NZ-OE1 3.26Å; K348-L378 HydrophobicContact CB-CD1 3.97Å
349	I	96	Very high	90.6	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-64.3	-47.5	166.5	-65.5	164.2	0	0	0	109.1	A314 I317 Y318 F322 T345 V346 Q351 T352 L353 L378 V386	A314-I349 HydrophobicContact CB-CB 4.24Å; A314-I349 HydrophobicContact CB-CG2 3.95Å; I317-I349 HydrophobicContact CB-CG2 4.04Å; I317-I349 HydrophobicContact CD1-CG2 4.42Å; I317-I349 HydrophobicContact CG2-CD1 4.4Å; I317-I349 HydrophobicContact CG2-CG2 3.97Å; Y318-I349 HydrophobicContact CD2-CD1 4.34Å; F322-I349 HydrophobicContact CD2-CD1 4.04Å; F322-I349 HydrophobicContact CE2-CD1 3.89Å; T345-I349 HydrophobicContact CG2-CD1 4.13Å; T345-I349 HydrophobicContact CG2-CG1 4.23Å; T345-I349 WeakPolarHBondContact O-CG1 3.26Å; T345-I349 PolarHBondContact O-N 2.95Å; V346-I349 PolarHBondContact O-N 2.88Å; I349-Q351 PolarHBondContact O-N 2.99Å; I349-T352 CarbonylContact O-C 3.6Å; I349-T352 WeakPolarHBondContact O-CA 3.39Å; I349-T352 WeakPolarHBondContact O-CB 3.36Å; I349-T352 PolarHBondContact O-N 2.63Å; I349-L353 HydrophobicContact CG2-CD1 4.01Å; I349-L353 HydrophobicContact CG2-CG 4.35Å; I349-L353 WeakPolarHBondContact O-CG 3.37Å; I349-L353 PolarHBondContact O-N 2.66Å; I349-L378 HydrophobicContact CG1-CD1 4.33Å; I349-V386 HydrophobicContact CG1-CG2 4.04Å; I349-V386 HydrophobicContact CG2-CG1 4.1Å; I349-V386 HydrophobicContact CG2-CG2 4.17Å
350	K	95.5	Very high	92	Very high	62 Å²	62	47.3 Å²	47.3	27%	0.27	24%	0.236	S	C	.	.	H	α-helix	trans	-54.7	-50.4	175	-175.2	179.5	-177.3	175.3	0	112.5	L310 D311 A314 V346 T352 L353 E354	L310-K350 HydrophobicContact CB-CG 4.2Å; D311-K350 WeakPolarHBondContact OD1-CD 3.42Å; D311-K350 WeakPolarHBondContact OD1-CE 3.45Å; D311-K350 IonicContact OD1-NZ 3.42Å; D311-K350 PolarHBondContact OD1-NZ 2.98Å; D311-K350 VanDerWaalsContact OD2-CE 3.3Å; D311-K350 WeakPolarHBondContact OD2-CE 3.43Å; D311-K350 IonicContact OD2-NZ 2.7Å; D311-K350 PolarHBondContact OD2-NZ 3.16Å; A314-K350 HydrophobicContact CB-CB 3.84Å; V346-K350 PolarHBondContact O-N 3.2Å; K350-T352 VanDerWaalsContact C-N 3.28Å; K350-T352 PolarHBondContact O-N 3.03Å; K350-L353 PolarHBondContact O-N 3.25Å; K350-E354 PolarHBondContact O-N 3.35Å
351	Q	93.7	Very high	93.2	Very high	68 Å²	68	38.1 Å²	38.1	32%	0.318	20%	0.202	S	C	.	.	H	α-helix	trans	-61.7	-35	176.4	-72.2	170.5	-1.5	0	0	112.4	N347 I349 F355 Y373	N347-Q351 WeakPolarHBondContact O-CG 3.43Å; N347-Q351 PolarHBondContact O-N 3.38Å; N347-Q351 VanDerWaalsContact O-N 3.09Å; I349-Q351 PolarHBondContact O-N 2.99Å; Q351-F355 WeakPolarHBondContact O-CD2 3.13Å; Q351-F355 VanDerWaalsContact O-CG 3.26Å; Q351-F355 WeakPolarHBondContact O-CG 3.39Å; Q351-F355 PolarHBondContact O-N 3.31Å; Q351-F355 VanDerWaalsContact O-N 3.09Å; Q351-Y373 PolarHBondContact OE1-O 3.24Å
352	T	95.8	Very high	93.7	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-65.9	-44.2	173.7	-58.7	0	0	0	0	111.9	K348 I349 K350 F355 I356 I366 L383 V386	K348-T352 WeakPolarHBondContact O-CB 3.4Å; K348-T352 PolarHBondContact O-N 2.87Å; K348-T352 PolarHBondContact O-OG1 2.84Å; I349-T352 CarbonylContact O-C 3.6Å; I349-T352 WeakPolarHBondContact O-CA 3.39Å; I349-T352 WeakPolarHBondContact O-CB 3.36Å; I349-T352 PolarHBondContact O-N 2.63Å; K350-T352 VanDerWaalsContact C-N 3.28Å; K350-T352 PolarHBondContact O-N 3.03Å; T352-F355 PolarHBondContact O-N 3.26Å; T352-I356 HydrophobicContact CG2-CD1 3.81Å; T352-I356 WeakPolarHBondContact O-CG1 3.18Å; T352-I356 PolarHBondContact O-N 3.23Å; T352-I366 HydrophobicContact CG2-CD1 4.4Å; T352-L383 HydrophobicContact CG2-CD2 3.54Å; T352-L383 WeakPolarHBondContact OG1-CD2 3.49Å; T352-V386 HydrophobicContact CG2-CB 4.25Å; T352-V386 HydrophobicContact CG2-CG1 3.85Å
353	L	95.5	Very high	94.1	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-64.6	-39	176.6	-65.7	165.8	0	0	0	111.6	L310 E313 A314 I317 I349 K350 F355 I356 R357 V386 D390	L310-L353 HydrophobicContact CD2-CB 3.74Å; E313-L353 HydrophobicContact CB-CD1 3.99Å; E313-L353 HydrophobicContact CG-CD1 3.64Å; E313-L353 HydrophobicContact CG-CD2 4.23Å; A314-L353 HydrophobicContact CB-CD1 4.14Å; I317-L353 HydrophobicContact CD1-CD1 4.21Å; I317-L353 HydrophobicContact CD1-CD2 3.85Å; I317-L353 HydrophobicContact CD1-CG 4.5Å; I349-L353 HydrophobicContact CG2-CD1 4.01Å; I349-L353 HydrophobicContact CG2-CG 4.35Å; I349-L353 WeakPolarHBondContact O-CG 3.37Å; I349-L353 PolarHBondContact O-N 2.66Å; K350-L353 PolarHBondContact O-N 3.25Å; L353-F355 VanDerWaalsContact C-N 3.34Å; L353-F355 PolarHBondContact O-N 3.48Å; L353-I356 PolarHBondContact O-N 3.11Å; L353-R357 WeakPolarHBondContact O-CB 3.32Å; L353-R357 PolarHBondContact O-N 2.96Å; L353-V386 HydrophobicContact CD2-CG1 3.84Å; L353-V386 HydrophobicContact CG-CG1 4.13Å; L353-D390 HydrophobicContact CD2-CB 3.78Å; L353-D390 WeakPolarHBondContact CD2-OD1 3.33Å
354	E	94.6	Very high	94.4	Very high	76 Å²	76	29.5 Å²	29.5	36%	0.355	15%	0.149	S	C	.	.	I	π-helix	trans	-60.4	-42.8	173.2	-167.9	-169.1	147.5	0	0	111.6	L310 K350 N358 Q359	L310-E354 HydrophobicContact CD1-CB 4.4Å; K350-E354 PolarHBondContact O-N 3.35Å; E354-N358 WeakPolarHBondContact O-CB 3.25Å; E354-N358 PolarHBondContact O-N 3.37Å; E354-N358 VanDerWaalsContact O-N 3.08Å; E354-Q359 PolarHBondContact O-N 2.87Å; E354-Q359 VanDerWaalsContact O-N 3.08Å
355	F	95.4	Very high	94.7	Very high	10 Å²	10	25.6 Å²	25.6	4%	0.044	13%	0.125	C	C	.	.	I	π-helix	trans	-64	-40.8	174	-64.7	-36.9	0	0	0	112.7	Q351 T352 L353 Q359 Q360 L361 I366 R370 Y373	Q351-F355 WeakPolarHBondContact O-CD2 3.13Å; Q351-F355 VanDerWaalsContact O-CG 3.26Å; Q351-F355 WeakPolarHBondContact O-CG 3.39Å; Q351-F355 PolarHBondContact O-N 3.31Å; Q351-F355 VanDerWaalsContact O-N 3.09Å; T352-F355 PolarHBondContact O-N 3.26Å; L353-F355 VanDerWaalsContact C-N 3.34Å; L353-F355 PolarHBondContact O-N 3.48Å; F355-Q359 HydrophobicContact CD1-CG 4.48Å; F355-Q359 CarbonylContact O-C 3.52Å; F355-Q359 WeakPolarHBondContact O-CB 3.46Å; F355-Q359 PolarHBondContact O-N 3.24Å; F355-Q360 PolarHBondContact O-N 2.85Å; F355-Q360 VanDerWaalsContact O-N 3.07Å; F355-L361 HydrophobicContact CB-CB 4.32Å; F355-L361 HydrophobicContact CB-CD1 4.1Å; F355-L361 HydrophobicContact CD1-CD1 4.06Å; F355-L361 HydrophobicContact CG-CD1 4.28Å; F355-L361 WeakPolarHBondContact O-CB 3.36Å; F355-L361 PolarHBondContact O-N 3.21Å; F355-I366 HydrophobicContact CB-CD1 3.59Å; F355-I366 HydrophobicContact CB-CG1 3.86Å; F355-I366 HydrophobicContact CD2-CD1 4.44Å; F355-I366 HydrophobicContact CD2-CG1 4.2Å; F355-I366 HydrophobicContact CD2-CG2 4.06Å; F355-I366 HydrophobicContact CG-CD1 4.48Å; F355-I366 HydrophobicContact CG-CG1 4.36Å; F355-R370 HydrophobicContact CD2-CB 4.26Å; F355-R370 HydrophobicContact CE1-CG 4.5Å; F355-R370 HydrophobicContact CE2-CB 3.76Å; F355-R370 HydrophobicContact CE2-CG 4.26Å; F355-R370 HydrophobicContact CZ-CB 4.08Å; F355-R370 HydrophobicContact CZ-CG 4.23Å; F355-Y373 HydrophobicContact CE2-CD2 4.02Å; F355-Y373 HydrophobicContact CE2-CG 4.04Å; F355-Y373 HydrophobicContact CZ-CD1 4.37Å; F355-Y373 AromaticContact CZ-CD2 3.67Å; F355-Y373 HydrophobicContact CZ-CD2 3.67Å; F355-Y373 HydrophobicContact CZ-CE2 4.15Å; F355-Y373 AromaticContact CZ-CG 3.81Å; F355-Y373 HydrophobicContact CZ-CG 3.81Å
356	I	94.6	Very high	94.9	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	13%	0.125	C	C	.	.	I	π-helix	trans	-71.1	-59.3	179.7	-68.1	165.2	0	0	0	111.1	M293 V300 T352 L353 Q360 I366 Y387	M293-I356 HydrophobicContact CE-CG2 4.23Å; V300-I356 HydrophobicContact CG1-CG2 4.27Å; T352-I356 HydrophobicContact CG2-CD1 3.81Å; T352-I356 WeakPolarHBondContact O-CG1 3.18Å; T352-I356 PolarHBondContact O-N 3.23Å; L353-I356 PolarHBondContact O-N 3.11Å; I356-Q360 VanDerWaalsContact O-CA 3.26Å; I356-Q360 WeakPolarHBondContact O-CA 3.49Å; I356-Q360 PolarHBondContact O-N 3.4Å; I356-I366 HydrophobicContact CG1-CD1 3.82Å; I356-Y387 HydrophobicContact CD1-CD2 4.2Å; I356-Y387 HydrophobicContact CG2-CD2 4.06Å; I356-Y387 HydrophobicContact CG2-CE2 4.4Å
357	R	92.4	Very high	94.8	Very high	4 Å²	4	25 Å²	25	2%	0.015	12%	0.122	C	C	.	.	I	π-helix	trans	-78.1	-41.4	-169.2	-62.8	-173.2	65.5	-175.7	-1.6	113.1	V300 T301 P302 E309 E313 L353 D390	V300-R357 HydrophobicContact CG1-CG 4.39Å; T301-R357 PolarHBondContact O-NE 3.36Å; T301-R357 PolarHBondContact O-NH2 3.46Å; T301-R357 PolarHBondContact OG1-NH2 3.24Å; P302-R357 WeakPolarHBondContact CA-O 3.39Å; E309-R357 IonicContact OE1-CZ 3.21Å; E309-R357 VanDerWaalsContact OE1-CZ 3.28Å; E309-R357 IonicContact OE1-NH1 3.49Å; E309-R357 PolarHBondContact OE1-NH1 2.84Å; E309-R357 IonicContact OE1-NH2 3.24Å; E309-R357 PolarHBondContact OE1-NH2 3.31Å; E313-R357 IonicContact OE1-NH1 2.75Å; E313-R357 IonicContact OE2-CZ 2.76Å; E313-R357 IonicContact OE2-NH1 3.61Å; E313-R357 PolarHBondContact OE2-NH1 3.16Å; L353-R357 WeakPolarHBondContact O-CB 3.32Å; L353-R357 PolarHBondContact O-N 2.96Å; R357-D390 WeakPolarHBondContact CD-OD1 3.45Å; R357-D390 WeakPolarHBondContact CG-OD1 3.32Å
358	N	92.5	Very high	94.8	Very high	53 Å²	53	21.8 Å²	21.8	28%	0.283	10%	0.103	S	C	.	.	I	π-helix	trans	-100.7	-32.8	-173.1	-66.2	4.6	0	0	0	113.1	V303 E354	V303-N358 PolarHBondContact N-OD1 2.88Å; E354-N358 WeakPolarHBondContact O-CB 3.25Å; E354-N358 PolarHBondContact O-N 3.37Å; E354-N358 VanDerWaalsContact O-N 3.08Å
359	Q	93.1	Very high	94.8	Very high	53 Å²	53	21.2 Å²	21.2	25%	0.248	10%	0.1	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.8	-11.2	177.1	-54	-173.6	21.6	0	0	113.9	E354 F355 L361 R1030	E354-Q359 PolarHBondContact O-N 2.87Å; E354-Q359 VanDerWaalsContact O-N 3.08Å; F355-Q359 HydrophobicContact CD1-CG 4.48Å; F355-Q359 CarbonylContact O-C 3.52Å; F355-Q359 WeakPolarHBondContact O-CB 3.46Å; F355-Q359 PolarHBondContact O-N 3.24Å; Q359-L361 VanDerWaalsContact C-N 3.31Å; Q359-L361 HydrophobicContact CB-CD1 3.79Å; Q359-L361 HydrophobicContact CB-CG 3.78Å; Q359-L361 PolarHBondContact O-N 3.29Å; Q359-R1030 PolarHBondContact O-NH1 2.97Å
360	Q	94.6	Very high	94.6	Very high	32 Å²	32	22.7 Å²	22.7	15%	0.15	11%	0.106	C	C	.	.			trans	55.5	43.7	-178.4	-65	173.3	-31.6	0	0	112.6	P290 M293 F355 I356 N1034	P290-Q360 WeakPolarHBondContact CG-O 3.37Å; M293-Q360 HydrophobicContact SD-CB 4.21Å; F355-Q360 PolarHBondContact O-N 2.85Å; F355-Q360 VanDerWaalsContact O-N 3.07Å; I356-Q360 VanDerWaalsContact O-CA 3.26Å; I356-Q360 WeakPolarHBondContact O-CA 3.49Å; I356-Q360 PolarHBondContact O-N 3.4Å; Q360-N1034 PolarHBondContact O-ND2 3.36Å
361	L	95.8	Very high	94.5	Very high	5 Å²	5	20.6 Å²	20.6	3%	0.026	10%	0.097	C	C	.	.			trans	-99.6	126.3	178	-56.9	175.1	0	0	0	110	M293 F355 Q359 F365 I366 I1033 N1034	M293-L361 VanDerWaalsContact CE-C 3.46Å; M293-L361 VanDerWaalsContact CE-O 3.27Å; M293-L361 WeakPolarHBondContact CE-O 2.81Å; F355-L361 HydrophobicContact CB-CB 4.32Å; F355-L361 HydrophobicContact CB-CD1 4.1Å; F355-L361 HydrophobicContact CD1-CD1 4.06Å; F355-L361 HydrophobicContact CG-CD1 4.28Å; F355-L361 WeakPolarHBondContact O-CB 3.36Å; F355-L361 PolarHBondContact O-N 3.21Å; Q359-L361 VanDerWaalsContact C-N 3.31Å; Q359-L361 HydrophobicContact CB-CD1 3.79Å; Q359-L361 HydrophobicContact CB-CG 3.78Å; Q359-L361 PolarHBondContact O-N 3.29Å; L361-F365 HydrophobicContact CB-CD1 4Å; L361-F365 HydrophobicContact CD1-CD1 3.82Å; L361-F365 HydrophobicContact CD1-CE1 3.74Å; L361-F365 HydrophobicContact CD2-CD1 3.76Å; L361-F365 HydrophobicContact CD2-CE1 3.86Å; L361-F365 HydrophobicContact CD2-CG 4.26Å; L361-F365 HydrophobicContact CD2-CZ 4.43Å; L361-F365 HydrophobicContact CG-CD1 4.06Å; L361-F365 HydrophobicContact CG-CE1 4.3Å; L361-I366 HydrophobicContact CB-CD1 4.37Å; L361-I366 HydrophobicContact CB-CG1 4.05Å; L361-I366 WeakPolarHBondContact O-CD1 3.4Å; L361-I1033 HydrophobicContact CD2-CG2 3.76Å; L361-N1034 WeakPolarHBondContact CA-OD1 3.48Å
362	E	95.5	Very high	94.3	Very high	2 Å²	2	18.8 Å²	18.8	1%	0.009	9%	0.088	C	C	.	.			trans	-75.6	160.8	175.6	-72.9	-166.9	-107.7	0	0	112.6	P290 R292 M293 P364 F365 I366 G995 N1034	P290-E362 HydrophobicContact CB-CG 3.84Å; P290-E362 HydrophobicContact CG-CG 4.27Å; R292-E362 IonicContact CZ-OE1 3.2Å; R292-E362 IonicContact CZ-OE2 2.85Å; R292-E362 IonicContact NE-OE1 2.67Å; R292-E362 IonicContact NE-OE2 2.81Å; R292-E362 PolarHBondContact NE-OE2 3.32Å; R292-E362 IonicContact NH2-OE1 2.64Å; R292-E362 PolarHBondContact NH2-OE1 2.81Å; R292-E362 IonicContact NH2-OE2 3.97Å; R292-E362 PolarHBondContact NH2-OE2 3.23Å; M293-E362 HydrophobicContact CE-CG 4.05Å; E362-P364 VanDerWaalsContact C-CD 3.47Å; E362-F365 WeakPolarHBondContact O-CB 3.4Å; E362-F365 PolarHBondContact O-N 3.43Å; E362-I366 PolarHBondContact O-N 3.48Å; E362-I366 VanDerWaalsContact O-N 3.08Å; E362-G995 WeakPolarHBondContact OE1-CA 3.45Å; E362-G995 PolarHBondContact OE1-N 3.37Å; E362-N1034 PolarHBondContact N-OD1 3.48Å
363	V	95.7	Very high	94.1	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-51.1	-41.4	-179.2	169.8	0	0	0	0	114.3	I366 A367 I380 L383 W384 Y387	V363-I366 PolarHBondContact O-N 2.84Å; V363-A367 VanDerWaalsContact O-CB 3.25Å; V363-A367 WeakPolarHBondContact O-CB 3.43Å; V363-A367 PolarHBondContact O-N 3.14Å; V363-I380 HydrophobicContact CG1-CG1 3.92Å; V363-L383 HydrophobicContact CB-CB 4.49Å; V363-L383 HydrophobicContact CG1-CB 3.6Å; V363-L383 HydrophobicContact CG2-CB 4.26Å; V363-W384 HydrophobicContact CB-CD2 3.8Å; V363-W384 HydrophobicContact CB-CE3 4.07Å; V363-W384 HydrophobicContact CB-CG 4.35Å; V363-W384 HydrophobicContact CB-CH2 4.07Å; V363-W384 HydrophobicContact CB-CZ2 3.82Å; V363-W384 HydrophobicContact CB-CZ3 4.19Å; V363-W384 HydrophobicContact CG1-CD2 3.78Å; V363-W384 HydrophobicContact CG1-CG 3.82Å; V363-W384 HydrophobicContact CG1-CZ2 4.19Å; V363-W384 HydrophobicContact CG2-CD2 3.89Å; V363-W384 HydrophobicContact CG2-CE3 3.79Å; V363-W384 HydrophobicContact CG2-CG 4.39Å; V363-W384 HydrophobicContact CG2-CH2 4.46Å; V363-W384 HydrophobicContact CG2-CZ3 4.08Å; V363-Y387 HydrophobicContact CG2-CG 4.47Å
364	P	95.5	Very high	93.9	Very high	0 Å²	0	22 Å²	22	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-63.6	-44	176	-21	33.6	0	0	0	112.4	E362 I366 A367 F368 W384 I967 C994 F1038	E362-P364 VanDerWaalsContact C-CD 3.47Å; P364-I366 VanDerWaalsContact C-N 3.32Å; P364-I366 PolarHBondContact O-N 2.94Å; P364-A367 PolarHBondContact O-N 3.22Å; P364-F368 WeakPolarHBondContact O-CB 3.27Å; P364-F368 VanDerWaalsContact O-CD2 3.32Å; P364-F368 WeakPolarHBondContact O-CD2 3.39Å; P364-F368 PolarHBondContact O-N 2.96Å; P364-W384 HydrophobicContact CG-CZ2 4.16Å; P364-I967 HydrophobicContact CG-CG2 3.56Å; P364-C994 HydrophobicContact CB-CB 4.1Å; P364-C994 HydrophobicContact CG-CB 4.34Å; P364-F1038 HydrophobicContact CB-CE2 4.48Å; P364-F1038 HydrophobicContact CB-CZ 4.17Å
365	F	96.3	Very high	93.6	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-58.7	-45.6	176.3	-176.3	-83.1	0	0	0	111.1	L361 E362 A367 F368 Y369 R370 I1033 H1063	L361-F365 HydrophobicContact CB-CD1 4Å; L361-F365 HydrophobicContact CD1-CD1 3.82Å; L361-F365 HydrophobicContact CD1-CE1 3.74Å; L361-F365 HydrophobicContact CD2-CD1 3.76Å; L361-F365 HydrophobicContact CD2-CE1 3.86Å; L361-F365 HydrophobicContact CD2-CG 4.26Å; L361-F365 HydrophobicContact CD2-CZ 4.43Å; L361-F365 HydrophobicContact CG-CD1 4.06Å; L361-F365 HydrophobicContact CG-CE1 4.3Å; E362-F365 WeakPolarHBondContact O-CB 3.4Å; E362-F365 PolarHBondContact O-N 3.43Å; F365-A367 PolarHBondContact O-N 3.17Å; F365-F368 PolarHBondContact O-N 3.21Å; F365-Y369 AromaticContact CD2-CD2 3.54Å; F365-Y369 HydrophobicContact CD2-CD2 3.54Å; F365-Y369 HydrophobicContact CD2-CE2 4.19Å; F365-Y369 HydrophobicContact CD2-CG 4.5Å; F365-Y369 AromaticContact CE2-CD2 3.63Å; F365-Y369 HydrophobicContact CE2-CD2 3.63Å; F365-Y369 HydrophobicContact CE2-CE2 4.42Å; F365-Y369 HydrophobicContact CE2-CG 4.24Å; F365-Y369 HydrophobicContact CG-CD2 4.07Å; F365-Y369 HydrophobicContact CZ-CD2 4.24Å; F365-Y369 HydrophobicContact CZ-CG 4.47Å; F365-Y369 PolarHBondContact O-N 3.32Å; F365-R370 HydrophobicContact CD1-CG 4.29Å; F365-R370 HydrophobicContact CE1-CG 3.88Å; F365-I1033 HydrophobicContact CD2-CG2 4.32Å; F365-I1033 VanDerWaalsContact CD2-O 3.24Å; F365-I1033 WeakPolarHBondContact CD2-O 3.45Å; F365-I1033 HydrophobicContact CE1-CG2 4.39Å; F365-I1033 HydrophobicContact CE2-CG2 3.64Å; F365-I1033 WeakPolarHBondContact CE2-O 3.35Å; F365-I1033 HydrophobicContact CZ-CG2 3.68Å; F365-H1063 AromaticContact CE2-CD2 3.94Å; F365-H1063 AromaticContact CE2-CE1 3.97Å; F365-H1063 AromaticContact CE2-NE2 3.64Å
366	I	96.1	Very high	93.1	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-61.6	-46.2	177.6	-62	168.1	0	0	0	110.8	T352 F355 I356 L361 E362 V363 P364 F368 R370 V374 L383	T352-I366 HydrophobicContact CG2-CD1 4.4Å; F355-I366 HydrophobicContact CB-CD1 3.59Å; F355-I366 HydrophobicContact CB-CG1 3.86Å; F355-I366 HydrophobicContact CD2-CD1 4.44Å; F355-I366 HydrophobicContact CD2-CG1 4.2Å; F355-I366 HydrophobicContact CD2-CG2 4.06Å; F355-I366 HydrophobicContact CG-CD1 4.48Å; F355-I366 HydrophobicContact CG-CG1 4.36Å; I356-I366 HydrophobicContact CG1-CD1 3.82Å; L361-I366 HydrophobicContact CB-CD1 4.37Å; L361-I366 HydrophobicContact CB-CG1 4.05Å; L361-I366 WeakPolarHBondContact O-CD1 3.4Å; E362-I366 PolarHBondContact O-N 3.48Å; E362-I366 VanDerWaalsContact O-N 3.08Å; V363-I366 PolarHBondContact O-N 2.84Å; P364-I366 VanDerWaalsContact C-N 3.32Å; P364-I366 PolarHBondContact O-N 2.94Å; I366-F368 PolarHBondContact O-N 3.11Å; I366-R370 HydrophobicContact CG2-CB 4.44Å; I366-R370 CarbonylContact O-C 3.59Å; I366-R370 WeakPolarHBondContact O-CA 3.28Å; I366-R370 PolarHBondContact O-N 2.59Å; I366-R370 VanDerWaalsContact O-N 3.1Å; I366-V374 HydrophobicContact CG2-CG1 3.88Å; I366-L383 HydrophobicContact CG2-CD1 4.03Å; I366-L383 HydrophobicContact CG2-CD2 4.22Å
367	A	94.6	Very high	92.7	Very high	12 Å²	12	29.5 Å²	29.5	10%	0.099	15%	0.146	C	C	.	.	H	α-helix	trans	-68	-28.9	-178.3	0	0	0	0	0	114.2	V363 P364 F365 K371 I380 L383	V363-A367 VanDerWaalsContact O-CB 3.25Å; V363-A367 WeakPolarHBondContact O-CB 3.43Å; V363-A367 PolarHBondContact O-N 3.14Å; P364-A367 PolarHBondContact O-N 3.22Å; F365-A367 PolarHBondContact O-N 3.17Å; A367-K371 WeakPolarHBondContact O-CE 3.41Å; A367-K371 WeakPolarHBondContact O-CG 3.46Å; A367-I380 HydrophobicContact CB-CB 4.2Å; A367-I380 HydrophobicContact CB-CD1 3.82Å; A367-I380 HydrophobicContact CB-CG1 3.83Å; A367-L383 HydrophobicContact CB-CD1 3.89Å
368	F	93.1	Very high	92.7	Very high	42 Å²	42	29.5 Å²	29.5	18%	0.184	15%	0.146	C	C	.	.	H	α-helix	trans	-95.7	-40.2	-178.7	-81.2	-84.7	0	0	0	114	P364 F365 I366 K371 E972 F1038	P364-F368 WeakPolarHBondContact O-CB 3.27Å; P364-F368 VanDerWaalsContact O-CD2 3.32Å; P364-F368 WeakPolarHBondContact O-CD2 3.39Å; P364-F368 PolarHBondContact O-N 2.96Å; F365-F368 PolarHBondContact O-N 3.21Å; I366-F368 PolarHBondContact O-N 3.11Å; F368-K371 VanDerWaalsContact O-CD 3.32Å; F368-K371 WeakPolarHBondContact O-CD 3.2Å; F368-K371 WeakPolarHBondContact O-CE 3.32Å; F368-K371 PolarHBondContact O-NZ 3.13Å; F368-E972 HydrophobicContact CZ-CB 3.86Å; F368-E972 HydrophobicContact CZ-CG 4.29Å; F368-F1038 HydrophobicContact CB-CE1 3.99Å; F368-F1038 HydrophobicContact CB-CZ 4.01Å; F368-F1038 AromaticContact CD2-CE1 3.87Å; F368-F1038 HydrophobicContact CD2-CE1 3.87Å; F368-F1038 HydrophobicContact CD2-CZ 4.12Å; F368-F1038 AromaticContact CG-CE1 3.88Å; F368-F1038 HydrophobicContact CG-CE1 3.88Å; F368-F1038 HydrophobicContact CG-CZ 4.25Å
369	Y	93.9	Very high	92.6	Very high	26 Å²	26	30.6 Å²	30.6	10%	0.102	15%	0.152	C	C	.	.	H	α-helix	trans	-113.1	-22.2	-171.8	-55	-62.2	0	0	0	114.7	F365 G1037 F1038 R1061 H1063	F365-Y369 AromaticContact CD2-CD2 3.54Å; F365-Y369 HydrophobicContact CD2-CD2 3.54Å; F365-Y369 HydrophobicContact CD2-CE2 4.19Å; F365-Y369 HydrophobicContact CD2-CG 4.5Å; F365-Y369 AromaticContact CE2-CD2 3.63Å; F365-Y369 HydrophobicContact CE2-CD2 3.63Å; F365-Y369 HydrophobicContact CE2-CE2 4.42Å; F365-Y369 HydrophobicContact CE2-CG 4.24Å; F365-Y369 HydrophobicContact CG-CD2 4.07Å; F365-Y369 HydrophobicContact CZ-CD2 4.24Å; F365-Y369 HydrophobicContact CZ-CG 4.47Å; F365-Y369 PolarHBondContact O-N 3.32Å; Y369-G1037 VanDerWaalsContact OH-C 3.3Å; Y369-G1037 PolarHBondContact OH-O 2.88Å; Y369-G1037 VanDerWaalsContact OH-O 3.09Å; Y369-F1038 HydrophobicContact CD2-CZ 4.23Å; Y369-F1038 HydrophobicContact CE2-CD1 4.5Å; Y369-F1038 HydrophobicContact CE2-CD2 4.49Å; Y369-F1038 AromaticContact CE2-CE1 3.82Å; Y369-F1038 HydrophobicContact CE2-CE1 3.82Å; Y369-F1038 AromaticContact CE2-CE2 3.8Å; Y369-F1038 HydrophobicContact CE2-CE2 3.8Å; Y369-F1038 AromaticContact CE2-CZ 3.44Å; Y369-F1038 HydrophobicContact CE2-CZ 3.44Å; Y369-F1038 VanDerWaalsContact CE2-CZ 3.44Å; Y369-R1061 WeakPolarHBondContact CE1-O 3.5Å; Y369-H1063 HydrophobicContact CD1-CB 3.85Å; Y369-H1063 HydrophobicContact CE1-CB 3.89Å; Y369-H1063 HydrophobicContact CG-CB 4.32Å
370	R	93.5	Very high	92.6	Very high	32 Å²	32	29.4 Å²	29.4	12%	0.121	15%	0.147	C	C	.	.			trans	-107	30.8	177.6	-54.1	-60.3	174.4	81.3	-6.9	112.6	F355 F365 I366 E372 Y373 E1065	F355-R370 HydrophobicContact CD2-CB 4.26Å; F355-R370 HydrophobicContact CE1-CG 4.5Å; F355-R370 HydrophobicContact CE2-CB 3.76Å; F355-R370 HydrophobicContact CE2-CG 4.26Å; F355-R370 HydrophobicContact CZ-CB 4.08Å; F355-R370 HydrophobicContact CZ-CG 4.23Å; F365-R370 HydrophobicContact CD1-CG 4.29Å; F365-R370 HydrophobicContact CE1-CG 3.88Å; I366-R370 HydrophobicContact CG2-CB 4.44Å; I366-R370 CarbonylContact O-C 3.59Å; I366-R370 WeakPolarHBondContact O-CA 3.28Å; I366-R370 PolarHBondContact O-N 2.59Å; I366-R370 VanDerWaalsContact O-N 3.1Å; R370-E372 VanDerWaalsContact C-N 3.31Å; R370-E372 PolarHBondContact O-N 3.03Å; R370-Y373 HydrophobicContact CB-CD2 4Å; R370-Y373 WeakPolarHBondContact O-CD2 3.26Å; R370-Y373 PolarHBondContact O-N 3.48Å; R370-E1065 IonicContact CZ-OE1 3.76Å; R370-E1065 IonicContact CZ-OE2 2.72Å; R370-E1065 IonicContact NE-OE1 2.68Å; R370-E1065 PolarHBondContact NE-OE1 3.35Å; R370-E1065 IonicContact NH2-OE1 3.68Å; R370-E1065 PolarHBondContact NH2-OE1 3.15Å; R370-E1065 IonicContact NH2-OE2 3.43Å; R370-E1065 PolarHBondContact NH2-OE2 3.44Å
371	K	92	Very high	92.4	Very high	18 Å²	18	32.1 Å²	32.1	8%	0.078	16%	0.162	C	C	.	.	H	α-helix	trans	-51.1	-40	-179.3	-72.9	166.3	177.2	144.8	0	114.5	A367 F368 Y373 V374 K375 I1123 D1127	A367-K371 WeakPolarHBondContact O-CE 3.41Å; A367-K371 WeakPolarHBondContact O-CG 3.46Å; F368-K371 VanDerWaalsContact O-CD 3.32Å; F368-K371 WeakPolarHBondContact O-CD 3.2Å; F368-K371 WeakPolarHBondContact O-CE 3.32Å; F368-K371 PolarHBondContact O-NZ 3.13Å; K371-Y373 PolarHBondContact O-N 2.63Å; K371-V374 PolarHBondContact O-N 2.87Å; K371-K375 HydrophobicContact CB-CD 4.29Å; K371-K375 HydrophobicContact CG-CD 4.35Å; K371-K375 WeakPolarHBondContact O-CB 3.22Å; K371-K375 PolarHBondContact O-N 3.17Å; K371-I1123 HydrophobicContact CB-CB 4.39Å; K371-I1123 HydrophobicContact CB-CD1 4.2Å; K371-I1123 HydrophobicContact CB-CG2 4.03Å; K371-I1123 HydrophobicContact CD-CG2 3.82Å; K371-D1127 WeakPolarHBondContact CD-OD2 3.48Å; K371-D1127 WeakPolarHBondContact CE-OD2 3.43Å; K371-D1127 IonicContact NZ-OD1 3.78Å; K371-D1127 PolarHBondContact NZ-OD1 3.46Å; K371-D1127 IonicContact NZ-OD2 2.76Å; K371-D1127 PolarHBondContact NZ-OD2 2.67Å
372	E	90	Very high	92.3	Very high	29 Å²	29	32.9 Å²	32.9	14%	0.136	17%	0.166	C	C	.	.	H	α-helix	trans	-50.5	-44	-179.4	-51.3	-74.6	137.9	0	0	112.1	R370 S1120 K1121 S1122 I1123 T1124	R370-E372 VanDerWaalsContact C-N 3.31Å; R370-E372 PolarHBondContact O-N 3.03Å; E372-S1120 WeakPolarHBondContact CG-O 3.21Å; E372-S1120 PolarHBondContact OE2-OG 3.32Å; E372-K1121 WeakPolarHBondContact OE1-CA 3.44Å; E372-S1122 PolarHBondContact OE1-N 3.49Å; E372-S1122 VanDerWaalsContact OE1-N 3.14Å; E372-S1122 PolarHBondContact OE2-N 3.06Å; E372-S1122 VanDerWaalsContact OE2-N 3.16Å; E372-S1122 PolarHBondContact OE2-OG 2.93Å; E372-I1123 VanDerWaalsContact OE1-CA 3.32Å; E372-I1123 WeakPolarHBondContact OE1-CA 3.47Å; E372-I1123 VanDerWaalsContact OE1-CB 3.23Å; E372-I1123 WeakPolarHBondContact OE1-CB 3.33Å; E372-I1123 PolarHBondContact OE1-N 3.37Å; E372-T1124 PolarHBondContact OE1-N 2.93Å; E372-T1124 VanDerWaalsContact OE1-N 3.12Å
373	Y	90.9	Very high	92.3	Very high	66 Å²	66	32.8 Å²	32.8	26%	0.259	17%	0.166	S	C	.	.	H	α-helix	trans	-79.8	-27.4	-170.4	-55.7	-80.5	0	0	0	112.4	K348 Q351 F355 R370 K371 K1121	K348-Y373 WeakPolarHBondContact CD-O 3.1Å; K348-Y373 WeakPolarHBondContact CE-O 3.47Å; K348-Y373 WeakPolarHBondContact CG-O 3.47Å; Q351-Y373 PolarHBondContact OE1-O 3.24Å; F355-Y373 HydrophobicContact CE2-CD2 4.02Å; F355-Y373 HydrophobicContact CE2-CG 4.04Å; F355-Y373 HydrophobicContact CZ-CD1 4.37Å; F355-Y373 AromaticContact CZ-CD2 3.67Å; F355-Y373 HydrophobicContact CZ-CD2 3.67Å; F355-Y373 HydrophobicContact CZ-CE2 4.15Å; F355-Y373 AromaticContact CZ-CG 3.81Å; F355-Y373 HydrophobicContact CZ-CG 3.81Å; R370-Y373 HydrophobicContact CB-CD2 4Å; R370-Y373 WeakPolarHBondContact O-CD2 3.26Å; R370-Y373 PolarHBondContact O-N 3.48Å; K371-Y373 PolarHBondContact O-N 2.63Å; Y373-K1121 PolarHBondContact OH-NZ 2.77Å; Y373-K1121 VanDerWaalsContact OH-NZ 3.14Å
374	V	91.4	Very high	92.3	Very high	1 Å²	1	33.8 Å²	33.8	1%	0.006	17%	0.17	C	C	.	.	H	α-helix	trans	-108	-32.3	-169.6	-59.6	0	0	0	0	113.8	I366 K371 E377 L378 L383	I366-V374 HydrophobicContact CG2-CG1 3.88Å; K371-V374 PolarHBondContact O-N 2.87Å; V374-E377 PolarHBondContact O-N 3.06Å; V374-L378 HydrophobicContact CB-CB 4.26Å; V374-L378 PolarHBondContact O-N 3.32Å; V374-L383 HydrophobicContact CB-CD2 4.25Å; V374-L383 HydrophobicContact CG1-CD2 3.94Å; V374-L383 HydrophobicContact CG2-CD1 4.37Å
375	K	87.9	Confident	92.1	Very high	87 Å²	87	37.1 Å²	37.1	38%	0.378	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81	159.9	179.3	-67.9	-172.8	-180	176.6	0	111.5	K348 K371 E377 I1123	K348-K375 PolarHBondContact NZ-O 3.33Å; K371-K375 HydrophobicContact CB-CD 4.29Å; K371-K375 HydrophobicContact CG-CD 4.35Å; K371-K375 WeakPolarHBondContact O-CB 3.22Å; K371-K375 PolarHBondContact O-N 3.17Å; K375-E377 VanDerWaalsContact C-N 3.28Å; K375-I1123 HydrophobicContact CB-CD1 4.46Å
376	P	86.8	Confident	92.1	Very high	124 Å²	124	37.1 Å²	37.1	81%	0.805	18%	0.184	S	C	*	.	T	Hydrogen-bonded Turn	cis	-82.3	6.2	-9.2	37.1	-36.7	0	0	0	113.7
377	E	85.9	Confident	92	Very high	34 Å²	34	38.2 Å²	38.2	16%	0.159	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.5	-36.9	-168.7	-74.6	160.4	-95.4	0	0	113.9	K341 P342 T344 T345 K348 V374 K375	K341-E377 WeakPolarHBondContact CE-O 3.28Å; K341-E377 PolarHBondContact NZ-O 2.89Å; P342-E377 HydrophobicContact CG-CG 4.09Å; P342-E377 WeakPolarHBondContact CG-OE2 3.34Å; T344-E377 WeakPolarHBondContact CB-OE2 3.37Å; T344-E377 PolarHBondContact OG1-OE2 2.96Å; T345-E377 WeakPolarHBondContact CA-OE2 3.47Å; T345-E377 HydrophobicContact CG2-CB 4.29Å; T345-E377 PolarHBondContact N-OE2 3.14Å; T345-E377 PolarHBondContact OG1-OE2 3.12Å; K348-E377 HydrophobicContact CD-CB 4.23Å; K348-E377 WeakPolarHBondContact CD-OE1 3.25Å; K348-E377 VanDerWaalsContact CE-OE1 3.3Å; K348-E377 WeakPolarHBondContact CE-OE1 3.29Å; K348-E377 IonicContact NZ-OE1 3.81Å; K348-E377 PolarHBondContact NZ-OE1 3.26Å; V374-E377 PolarHBondContact O-N 3.06Å; K375-E377 VanDerWaalsContact C-N 3.28Å
378	L	91.4	Very high	91.9	Very high	3 Å²	3	43 Å²	43	2%	0.016	21%	0.205	C	C	.	.			trans	-109.2	131.7	177.1	-58.2	172.7	0	0	0	110.6	F322 T345 K348 I349 V374 D382 L383	F322-L378 HydrophobicContact CZ-CD2 4.15Å; T345-L378 HydrophobicContact CG2-CD2 3.63Å; T345-L378 HydrophobicContact CG2-CG 4.06Å; K348-L378 HydrophobicContact CB-CD1 3.97Å; I349-L378 HydrophobicContact CG1-CD1 4.33Å; V374-L378 HydrophobicContact CB-CB 4.26Å; V374-L378 PolarHBondContact O-N 3.32Å; L378-D382 HydrophobicContact CB-CB 4.17Å; L378-D382 HydrophobicContact CD2-CB 3.77Å; L378-L383 HydrophobicContact CB-CD2 4.19Å; L378-L383 HydrophobicContact CB-CG 4.42Å; L378-L383 HydrophobicContact CD1-CD2 4.03Å
379	N	91.5	Very high	92	Very high	76 Å²	76	43.4 Å²	43.4	41%	0.406	21%	0.206	S	C	.	.			trans	-100.5	179.6	167.1	74.1	32.9	0	0	0	110.6	D381 D382 L383	N379-D381 VanDerWaalsContact C-N 3.31Å; N379-D381 PolarHBondContact O-N 2.79Å; N379-D381 WeakPolarHBondContact OD1-CA 3.45Å; N379-D381 WeakPolarHBondContact OD1-CB 3.22Å; N379-D381 PolarHBondContact OD1-N 3.43Å; N379-D382 PolarHBondContact N-OD2 2.86Å; N379-D382 PolarHBondContact ND2-OD2 3.15Å; N379-D382 WeakPolarHBondContact O-CB 3.23Å; N379-D382 PolarHBondContact O-N 2.78Å; N379-D382 PolarHBondContact OD1-N 2.9Å; N379-D382 PolarHBondContact OD1-OD2 2.98Å; N379-L383 WeakPolarHBondContact O-CG 3.48Å; N379-L383 PolarHBondContact O-N 2.83Å
380	I	92.8	Very high	92.1	Very high	29 Å²	29	42.2 Å²	42.2	15%	0.149	20%	0.201	C	C	.	.	H	α-helix	trans	-64.5	-32.4	-176.1	-163.4	164.5	0	0	0	113.5	V363 A367 L383 W384 N968	V363-I380 HydrophobicContact CG1-CG1 3.92Å; A367-I380 HydrophobicContact CB-CB 4.2Å; A367-I380 HydrophobicContact CB-CD1 3.82Å; A367-I380 HydrophobicContact CB-CG1 3.83Å; I380-L383 PolarHBondContact O-N 3.01Å; I380-W384 PolarHBondContact O-N 2.99Å; I380-N968 HydrophobicContact CD1-CB 4.3Å; I380-N968 WeakPolarHBondContact CD1-OD1 3.41Å
381	D	90.7	Very high	92	Very high	89 Å²	89	41.2 Å²	41.2	48%	0.476	20%	0.2	S	C	.	.	H	α-helix	trans	-75.7	-34.6	177.3	-47.9	-56.7	0	0	0	111	N379 L383 W384 K385	N379-D381 VanDerWaalsContact C-N 3.31Å; N379-D381 PolarHBondContact O-N 2.79Å; N379-D381 WeakPolarHBondContact OD1-CA 3.45Å; N379-D381 WeakPolarHBondContact OD1-CB 3.22Å; N379-D381 PolarHBondContact OD1-N 3.43Å; D381-L383 VanDerWaalsContact C-N 3.32Å; D381-W384 PolarHBondContact O-N 3.46Å; D381-K385 WeakPolarHBondContact O-CB 3.43Å; D381-K385 PolarHBondContact O-N 3.33Å
382	D	93	Very high	92.1	Very high	20 Å²	20	42.8 Å²	42.8	11%	0.107	21%	0.209	C	C	.	.	H	α-helix	trans	-63.7	-36.8	170	-58.1	-62.9	0	0	0	111.5	F322 K341 L378 N379 K385 V386	F322-D382 HydrophobicContact CE1-CB 4.19Å; F322-D382 WeakPolarHBondContact CE1-OD1 3.49Å; F322-D382 HydrophobicContact CZ-CB 4.17Å; K341-D382 WeakPolarHBondContact CE-OD1 3.48Å; K341-D382 IonicContact NZ-OD1 3.58Å; K341-D382 PolarHBondContact NZ-OD1 3.19Å; K341-D382 IonicContact NZ-OD2 2.71Å; K341-D382 PolarHBondContact NZ-OD2 3.24Å; L378-D382 HydrophobicContact CB-CB 4.17Å; L378-D382 HydrophobicContact CD2-CB 3.77Å; N379-D382 PolarHBondContact N-OD2 2.86Å; N379-D382 PolarHBondContact ND2-OD2 3.15Å; N379-D382 WeakPolarHBondContact O-CB 3.23Å; N379-D382 PolarHBondContact O-N 2.78Å; N379-D382 PolarHBondContact OD1-N 2.9Å; N379-D382 PolarHBondContact OD1-OD2 2.98Å; D382-K385 WeakPolarHBondContact O-CB 3.42Å; D382-K385 PolarHBondContact O-N 3.03Å; D382-V386 WeakPolarHBondContact O-CG2 3.46Å; D382-V386 PolarHBondContact O-N 2.83Å
383	L	95.5	Very high	92.3	Very high	1 Å²	1	42.6 Å²	42.6	1%	0.005	21%	0.207	C	C	.	.	H	α-helix	trans	-69.9	-41.3	177.3	-67.7	171.8	0	0	0	111.9	T352 V363 I366 A367 V374 L378 N379 I380 D381 K385 V386 Y387	T352-L383 HydrophobicContact CG2-CD2 3.54Å; T352-L383 WeakPolarHBondContact OG1-CD2 3.49Å; V363-L383 HydrophobicContact CB-CB 4.49Å; V363-L383 HydrophobicContact CG1-CB 3.6Å; V363-L383 HydrophobicContact CG2-CB 4.26Å; I366-L383 HydrophobicContact CG2-CD1 4.03Å; I366-L383 HydrophobicContact CG2-CD2 4.22Å; A367-L383 HydrophobicContact CB-CD1 3.89Å; V374-L383 HydrophobicContact CB-CD2 4.25Å; V374-L383 HydrophobicContact CG1-CD2 3.94Å; V374-L383 HydrophobicContact CG2-CD1 4.37Å; L378-L383 HydrophobicContact CB-CD2 4.19Å; L378-L383 HydrophobicContact CB-CG 4.42Å; L378-L383 HydrophobicContact CD1-CD2 4.03Å; N379-L383 WeakPolarHBondContact O-CG 3.48Å; N379-L383 PolarHBondContact O-N 2.83Å; I380-L383 PolarHBondContact O-N 3.01Å; D381-L383 VanDerWaalsContact C-N 3.32Å; L383-K385 PolarHBondContact O-N 2.97Å; L383-V386 PolarHBondContact O-N 3.48Å; L383-Y387 PolarHBondContact O-N 1.78Å
384	W	94.6	Very high	92.4	Very high	20 Å²	20	40 Å²	40	8%	0.076	20%	0.199	C	C	.	.	H	α-helix	trans	-61.2	-35.1	168.8	-76.7	116.7	0	0	0	111.8	V363 P364 I380 D381 Y387 Y388 L964 I967 N968	V363-W384 HydrophobicContact CB-CD2 3.8Å; V363-W384 HydrophobicContact CB-CE3 4.07Å; V363-W384 HydrophobicContact CB-CG 4.35Å; V363-W384 HydrophobicContact CB-CH2 4.07Å; V363-W384 HydrophobicContact CB-CZ2 3.82Å; V363-W384 HydrophobicContact CB-CZ3 4.19Å; V363-W384 HydrophobicContact CG1-CD2 3.78Å; V363-W384 HydrophobicContact CG1-CG 3.82Å; V363-W384 HydrophobicContact CG1-CZ2 4.19Å; V363-W384 HydrophobicContact CG2-CD2 3.89Å; V363-W384 HydrophobicContact CG2-CE3 3.79Å; V363-W384 HydrophobicContact CG2-CG 4.39Å; V363-W384 HydrophobicContact CG2-CH2 4.46Å; V363-W384 HydrophobicContact CG2-CZ3 4.08Å; P364-W384 HydrophobicContact CG-CZ2 4.16Å; I380-W384 PolarHBondContact O-N 2.99Å; D381-W384 PolarHBondContact O-N 3.46Å; W384-Y387 AromaticContact CE3-CD1 3.91Å; W384-Y387 HydrophobicContact CE3-CD1 3.91Å; W384-Y387 HydrophobicContact CE3-CG 4.32Å; W384-Y387 AromaticContact CZ3-CD1 3.92Å; W384-Y387 HydrophobicContact CZ3-CD1 3.92Å; W384-Y387 HydrophobicContact CZ3-CE1 4.1Å; W384-Y387 HydrophobicContact CZ3-CG 4.39Å; W384-Y387 PolarHBondContact O-N 3.3Å; W384-Y388 PolarHBondContact O-N 2.81Å; W384-L964 HydrophobicContact CD2-CD1 4.13Å; W384-L964 HydrophobicContact CD2-CD2 3.99Å; W384-L964 HydrophobicContact CE3-CD1 4.26Å; W384-L964 HydrophobicContact CE3-CD2 3.81Å; W384-L964 HydrophobicContact CG-CD1 4.27Å; W384-L964 HydrophobicContact CH2-CD2 3.73Å; W384-L964 HydrophobicContact CZ2-CD2 3.89Å; W384-L964 HydrophobicContact CZ3-CD2 3.69Å; W384-I967 HydrophobicContact CZ2-CG2 4.08Å; W384-N968 PolarHBondContact NE1-ND2 2.84Å; W384-N968 PolarHBondContact NE1-OD1 2.7Å
385	K	92.7	Very high	92.5	Very high	71 Å²	71	42.3 Å²	42.3	31%	0.309	21%	0.21	S	C	.	.	H	α-helix	trans	-64.8	-39.8	173	-158.9	178	-165.6	179.3	0	112.5	A321 F322 D381 D382 L383 Y388 Y389	A321-K385 HydrophobicContact CB-CD 4.13Å; A321-K385 HydrophobicContact CB-CG 4.26Å; A321-K385 WeakPolarHBondContact O-CE 3.44Å; A321-K385 PolarHBondContact O-NZ 3.18Å; F322-K385 HydrophobicContact CE1-CD 4.32Å; F322-K385 HydrophobicContact CZ-CD 4.38Å; D381-K385 WeakPolarHBondContact O-CB 3.43Å; D381-K385 PolarHBondContact O-N 3.33Å; D382-K385 WeakPolarHBondContact O-CB 3.42Å; D382-K385 PolarHBondContact O-N 3.03Å; L383-K385 PolarHBondContact O-N 2.97Å; K385-Y388 PolarHBondContact O-N 3.08Å; K385-Y389 HydrophobicContact CD-CE2 4.49Å; K385-Y389 HydrophobicContact CG-CD2 3.95Å; K385-Y389 HydrophobicContact CG-CE2 3.89Å; K385-Y389 VanDerWaalsContact O-CD2 3.25Å; K385-Y389 WeakPolarHBondContact O-CD2 3.38Å; K385-Y389 PolarHBondContact O-N 2.88Å
386	V	95.4	Very high	92.7	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-61.7	-48.1	172.1	173.6	0	0	0	0	110.6	I317 F322 I349 T352 L353 D382 L383 Y388 Y389 D390	I317-V386 HydrophobicContact CD1-CG1 4.25Å; I317-V386 HydrophobicContact CG2-CG2 4.23Å; F322-V386 HydrophobicContact CE2-CG2 4.35Å; I349-V386 HydrophobicContact CG1-CG2 4.04Å; I349-V386 HydrophobicContact CG2-CG1 4.1Å; I349-V386 HydrophobicContact CG2-CG2 4.17Å; T352-V386 HydrophobicContact CG2-CB 4.25Å; T352-V386 HydrophobicContact CG2-CG1 3.85Å; L353-V386 HydrophobicContact CD2-CG1 3.84Å; L353-V386 HydrophobicContact CG-CG1 4.13Å; D382-V386 WeakPolarHBondContact O-CG2 3.46Å; D382-V386 PolarHBondContact O-N 2.83Å; L383-V386 PolarHBondContact O-N 3.48Å; V386-Y388 VanDerWaalsContact C-N 3.3Å; V386-Y388 PolarHBondContact O-N 3.17Å; V386-Y389 PolarHBondContact O-N 2.46Å; V386-D390 WeakPolarHBondContact O-CB 3.25Å; V386-D390 PolarHBondContact O-N 3.33Å
387	Y	94.8	Very high	93	Very high	22 Å²	22	35.4 Å²	35.4	9%	0.086	17%	0.17	C	C	.	.	H	α-helix	trans	-58.7	-35.7	178.6	178.3	-97.7	0	0	0	113.9	R292 M293 R296 I356 V363 L383 W384	R292-Y387 PolarHBondContact O-OH 2.94Å; M293-Y387 HydrophobicContact CG-CE2 4.45Å; R296-Y387 PolarHBondContact NH1-O 3.32Å; I356-Y387 HydrophobicContact CD1-CD2 4.2Å; I356-Y387 HydrophobicContact CG2-CD2 4.06Å; I356-Y387 HydrophobicContact CG2-CE2 4.4Å; V363-Y387 HydrophobicContact CG2-CG 4.47Å; L383-Y387 PolarHBondContact O-N 1.78Å; W384-Y387 AromaticContact CE3-CD1 3.91Å; W384-Y387 HydrophobicContact CE3-CD1 3.91Å; W384-Y387 HydrophobicContact CE3-CG 4.32Å; W384-Y387 AromaticContact CZ3-CD1 3.92Å; W384-Y387 HydrophobicContact CZ3-CD1 3.92Å; W384-Y387 HydrophobicContact CZ3-CE1 4.1Å; W384-Y387 HydrophobicContact CZ3-CG 4.39Å; W384-Y387 PolarHBondContact O-N 3.3Å
388	Y	93	Very high	93.3	Very high	113 Å²	113	37 Å²	37	44%	0.443	18%	0.177	S	C	.	.	H	α-helix	trans	-72.8	-44.7	175.1	178.4	-110.6	0	0	0	112.4	W384 K385 V386 G391 I392	W384-Y388 PolarHBondContact O-N 2.81Å; K385-Y388 PolarHBondContact O-N 3.08Å; V386-Y388 VanDerWaalsContact C-N 3.3Å; V386-Y388 PolarHBondContact O-N 3.17Å; Y388-G391 PolarHBondContact O-N 2.89Å; Y388-I392 HydrophobicContact CD1-CD1 4.05Å; Y388-I392 HydrophobicContact CE1-CD1 3.51Å; Y388-I392 HydrophobicContact CE1-CG1 4.46Å; Y388-I392 PolarHBondContact O-N 3.13Å
389	Y	94.2	Very high	93.4	Very high	51 Å²	51	42.2 Å²	42.2	20%	0.2	20%	0.197	C	C	.	.	H	α-helix	trans	-72.6	-26.1	-179.9	-83.3	-110.5	0	0	0	113.1	W316 A321 K385 V386 I392 W393	W316-Y389 HydrophobicContact CH2-CD1 4.05Å; W316-Y389 AromaticContact CZ3-CD1 3.75Å; W316-Y389 HydrophobicContact CZ3-CD1 3.75Å; W316-Y389 HydrophobicContact CZ3-CG 4.44Å; A321-Y389 HydrophobicContact CB-CD1 3.71Å; A321-Y389 HydrophobicContact CB-CD2 3.86Å; A321-Y389 HydrophobicContact CB-CE1 3.66Å; A321-Y389 HydrophobicContact CB-CE2 3.84Å; A321-Y389 HydrophobicContact CB-CG 3.8Å; K385-Y389 HydrophobicContact CD-CE2 4.49Å; K385-Y389 HydrophobicContact CG-CD2 3.95Å; K385-Y389 HydrophobicContact CG-CE2 3.89Å; K385-Y389 VanDerWaalsContact O-CD2 3.25Å; K385-Y389 WeakPolarHBondContact O-CD2 3.38Å; K385-Y389 PolarHBondContact O-N 2.88Å; V386-Y389 PolarHBondContact O-N 2.46Å; Y389-I392 PolarHBondContact O-N 3.3Å; Y389-W393 WeakPolarHBondContact O-CB 3.49Å; Y389-W393 PolarHBondContact O-N 2.78Å
390	D	95.4	Very high	93.5	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-55.6	-47.8	165.2	167.1	139.1	0	0	0	110.8	R296 E313 I317 L353 R357 V386 I392 W393 C394	R296-D390 IonicContact CZ-OD2 3.75Å; R296-D390 IonicContact NH1-OD2 2.73Å; R296-D390 PolarHBondContact NH1-OD2 2.74Å; R296-D390 IonicContact NH2-OD2 2.77Å; R296-D390 PolarHBondContact NH2-OD2 3.01Å; E313-D390 WeakPolarHBondContact OE1-CA 3.4Å; I317-D390 HydrophobicContact CD1-CB 4.44Å; L353-D390 HydrophobicContact CD2-CB 3.78Å; L353-D390 WeakPolarHBondContact CD2-OD1 3.33Å; R357-D390 WeakPolarHBondContact CD-OD1 3.45Å; R357-D390 WeakPolarHBondContact CG-OD1 3.32Å; V386-D390 WeakPolarHBondContact O-CB 3.25Å; V386-D390 PolarHBondContact O-N 3.33Å; D390-I392 PolarHBondContact O-N 2.86Å; D390-W393 PolarHBondContact O-N 2.77Å; D390-C394 WeakPolarHBondContact O-CB 3.18Å; D390-C394 PolarHBondContact O-N 2.87Å; D390-C394 PolarHBondContact O-SG 3.4Å; D390-C394 VanDerWaalsContact O-SG 3.34Å
391	G	92.8	Very high	93.5	Very high	11 Å²	11	45.5 Å²	45.5	11%	0.113	20%	0.203	C	C	.	.	H	α-helix	trans	-59.6	-43.8	175.5	0	0	0	0	0	113.1	Y388 Q395	Y388-G391 PolarHBondContact O-N 2.89Å; G391-Q395 WeakPolarHBondContact O-CB 3.14Å; G391-Q395 PolarHBondContact O-N 3.38Å
392	I	93.3	Very high	93.6	Very high	51 Å²	51	47.4 Å²	47.4	26%	0.262	21%	0.207	S	C	.	.	H	α-helix	trans	-65.9	-44.3	176.1	-60.6	173.8	0	0	0	111.1	W316 Y388 Y389 D390 Q395 L396	W316-I392 HydrophobicContact CH2-CB 4.2Å; W316-I392 HydrophobicContact CH2-CG2 3.73Å; W316-I392 HydrophobicContact CZ2-CG2 4.47Å; Y388-I392 HydrophobicContact CD1-CD1 4.05Å; Y388-I392 HydrophobicContact CE1-CD1 3.51Å; Y388-I392 HydrophobicContact CE1-CG1 4.46Å; Y388-I392 PolarHBondContact O-N 3.13Å; Y389-I392 PolarHBondContact O-N 3.3Å; D390-I392 PolarHBondContact O-N 2.86Å; I392-Q395 PolarHBondContact O-N 3.04Å; I392-L396 WeakPolarHBondContact O-CB 3.48Å; I392-L396 PolarHBondContact O-N 2.73Å
393	W	94.6	Very high	93.7	Very high	25 Å²	25	47.2 Å²	47.2	10%	0.095	21%	0.205	C	C	.	.	H	α-helix	trans	-63	-45.6	179.6	-175.3	96.2	0	0	0	110.9	E309 E313 W316 Y389 D390 Q395 L396 N397	E309-W393 HydrophobicContact CG-CH2 3.6Å; E309-W393 HydrophobicContact CG-CZ3 3.93Å; E309-W393 VanDerWaalsContact OE1-CZ3 3.31Å; E309-W393 WeakPolarHBondContact OE1-CZ3 3.46Å; E313-W393 HydrophobicContact CB-CD2 3.87Å; E313-W393 HydrophobicContact CB-CE3 4.26Å; E313-W393 HydrophobicContact CB-CG 4.21Å; E313-W393 HydrophobicContact CB-CZ2 4.29Å; E313-W393 HydrophobicContact CG-CB 4.14Å; E313-W393 HydrophobicContact CG-CD2 3.68Å; E313-W393 HydrophobicContact CG-CE3 3.98Å; E313-W393 HydrophobicContact CG-CG 3.71Å; W316-W393 AromaticContact CD2-CD1 3.65Å; W316-W393 HydrophobicContact CE3-CB 3.9Å; W316-W393 AromaticContact CE3-CD1 3.66Å; W316-W393 HydrophobicContact CE3-CG 4.18Å; W316-W393 AromaticContact CG-CD1 3.71Å; W316-W393 HydrophobicContact CZ3-CB 3.9Å; Y389-W393 WeakPolarHBondContact O-CB 3.49Å; Y389-W393 PolarHBondContact O-N 2.78Å; D390-W393 PolarHBondContact O-N 2.77Å; W393-Q395 VanDerWaalsContact C-N 3.35Å; W393-Q395 PolarHBondContact O-N 3.42Å; W393-L396 PolarHBondContact O-N 3.3Å; W393-N397 HydrophobicContact CD2-CB 4.47Å; W393-N397 HydrophobicContact CE3-CB 4.17Å; W393-N397 HydrophobicContact CH2-CB 3.84Å; W393-N397 WeakPolarHBondContact CH2-ND2 3.41Å; W393-N397 HydrophobicContact CZ2-CB 4.2Å; W393-N397 HydrophobicContact CZ3-CB 3.83Å; W393-N397 WeakPolarHBondContact CZ3-ND2 3.46Å; W393-N397 WeakPolarHBondContact O-CB 3.48Å; W393-N397 PolarHBondContact O-N 3.48Å
394	C	92.9	Very high	93.6	Very high	12 Å²	12	51.8 Å²	51.8	8%	0.081	23%	0.225	C	C	.	.	H	α-helix	trans	-59.2	-43.4	174	-73.6	0	0	0	0	111.6	V298 D390 L396 N397 E398	V298-C394 HydrophobicContact CG1-CB 3.62Å; D390-C394 WeakPolarHBondContact O-CB 3.18Å; D390-C394 PolarHBondContact O-N 2.87Å; D390-C394 PolarHBondContact O-SG 3.4Å; D390-C394 VanDerWaalsContact O-SG 3.34Å; C394-L396 PolarHBondContact O-N 3.3Å; C394-N397 PolarHBondContact O-N 3.12Å; C394-E398 WeakPolarHBondContact O-CB 3.07Å; C394-E398 PolarHBondContact O-N 3.49Å
395	Q	92.8	Very high	93.6	Very high	50 Å²	50	53.2 Å²	53.2	23%	0.234	24%	0.236	C	C	.	.	H	α-helix	trans	-63	-42.1	175.9	-155.1	-171	83.7	0	0	112	V298 G391 I392 W393 R399 M447	V298-Q395 HydrophobicContact CG2-CB 3.96Å; V298-Q395 HydrophobicContact CG2-CG 4.09Å; G391-Q395 WeakPolarHBondContact O-CB 3.14Å; G391-Q395 PolarHBondContact O-N 3.38Å; I392-Q395 PolarHBondContact O-N 3.04Å; W393-Q395 VanDerWaalsContact C-N 3.35Å; W393-Q395 PolarHBondContact O-N 3.42Å; Q395-R399 WeakPolarHBondContact O-CB 3.37Å; Q395-R399 VanDerWaalsContact O-CG 3.29Å; Q395-R399 WeakPolarHBondContact O-CG 3.31Å; Q395-R399 PolarHBondContact O-N 3.06Å; Q395-R399 VanDerWaalsContact OE1-CZ 3.28Å; Q395-M447 HydrophobicContact CB-CE 3.75Å; Q395-M447 HydrophobicContact CG-CE 3.87Å
396	L	93.7	Very high	93.6	Very high	8 Å²	8	52 Å²	52	4%	0.042	23%	0.233	C	C	.	.	H	α-helix	trans	-64.8	-49.6	178.4	179.1	63.3	0	0	0	110.6	W316 I392 W393 C394 R399 K400 V444 Q445 M447 L450	W316-L396 HydrophobicContact CZ2-CD2 4.27Å; I392-L396 WeakPolarHBondContact O-CB 3.48Å; I392-L396 PolarHBondContact O-N 2.73Å; W393-L396 PolarHBondContact O-N 3.3Å; C394-L396 PolarHBondContact O-N 3.3Å; L396-R399 PolarHBondContact O-N 3.41Å; L396-K400 WeakPolarHBondContact O-CB 3.4Å; L396-K400 PolarHBondContact O-N 3.15Å; L396-V444 HydrophobicContact CD1-CG1 4.35Å; L396-Q445 WeakPolarHBondContact CD2-O 3.5Å; L396-M447 HydrophobicContact CB-CE 3.94Å; L396-M447 HydrophobicContact CD1-CE 4.44Å; L396-M447 HydrophobicContact CD1-SD 4.11Å; L396-L450 HydrophobicContact CD1-CB 4.43Å; L396-L450 HydrophobicContact CD1-CD2 4.31Å
397	N	92.2	Very high	93.5	Very high	58 Å²	58	52.1 Å²	52.1	31%	0.31	23%	0.233	S	C	.	.	H	α-helix	trans	-63	-42.8	-179.5	-170	32.6	0	0	0	111.4	W393 C394 K400 R401	W393-N397 HydrophobicContact CD2-CB 4.47Å; W393-N397 HydrophobicContact CE3-CB 4.17Å; W393-N397 HydrophobicContact CH2-CB 3.84Å; W393-N397 WeakPolarHBondContact CH2-ND2 3.41Å; W393-N397 HydrophobicContact CZ2-CB 4.2Å; W393-N397 HydrophobicContact CZ3-CB 3.83Å; W393-N397 WeakPolarHBondContact CZ3-ND2 3.46Å; W393-N397 WeakPolarHBondContact O-CB 3.48Å; W393-N397 PolarHBondContact O-N 3.48Å; C394-N397 PolarHBondContact O-N 3.12Å; N397-K400 PolarHBondContact O-N 3.4Å; N397-R401 VanDerWaalsContact O-CB 3.27Å; N397-R401 WeakPolarHBondContact O-CB 3.39Å; N397-R401 PolarHBondContact O-N 3.12Å
398	E	91.3	Very high	93.5	Very high	66 Å²	66	54.7 Å²	54.7	31%	0.308	25%	0.246	S	C	.	.	H	α-helix	trans	-66	-43.5	177.3	175.2	57.8	-173.4	0	0	112.3	C394 R401 K402	C394-E398 WeakPolarHBondContact O-CB 3.07Å; C394-E398 PolarHBondContact O-N 3.49Å; E398-R401 PolarHBondContact O-N 3.46Å; E398-R401 IonicContact OE1-CZ 3.26Å; E398-R401 IonicContact OE1-NH2 2.78Å; E398-R401 PolarHBondContact OE1-NH2 3.45Å; E398-R401 IonicContact OE2-CZ 3.87Å; E398-R401 IonicContact OE2-NE 2.76Å; E398-R401 PolarHBondContact OE2-NE 2.89Å; E398-R401 IonicContact OE2-NH2 3.11Å; E398-R401 PolarHBondContact OE2-NH2 3.5Å; E398-K402 WeakPolarHBondContact O-CG 3.21Å; E398-K402 PolarHBondContact O-N 2.71Å; E398-K402 WeakPolarHBondContact OE1-CE 3.36Å; E398-K402 IonicContact OE1-NZ 2.93Å
399	R	93.8	Very high	93.4	Very high	114 Å²	114	54 Å²	54	43%	0.43	25%	0.245	S	C	.	.	H	α-helix	trans	-65.3	-40.2	175.3	-70.6	175.3	172.7	179.2	-0.8	111.6	Q395 L396 K402 L403 M447 L450	Q395-R399 WeakPolarHBondContact O-CB 3.37Å; Q395-R399 VanDerWaalsContact O-CG 3.29Å; Q395-R399 WeakPolarHBondContact O-CG 3.31Å; Q395-R399 PolarHBondContact O-N 3.06Å; Q395-R399 VanDerWaalsContact OE1-CZ 3.28Å; L396-R399 PolarHBondContact O-N 3.41Å; R399-K402 PolarHBondContact O-N 3.12Å; R399-L403 PolarHBondContact O-N 2.97Å; R399-M447 PolarHBondContact NH1-SD 2.88Å; R399-L450 HydrophobicContact CB-CD2 3.47Å; R399-L450 VanDerWaalsContact CB-CD2 3.47Å
400	K	94	Very high	93.4	Very high	40 Å²	40	51.6 Å²	51.6	17%	0.174	24%	0.236	C	C	.	.	H	α-helix	trans	-61.7	-42	174	179.1	173.6	174.3	168.6	0	111.7	L396 N397 L403 K404 L441 A442 V444 L450	L396-K400 WeakPolarHBondContact O-CB 3.4Å; L396-K400 PolarHBondContact O-N 3.15Å; N397-K400 PolarHBondContact O-N 3.4Å; K400-L403 PolarHBondContact O-N 3.08Å; K400-K404 WeakPolarHBondContact O-CB 3.37Å; K400-K404 PolarHBondContact O-N 2.75Å; K400-L441 WeakPolarHBondContact CE-O 3.41Å; K400-L441 HydrophobicContact CG-CD1 4.25Å; K400-A442 WeakPolarHBondContact CE-O 3.29Å; K400-A442 PolarHBondContact NZ-O 3.24Å; K400-V444 PolarHBondContact NZ-O 3.36Å; K400-L450 HydrophobicContact CB-CD1 4.22Å
401	R	92.6	Very high	93.2	Very high	133 Å²	133	55.2 Å²	55.2	50%	0.502	25%	0.25	S	C	.	.	H	α-helix	trans	-63.6	-46.7	173.4	-170.4	-173.5	70.5	91.7	1.2	112	N397 E398 L403 K404 V405	N397-R401 VanDerWaalsContact O-CB 3.27Å; N397-R401 WeakPolarHBondContact O-CB 3.39Å; N397-R401 PolarHBondContact O-N 3.12Å; E398-R401 PolarHBondContact O-N 3.46Å; E398-R401 IonicContact OE1-CZ 3.26Å; E398-R401 IonicContact OE1-NH2 2.78Å; E398-R401 PolarHBondContact OE1-NH2 3.45Å; E398-R401 IonicContact OE2-CZ 3.87Å; E398-R401 IonicContact OE2-NE 2.76Å; E398-R401 PolarHBondContact OE2-NE 2.89Å; E398-R401 IonicContact OE2-NH2 3.11Å; E398-R401 PolarHBondContact OE2-NH2 3.5Å; R401-L403 VanDerWaalsContact C-N 3.33Å; R401-L403 PolarHBondContact O-N 3.16Å; R401-K404 WeakPolarHBondContact O-CB 3.43Å; R401-K404 PolarHBondContact O-N 3.19Å; R401-V405 WeakPolarHBondContact O-CG2 3.34Å; R401-V405 PolarHBondContact O-N 2.98Å
402	K	93.8	Very high	93.1	Very high	130 Å²	130	59.6 Å²	59.6	57%	0.565	27%	0.267	S	S	*	.	H	α-helix	trans	-59	-42.9	174.6	-71.1	-177.3	-166.9	-174.2	0	111.8	E398 R399 V405 L406	E398-K402 WeakPolarHBondContact O-CG 3.21Å; E398-K402 PolarHBondContact O-N 2.71Å; E398-K402 WeakPolarHBondContact OE1-CE 3.36Å; E398-K402 IonicContact OE1-NZ 2.93Å; R399-K402 PolarHBondContact O-N 3.12Å; K402-V405 PolarHBondContact O-N 3.09Å; K402-L406 PolarHBondContact O-N 3.04Å; K402-L406 VanDerWaalsContact O-N 3.15Å
403	L	93.4	Very high	93	Very high	15 Å²	15	57.7 Å²	57.7	8%	0.079	26%	0.257	C	S	.	.	H	α-helix	trans	-67.3	-36.8	176.6	-169.7	56.9	0	0	0	112.1	R399 K400 R401 L406 F407 L441 L450 V453 H454	R399-L403 PolarHBondContact O-N 2.97Å; K400-L403 PolarHBondContact O-N 3.08Å; R401-L403 VanDerWaalsContact C-N 3.33Å; R401-L403 PolarHBondContact O-N 3.16Å; L403-L406 HydrophobicContact CD1-CD2 4.24Å; L403-L406 WeakPolarHBondContact O-CB 3.22Å; L403-L406 PolarHBondContact O-N 3.23Å; L403-L406 VanDerWaalsContact O-N 3.14Å; L403-F407 HydrophobicContact CD1-CD2 4.15Å; L403-F407 HydrophobicContact CD1-CE2 3.76Å; L403-F407 HydrophobicContact CD2-CE2 4.35Å; L403-F407 HydrophobicContact CG-CD2 4.17Å; L403-F407 HydrophobicContact CG-CE2 3.76Å; L403-F407 VanDerWaalsContact O-CD2 3.24Å; L403-F407 WeakPolarHBondContact O-CD2 2.94Å; L403-F407 PolarHBondContact O-N 3.42Å; L403-L441 HydrophobicContact CB-CD1 4.39Å; L403-L441 HydrophobicContact CB-CD2 4.37Å; L403-L441 HydrophobicContact CD2-CD1 3.85Å; L403-L441 HydrophobicContact CG-CD1 4.22Å; L403-L441 HydrophobicContact CG-CD2 4.26Å; L403-L450 HydrophobicContact CD2-CD1 3.71Å; L403-L450 HydrophobicContact CD2-CG 4.37Å; L403-V453 HydrophobicContact CD2-CG1 4.24Å; L403-H454 HydrophobicContact CD2-CB 4.11Å
404	K	94.4	Very high	92.8	Very high	98 Å²	98	56.9 Å²	56.9	43%	0.426	25%	0.254	S	S	.	.	H	α-helix	trans	-62.7	-45.4	175.3	-165.9	-166.1	179.9	-124.1	0	111.6	K400 R401 L406 F407 E408 F438 L441	K400-K404 WeakPolarHBondContact O-CB 3.37Å; K400-K404 PolarHBondContact O-N 2.75Å; R401-K404 WeakPolarHBondContact O-CB 3.43Å; R401-K404 PolarHBondContact O-N 3.19Å; K404-L406 PolarHBondContact O-N 2.69Å; K404-F407 WeakPolarHBondContact O-CB 3.46Å; K404-F407 PolarHBondContact O-N 2.82Å; K404-F407 VanDerWaalsContact O-N 3.09Å; K404-E408 WeakPolarHBondContact CE-OE1 3.41Å; K404-E408 IonicContact NZ-OE1 3.19Å; K404-E408 PolarHBondContact NZ-OE1 3.29Å; K404-E408 WeakPolarHBondContact O-CG 3.39Å; K404-E408 PolarHBondContact O-N 3.38Å; K404-F438 HydrophobicContact CG-CD1 4.21Å; K404-F438 HydrophobicContact CG-CE1 4.49Å; K404-L441 VanDerWaalsContact CA-CD2 3.49Å; K404-L441 HydrophobicContact CB-CD2 3.78Å; K404-L441 HydrophobicContact CG-CD2 4.25Å
405	V	94.4	Very high	92.6	Very high	50 Å²	50	60 Å²	60	30%	0.303	27%	0.27	S	S	.	.	H	α-helix	trans	-60.8	-32.1	174.7	171.6	0	0	0	0	111.6	R401 K402 K409	R401-V405 WeakPolarHBondContact O-CG2 3.34Å; R401-V405 PolarHBondContact O-N 2.98Å; K402-V405 PolarHBondContact O-N 3.09Å; V405-K409 HydrophobicContact CG1-CD 4.22Å; V405-K409 VanDerWaalsContact O-CB 3.29Å; V405-K409 WeakPolarHBondContact O-CB 3.45Å; V405-K409 VanDerWaalsContact O-CG 3.24Å; V405-K409 WeakPolarHBondContact O-CG 3.24Å; V405-K409 PolarHBondContact O-N 3.38Å
406	L	92.4	Very high	92.3	Very high	46 Å²	46	60 Å²	60	24%	0.241	27%	0.271	C	S	.	.	H	α-helix	trans	-70.5	-39.2	173.7	-175	60.2	0	0	0	112.5	K402 L403 K404 M410 F457 L465 M468	K402-L406 PolarHBondContact O-N 3.04Å; K402-L406 VanDerWaalsContact O-N 3.15Å; L403-L406 HydrophobicContact CD1-CD2 4.24Å; L403-L406 WeakPolarHBondContact O-CB 3.22Å; L403-L406 PolarHBondContact O-N 3.23Å; L403-L406 VanDerWaalsContact O-N 3.14Å; K404-L406 PolarHBondContact O-N 2.69Å; L406-M410 WeakPolarHBondContact O-CB 3.4Å; L406-M410 PolarHBondContact O-N 3.46Å; L406-F457 HydrophobicContact CD1-CZ 4.35Å; L406-F457 HydrophobicContact CD2-CD1 4.18Å; L406-F457 HydrophobicContact CD2-CE1 3.58Å; L406-F457 HydrophobicContact CD2-CZ 4Å; L406-F457 HydrophobicContact CG-CE1 3.84Å; L406-F457 HydrophobicContact CG-CE2 4.47Å; L406-F457 HydrophobicContact CG-CZ 3.7Å; L406-L465 HydrophobicContact CD1-CD2 4.04Å; L406-M468 HydrophobicContact CD1-CE 4.09Å
407	F	93.5	Very high	91.9	Very high	2 Å²	2	62.2 Å²	62.2	1%	0.009	29%	0.285	C	S	.	.	H	α-helix	trans	-65.4	-43.3	172.7	-80	-138.8	0	0	0	111.1	L403 K404 M410 R411 I433 D437 F438 L441 V453 F457	L403-F407 HydrophobicContact CD1-CD2 4.15Å; L403-F407 HydrophobicContact CD1-CE2 3.76Å; L403-F407 HydrophobicContact CD2-CE2 4.35Å; L403-F407 HydrophobicContact CG-CD2 4.17Å; L403-F407 HydrophobicContact CG-CE2 3.76Å; L403-F407 VanDerWaalsContact O-CD2 3.24Å; L403-F407 WeakPolarHBondContact O-CD2 2.94Å; L403-F407 PolarHBondContact O-N 3.42Å; K404-F407 WeakPolarHBondContact O-CB 3.46Å; K404-F407 PolarHBondContact O-N 2.82Å; K404-F407 VanDerWaalsContact O-N 3.09Å; F407-M410 PolarHBondContact O-N 2.86Å; F407-R411 WeakPolarHBondContact O-CB 3.29Å; F407-R411 PolarHBondContact O-N 3.1Å; F407-I433 HydrophobicContact CB-CD1 4.39Å; F407-I433 HydrophobicContact CD1-CG2 4.43Å; F407-I433 WeakPolarHBondContact O-CD1 3.31Å; F407-D437 HydrophobicContact CD1-CB 4.24Å; F407-D437 HydrophobicContact CE1-CB 4.06Å; F407-F438 HydrophobicContact CB-CD1 4.28Å; F407-F438 HydrophobicContact CB-CE1 3.5Å; F407-F438 VanDerWaalsContact CB-CE1 3.5Å; F407-F438 HydrophobicContact CB-CZ 3.85Å; F407-L441 HydrophobicContact CD2-CD2 4.48Å; F407-L441 HydrophobicContact CG-CD2 4.45Å; F407-V453 HydrophobicContact CZ-CG1 3.87Å; F407-F457 AromaticContact CD2-CD2 3.45Å; F407-F457 HydrophobicContact CD2-CD2 3.45Å; F407-F457 VanDerWaalsContact CD2-CD2 3.45Å; F407-F457 AromaticContact CD2-CE2 3.8Å; F407-F457 HydrophobicContact CD2-CE2 3.8Å; F407-F457 HydrophobicContact CD2-CG 4.18Å; F407-F457 HydrophobicContact CE2-CB 3.67Å; F407-F457 AromaticContact CE2-CD2 3.25Å; F407-F457 HydrophobicContact CE2-CD2 3.25Å; F407-F457 HydrophobicContact CE2-CE2 4.08Å; F407-F457 AromaticContact CE2-CG 3.63Å; F407-F457 HydrophobicContact CE2-CG 3.63Å; F407-F457 HydrophobicContact CG-CD2 4.2Å; F407-F457 HydrophobicContact CG-CE2 4.41Å; F407-F457 HydrophobicContact CZ-CB 3.94Å; F407-F457 AromaticContact CZ-CD2 3.86Å; F407-F457 HydrophobicContact CZ-CD2 3.86Å; F407-F457 HydrophobicContact CZ-CG 4.27Å
408	E	94	Very high	91.5	Very high	76 Å²	76	62.2 Å²	62.2	36%	0.355	29%	0.285	S	S	.	.	H	α-helix	trans	-59.9	-47.1	175.6	-71	166.3	174.8	0	0	111.2	K404 M410 R411 Q412 F438	K404-E408 WeakPolarHBondContact CE-OE1 3.41Å; K404-E408 IonicContact NZ-OE1 3.19Å; K404-E408 PolarHBondContact NZ-OE1 3.29Å; K404-E408 WeakPolarHBondContact O-CG 3.39Å; K404-E408 PolarHBondContact O-N 3.38Å; E408-M410 PolarHBondContact O-N 2.95Å; E408-R411 PolarHBondContact O-N 2.94Å; E408-Q412 PolarHBondContact O-N 2.97Å; E408-F438 HydrophobicContact CG-CE1 3.84Å; E408-F438 HydrophobicContact CG-CZ 4.35Å
409	K	92.5	Very high	91.1	Very high	98 Å²	98	63.6 Å²	63.6	43%	0.426	30%	0.301	S	S	.	.	H	α-helix	trans	-59.4	-41.7	175.3	-82.4	177.6	179.6	-172.2	0	113.2	V405 F413 M468	V405-K409 HydrophobicContact CG1-CD 4.22Å; V405-K409 VanDerWaalsContact O-CB 3.29Å; V405-K409 WeakPolarHBondContact O-CB 3.45Å; V405-K409 VanDerWaalsContact O-CG 3.24Å; V405-K409 WeakPolarHBondContact O-CG 3.24Å; V405-K409 PolarHBondContact O-N 3.38Å; K409-F413 PolarHBondContact O-N 2.99Å; K409-F413 VanDerWaalsContact O-N 3.14Å; K409-M468 HydrophobicContact CB-SD 4.04Å
410	M	92.6	Very high	90.5	Very high	0 Å²	0	61.8 Å²	61.8	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-71.7	-41.3	177.7	-177.5	57.3	69.2	0	0	111.6	L406 F407 E408 Q412 F413 Q414 I433 F457 Y461 E464 L465 M468	L406-M410 WeakPolarHBondContact O-CB 3.4Å; L406-M410 PolarHBondContact O-N 3.46Å; F407-M410 PolarHBondContact O-N 2.86Å; E408-M410 PolarHBondContact O-N 2.95Å; M410-Q412 VanDerWaalsContact C-N 3.32Å; M410-Q412 PolarHBondContact O-N 3.44Å; M410-F413 PolarHBondContact O-N 3.4Å; M410-F413 HydrophobicContact SD-CD1 3.97Å; M410-Q414 WeakPolarHBondContact O-CG 3.46Å; M410-Q414 PolarHBondContact O-N 2.91Å; M410-Q414 HydrophobicContact SD-CG 4.38Å; M410-I433 HydrophobicContact CB-CD1 3.62Å; M410-I433 HydrophobicContact CG-CD1 3.64Å; M410-I433 HydrophobicContact CG-CG1 4.5Å; M410-F457 HydrophobicContact CB-CE2 4.15Å; M410-F457 HydrophobicContact CB-CZ 4.23Å; M410-F457 HydrophobicContact CE-CZ 4.5Å; M410-F457 HydrophobicContact CG-CE2 4.32Å; M410-F457 HydrophobicContact CG-CZ 4.45Å; M410-Y461 HydrophobicContact CG-CD1 3.92Å; M410-Y461 HydrophobicContact CG-CG 4.16Å; M410-E464 HydrophobicContact CE-CB 3.83Å; M410-E464 HydrophobicContact SD-CB 3.78Å; M410-L465 HydrophobicContact CE-CD2 3.67Å; M410-L465 HydrophobicContact CE-CG 4.02Å; M410-M468 HydrophobicContact CB-SD 4.12Å; M410-M468 HydrophobicContact CE-CB 4.02Å; M410-M468 HydrophobicContact CE-CG 4.32Å; M410-M468 HydrophobicContact CE-SD 3.66Å; M410-M468 HydrophobicContact SD-SD 4.35Å
411	R	92.6	Very high	89.6	Confident	77 Å²	77	65.1 Å²	65.1	29%	0.291	33%	0.33	S	S	.	.	H	α-helix	trans	-58.6	-44.4	174.7	-171.6	-171.1	-168.6	154.3	3.4	110.8	F407 E408 Q414 L415 I433 D435 F438	F407-R411 WeakPolarHBondContact O-CB 3.29Å; F407-R411 PolarHBondContact O-N 3.1Å; E408-R411 PolarHBondContact O-N 2.94Å; R411-Q414 PolarHBondContact O-N 3.4Å; R411-L415 HydrophobicContact CG-CD1 4.12Å; R411-L415 WeakPolarHBondContact O-CB 3.09Å; R411-L415 VanDerWaalsContact O-CG 3.28Å; R411-L415 WeakPolarHBondContact O-CG 3.47Å; R411-L415 PolarHBondContact O-N 3.25Å; R411-I433 HydrophobicContact CB-CB 4.31Å; R411-I433 HydrophobicContact CB-CD1 4.45Å; R411-D435 IonicContact CZ-OD1 3.18Å; R411-D435 IonicContact NH1-OD1 3.37Å; R411-D435 PolarHBondContact NH1-OD1 2.9Å; R411-D435 IonicContact NH2-OD1 3.82Å; R411-D435 PolarHBondContact NH2-OD1 3.12Å; R411-D435 IonicContact NH2-OD2 3.73Å; R411-D435 PolarHBondContact NH2-OD2 3.37Å; R411-F438 HydrophobicContact CB-CZ 4.39Å; R411-F438 VanDerWaalsContact NH1-CE2 3.3Å
412	Q	91.2	Very high	88.6	Confident	102 Å²	102	64.2 Å²	64.2	48%	0.477	34%	0.34	S	S	.	.	H	α-helix	trans	-63.8	-42.6	176.8	-170.9	61.4	47.5	0	0	111.9	E408 M410 Q414 L415 D416	E408-Q412 PolarHBondContact O-N 2.97Å; M410-Q412 VanDerWaalsContact C-N 3.32Å; M410-Q412 PolarHBondContact O-N 3.44Å; Q412-Q414 PolarHBondContact O-N 3.5Å; Q412-L415 PolarHBondContact O-N 3.07Å; Q412-D416 PolarHBondContact NE2-OD1 3.44Å; Q412-D416 WeakPolarHBondContact O-CB 3.4Å; Q412-D416 PolarHBondContact O-N 2.87Å
413	F	90.8	Very high	87.7	Confident	11 Å²	11	65.8 Å²	65.8	5%	0.048	35%	0.354	C	S	.	.	H	α-helix	trans	-63.3	-40.3	176.2	169.4	-98.4	0	0	0	112.9	K409 M410 T417 E464 R467 M468 E471	K409-F413 PolarHBondContact O-N 2.99Å; K409-F413 VanDerWaalsContact O-N 3.14Å; M410-F413 PolarHBondContact O-N 3.4Å; M410-F413 HydrophobicContact SD-CD1 3.97Å; F413-T417 WeakPolarHBondContact O-CB 3.42Å; F413-T417 PolarHBondContact O-N 3.19Å; F413-T417 PolarHBondContact O-OG1 3.45Å; F413-E464 HydrophobicContact CE1-CB 4.14Å; F413-R467 HydrophobicContact CE1-CB 4.3Å; F413-R467 HydrophobicContact CE2-CB 4.19Å; F413-R467 HydrophobicContact CZ-CB 3.58Å; F413-M468 HydrophobicContact CB-CB 4.16Å; F413-M468 HydrophobicContact CB-CG 3.76Å; F413-M468 HydrophobicContact CD1-CB 3.99Å; F413-M468 HydrophobicContact CD1-CG 4.48Å; F413-M468 HydrophobicContact CD2-CB 4.13Å; F413-M468 HydrophobicContact CD2-CG 4.46Å; F413-M468 HydrophobicContact CE1-CB 4.49Å; F413-M468 HydrophobicContact CG-CB 3.8Å; F413-M468 HydrophobicContact CG-CG 3.97Å; F413-E471 HydrophobicContact CD2-CB 3.94Å; F413-E471 HydrophobicContact CD2-CG 4.03Å; F413-E471 HydrophobicContact CE2-CB 3.99Å; F413-E471 HydrophobicContact CE2-CG 4.29Å
414	Q	89.4	Confident	86.7	Confident	8 Å²	8	71.4 Å²	71.4	4%	0.037	38%	0.38	C	S	.	.	H	α-helix	trans	-64.3	-44.4	173.6	-71.3	-175	-26.3	0	0	111.1	M410 R411 Q412 T417 L418 R431 L432 E464	M410-Q414 WeakPolarHBondContact O-CG 3.46Å; M410-Q414 PolarHBondContact O-N 2.91Å; M410-Q414 HydrophobicContact SD-CG 4.38Å; R411-Q414 PolarHBondContact O-N 3.4Å; Q412-Q414 PolarHBondContact O-N 3.5Å; Q414-T417 PolarHBondContact O-N 3.44Å; Q414-L418 VanDerWaalsContact O-CG 3.27Å; Q414-L418 WeakPolarHBondContact O-CG 3.3Å; Q414-L418 PolarHBondContact O-N 2.59Å; Q414-R431 PolarHBondContact NE2-O 2.97Å; Q414-L432 HydrophobicContact CB-CD2 4.4Å; Q414-E464 PolarHBondContact NE2-OE2 3.44Å
415	L	88.4	Confident	85.6	Confident	78 Å²	78	71.9 Å²	71.9	41%	0.408	39%	0.393	S	S	.	.	H	α-helix	trans	-62	-47.4	175.8	-73.3	169.3	0	0	0	112.3	R411 Q412 T417 L418 C419	R411-L415 HydrophobicContact CG-CD1 4.12Å; R411-L415 WeakPolarHBondContact O-CB 3.09Å; R411-L415 VanDerWaalsContact O-CG 3.28Å; R411-L415 WeakPolarHBondContact O-CG 3.47Å; R411-L415 PolarHBondContact O-N 3.25Å; Q412-L415 PolarHBondContact O-N 3.07Å; L415-T417 VanDerWaalsContact C-N 3.27Å; L415-T417 PolarHBondContact O-N 2.83Å; L415-L418 PolarHBondContact O-N 3.32Å; L415-C419 WeakPolarHBondContact O-CB 3.16Å; L415-C419 PolarHBondContact O-N 3.03Å; L415-C419 PolarHBondContact O-SG 3.28Å; L415-C419 VanDerWaalsContact O-SG 3.35Å
416	D	87.8	Confident	84.6	Confident	49 Å²	49	72.8 Å²	72.8	26%	0.262	40%	0.399	S	S	.	.	H	α-helix	trans	-57	-42.3	176.1	-70	-14.5	0	0	0	111.2	Q412 C419 A420 K475	Q412-D416 PolarHBondContact NE2-OD1 3.44Å; Q412-D416 WeakPolarHBondContact O-CB 3.4Å; Q412-D416 PolarHBondContact O-N 2.87Å; D416-C419 PolarHBondContact O-N 2.77Å; D416-A420 PolarHBondContact O-N 2.54Å; D416-A420 VanDerWaalsContact O-N 3.13Å; D416-K475 IonicContact OD2-NZ 3.39Å; D416-K475 PolarHBondContact OD2-NZ 3.16Å
417	T	85.2	Confident	83.6	Confident	55 Å²	55	73.6 Å²	73.6	34%	0.337	41%	0.407	S	S	.	.	H	α-helix	trans	-67.2	-41.4	178.8	-57.3	0	0	0	0	111.8	F413 Q414 L415 A420	F413-T417 WeakPolarHBondContact O-CB 3.42Å; F413-T417 PolarHBondContact O-N 3.19Å; F413-T417 PolarHBondContact O-OG1 3.45Å; Q414-T417 PolarHBondContact O-N 3.44Å; L415-T417 VanDerWaalsContact C-N 3.27Å; L415-T417 PolarHBondContact O-N 2.83Å; T417-A420 PolarHBondContact O-N 2.9Å
418	L	82.7	Confident	82.3	Confident	58 Å²	58	79 Å²	79	30%	0.304	44%	0.436	S	S	.	.	H	α-helix	trans	-70.3	-32.6	176.3	-68.9	170.6	0	0	0	112.8	Q414 L415 A420 V426 L432	Q414-L418 VanDerWaalsContact O-CG 3.27Å; Q414-L418 WeakPolarHBondContact O-CG 3.3Å; Q414-L418 PolarHBondContact O-N 2.59Å; L415-L418 PolarHBondContact O-N 3.32Å; L418-A420 VanDerWaalsContact C-N 3.3Å; L418-V426 HydrophobicContact CD2-CG2 3.94Å; L418-L432 HydrophobicContact CD1-CD1 3.98Å; L418-L432 HydrophobicContact CD1-CD2 3.88Å
419	C	83.6	Confident	81.1	Confident	95 Å²	95	78.8 Å²	78.8	64%	0.642	44%	0.437	S	S	*	.	H	α-helix	trans	-74.1	-19.2	175.2	-73.4	0	0	0	0	113.4	L415 D416	L415-C419 WeakPolarHBondContact O-CB 3.16Å; L415-C419 PolarHBondContact O-N 3.03Å; L415-C419 PolarHBondContact O-SG 3.28Å; L415-C419 VanDerWaalsContact O-SG 3.35Å; D416-C419 PolarHBondContact O-N 2.77Å
420	A	82.4	Confident	80.4	Confident	77 Å²	77	75.8 Å²	75.8	64%	0.636	43%	0.427	S	S	*	.	H	α-helix	trans	-74.9	-39.3	176.8	0	0	0	0	0	113	D416 T417 L418	D416-A420 PolarHBondContact O-N 2.54Å; D416-A420 VanDerWaalsContact O-N 3.13Å; T417-A420 PolarHBondContact O-N 2.9Å; L418-A420 VanDerWaalsContact C-N 3.3Å
421	D	73.7	Confident	80	Confident	110 Å²	110	78.7 Å²	78.7	59%	0.588	44%	0.438	S	S	*	.	S	Bend	trans	-130.5	69.9	-178.9	-93.3	-55.1	0	0	0	110.8	D423 Q424	D421-D423 PolarHBondContact O-N 2.86Å; D421-Q424 HydrophobicContact CB-CB 4.29Å; D421-Q424 PolarHBondContact O-N 2.88Å
422	T	72.6	Confident	79.8	Confident	114 Å²	114	77.8 Å²	77.8	70%	0.699	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-16.5	-172.8	56.1	0	0	0	0	115.5
423	D	74	Confident	79.7	Confident	162 Å²	162	73.3 Å²	73.3	87%	0.866	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.8	-8.8	177.9	-74.3	-28.2	0	0	0	113.3	D421	D421-D423 PolarHBondContact O-N 2.86Å
424	Q	71.7	Confident	79.7	Confident	133 Å²	133	77.1 Å²	77.1	62%	0.621	44%	0.438	S	S	*	.	S	Bend	trans	-85.9	125.5	-178.8	-167.4	169.1	53.5	0	0	111.3	D421	D421-Q424 HydrophobicContact CB-CB 4.29Å; D421-Q424 PolarHBondContact O-N 2.88Å
425	P	71.7	Confident	79.8	Confident	109 Å²	109	81.3 Å²	81.3	71%	0.708	46%	0.461	S	S	*	.	P	Polyproline II helix	trans	-65.5	138.8	174.4	27.6	-34.4	0	0	0	110.7
426	V	73.8	Confident	79.9	Confident	69 Å²	69	79.3 Å²	79.3	42%	0.418	45%	0.453	S	S	.	.	P	Polyproline II helix	trans	-54.2	124.5	178.3	-171.7	0	0	0	0	109.6	L418 V430 L432	L418-V426 HydrophobicContact CD2-CG2 3.94Å; V426-V430 HydrophobicContact CG1-CB 4.2Å; V426-V430 HydrophobicContact CG1-CG1 4.22Å; V426-L432 HydrophobicContact CG1-CD2 4.29Å; V426-L432 HydrophobicContact CG1-CG 4.43Å; V426-L432 HydrophobicContact CG2-CD1 4.49Å
427	P	71.2	Confident	80	Confident	62 Å²	62	77.1 Å²	77.1	40%	0.403	44%	0.441	S	S	.	.	P	Polyproline II helix	trans	-58.7	143.3	-179.1	-26.3	35.1	0	0	0	112.8	D429 V430	P427-D429 WeakPolarHBondContact CB-OD1 3.47Å; P427-D429 PolarHBondContact O-N 3.07Å; P427-V430 HydrophobicContact CB-CG2 4.04Å; P427-V430 HydrophobicContact CG-CG2 4.21Å; P427-V430 PolarHBondContact O-N 3.14Å
428	D	66.9	Low	80.4	Confident	116 Å²	116	75.9 Å²	75.9	62%	0.62	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-20.6	-174.8	-99	-53	0	0	0	114.5	K542	D428-K542 VanDerWaalsContact O-CE 3.26Å; D428-K542 WeakPolarHBondContact O-CE 3.46Å; D428-K542 PolarHBondContact O-NZ 2.85Å; D428-K542 IonicContact OD1-NZ 3.39Å; D428-K542 PolarHBondContact OD1-NZ 2.66Å
429	D	69.5	Low	80.8	Confident	72 Å²	72	79 Å²	79	39%	0.385	45%	0.445	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.2	-6.6	177.9	65.2	-40.6	0	0	0	114.8	P427 R533	P427-D429 WeakPolarHBondContact CB-OD1 3.47Å; P427-D429 PolarHBondContact O-N 3.07Å; D429-R533 HydrophobicContact CB-CG 4.09Å
430	V	76.2	Confident	81.1	Confident	34 Å²	34	76.6 Å²	76.6	21%	0.206	42%	0.422	C	S	.	.			trans	-93.8	113.7	177.2	176.4	0	0	0	0	110.3	V426 P427 L432	V426-V430 HydrophobicContact CG1-CB 4.2Å; V426-V430 HydrophobicContact CG1-CG1 4.22Å; P427-V430 HydrophobicContact CB-CG2 4.04Å; P427-V430 HydrophobicContact CG-CG2 4.21Å; P427-V430 PolarHBondContact O-N 3.14Å; V430-L432 HydrophobicContact CG1-CD2 4.18Å
431	R	84.7	Confident	81.6	Confident	61 Å²	61	73.1 Å²	73.1	23%	0.23	39%	0.392	C	S	.	.	P	Polyproline II helix	trans	-88	125.5	166.9	-177.7	178.8	-175.6	-105.8	0.2	108.4	Q414 D437 Y456 N460 Y461	Q414-R431 PolarHBondContact NE2-O 2.97Å; R431-D437 IonicContact CZ-OD1 3.37Å; R431-D437 VanDerWaalsContact CZ-OD1 3.24Å; R431-D437 IonicContact CZ-OD2 3.93Å; R431-D437 VanDerWaalsContact NH1-CG 3.29Å; R431-D437 IonicContact NH1-OD1 2.65Å; R431-D437 PolarHBondContact NH1-OD1 3.04Å; R431-D437 IonicContact NH1-OD2 2.67Å; R431-D437 PolarHBondContact NH1-OD2 2.76Å; R431-D437 VanDerWaalsContact NH1-OD2 3.16Å; R431-D437 IonicContact NH2-OD1 3.51Å; R431-D437 PolarHBondContact NH2-OD1 3.15Å; R431-D437 IonicContact NH2-OD2 3.74Å; R431-D437 PolarHBondContact NH2-OD2 3.16Å; R431-Y456 PolarHBondContact NH2-OH 2.85Å; R431-N460 WeakPolarHBondContact CD-OD1 3.23Å; R431-Y461 PolarHBondContact NH1-OH 2.74Å; R431-Y461 WeakPolarHBondContact O-CE1 3.35Å
432	L	88	Confident	82.4	Confident	58 Å²	58	70.7 Å²	70.7	30%	0.304	39%	0.388	S	S	.	.	P	Polyproline II helix	trans	-76.6	147.6	170.3	-57.1	-177.6	0	0	0	110.5	Q414 L418 V426 V430 L434	Q414-L432 HydrophobicContact CB-CD2 4.4Å; L418-L432 HydrophobicContact CD1-CD1 3.98Å; L418-L432 HydrophobicContact CD1-CD2 3.88Å; V426-L432 HydrophobicContact CG1-CD2 4.29Å; V426-L432 HydrophobicContact CG1-CG 4.43Å; V426-L432 HydrophobicContact CG2-CD1 4.49Å; V430-L432 HydrophobicContact CG1-CD2 4.18Å; L432-L434 PolarHBondContact O-N 3Å
433	I	90.3	Very high	83.3	Confident	8 Å²	8	71 Å²	71	4%	0.041	39%	0.385	C	S	.	.	P	Polyproline II helix	trans	-72.3	122.9	168.8	-62.3	-178.5	0	0	0	109.1	F407 M410 R411 D437 F438 F457 Y461	F407-I433 HydrophobicContact CB-CD1 4.39Å; F407-I433 HydrophobicContact CD1-CG2 4.43Å; F407-I433 WeakPolarHBondContact O-CD1 3.31Å; M410-I433 HydrophobicContact CB-CD1 3.62Å; M410-I433 HydrophobicContact CG-CD1 3.64Å; M410-I433 HydrophobicContact CG-CG1 4.5Å; R411-I433 HydrophobicContact CB-CB 4.31Å; R411-I433 HydrophobicContact CB-CD1 4.45Å; I433-D437 HydrophobicContact CG2-CB 3.97Å; I433-F438 HydrophobicContact CG2-CD2 4.17Å; I433-F438 HydrophobicContact CG2-CE2 3.4Å; I433-F438 VanDerWaalsContact CG2-CE2 3.4Å; I433-F438 HydrophobicContact CG2-CZ 3.84Å; I433-F457 HydrophobicContact CD1-CE2 4.34Å; I433-Y461 HydrophobicContact CD1-CD1 4.41Å; I433-Y461 HydrophobicContact CD1-CE1 4.13Å; I433-Y461 HydrophobicContact CG1-CD1 4.13Å; I433-Y461 HydrophobicContact CG1-CE1 3.39Å; I433-Y461 HydrophobicContact CG1-CE2 4.12Å; I433-Y461 VanDerWaalsContact CG1-CZ 3.42Å
434	L	90	Very high	84.3	Confident	91 Å²	91	63.4 Å²	63.4	48%	0.476	35%	0.345	S	S	.	.	P	Polyproline II helix	trans	-98.7	163.8	179	-57.3	-179	0	0	0	111.1	L432 S436 D437 F438	L432-L434 PolarHBondContact O-N 3Å; L434-S436 PolarHBondContact O-N 3.31Å; L434-D437 PolarHBondContact N-OD2 3.24Å; L434-D437 WeakPolarHBondContact O-CB 3.45Å; L434-D437 PolarHBondContact O-N 2.92Å; L434-F438 WeakPolarHBondContact O-CD2 3.28Å
435	D	91.5	Very high	85.3	Confident	97 Å²	97	59.4 Å²	59.4	52%	0.519	33%	0.326	S	S	.	.	H	α-helix	trans	-61.6	-31	174.3	-63	-57.9	0	0	0	112	R411 D437 F438 E439	R411-D435 IonicContact CZ-OD1 3.18Å; R411-D435 IonicContact NH1-OD1 3.37Å; R411-D435 PolarHBondContact NH1-OD1 2.9Å; R411-D435 IonicContact NH2-OD1 3.82Å; R411-D435 PolarHBondContact NH2-OD1 3.12Å; R411-D435 IonicContact NH2-OD2 3.73Å; R411-D435 PolarHBondContact NH2-OD2 3.37Å; D435-D437 VanDerWaalsContact C-N 3.26Å; D435-D437 PolarHBondContact O-N 2.66Å; D435-F438 WeakPolarHBondContact O-CA 3.46Å; D435-F438 WeakPolarHBondContact O-CB 3.44Å; D435-F438 PolarHBondContact O-N 2.91Å; D435-E439 PolarHBondContact O-N 2.96Å
436	S	90	Very high	86.2	Confident	36 Å²	36	55 Å²	55	25%	0.252	30%	0.298	S	S	.	.	H	α-helix	trans	-64.7	-23	172.4	58	0	0	0	0	114.3	L434 F438 E439 R440	L434-S436 PolarHBondContact O-N 3.31Å; S436-F438 VanDerWaalsContact C-N 3.31Å; S436-E439 WeakPolarHBondContact CA-OE2 3.31Å; S436-R440 WeakPolarHBondContact O-CB 3.19Å; S436-R440 VanDerWaalsContact O-CD 3.27Å; S436-R440 WeakPolarHBondContact O-CD 3.4Å; S436-R440 WeakPolarHBondContact O-CG 3.33Å; S436-R440 PolarHBondContact O-N 3.04Å
437	D	91	Very high	87.1	Confident	2 Å²	2	53.1 Å²	53.1	1%	0.011	29%	0.285	C	S	.	.	H	α-helix	trans	-71	-29.9	171.3	-68.2	-59.9	0	0	0	111.6	F407 R431 I433 L434 D435 L441	F407-D437 HydrophobicContact CD1-CB 4.24Å; F407-D437 HydrophobicContact CE1-CB 4.06Å; R431-D437 IonicContact CZ-OD1 3.37Å; R431-D437 VanDerWaalsContact CZ-OD1 3.24Å; R431-D437 IonicContact CZ-OD2 3.93Å; R431-D437 VanDerWaalsContact NH1-CG 3.29Å; R431-D437 IonicContact NH1-OD1 2.65Å; R431-D437 PolarHBondContact NH1-OD1 3.04Å; R431-D437 IonicContact NH1-OD2 2.67Å; R431-D437 PolarHBondContact NH1-OD2 2.76Å; R431-D437 VanDerWaalsContact NH1-OD2 3.16Å; R431-D437 IonicContact NH2-OD1 3.51Å; R431-D437 PolarHBondContact NH2-OD1 3.15Å; R431-D437 IonicContact NH2-OD2 3.74Å; R431-D437 PolarHBondContact NH2-OD2 3.16Å; I433-D437 HydrophobicContact CG2-CB 3.97Å; L434-D437 PolarHBondContact N-OD2 3.24Å; L434-D437 WeakPolarHBondContact O-CB 3.45Å; L434-D437 PolarHBondContact O-N 2.92Å; D435-D437 VanDerWaalsContact C-N 3.26Å; D435-D437 PolarHBondContact O-N 2.66Å; D437-L441 PolarHBondContact O-N 3.27Å
438	F	92.7	Very high	88.2	Confident	30 Å²	30	53 Å²	53	13%	0.132	28%	0.279	C	S	.	.	H	α-helix	trans	-78.1	-37.1	172.3	-64.6	-83	0	0	0	112	K404 F407 E408 R411 I433 L434 D435 S436 L441 A442	K404-F438 HydrophobicContact CG-CD1 4.21Å; K404-F438 HydrophobicContact CG-CE1 4.49Å; F407-F438 HydrophobicContact CB-CD1 4.28Å; F407-F438 HydrophobicContact CB-CE1 3.5Å; F407-F438 VanDerWaalsContact CB-CE1 3.5Å; F407-F438 HydrophobicContact CB-CZ 3.85Å; E408-F438 HydrophobicContact CG-CE1 3.84Å; E408-F438 HydrophobicContact CG-CZ 4.35Å; R411-F438 HydrophobicContact CB-CZ 4.39Å; R411-F438 VanDerWaalsContact NH1-CE2 3.3Å; I433-F438 HydrophobicContact CG2-CD2 4.17Å; I433-F438 HydrophobicContact CG2-CE2 3.4Å; I433-F438 VanDerWaalsContact CG2-CE2 3.4Å; I433-F438 HydrophobicContact CG2-CZ 3.84Å; L434-F438 WeakPolarHBondContact O-CD2 3.28Å; D435-F438 WeakPolarHBondContact O-CA 3.46Å; D435-F438 WeakPolarHBondContact O-CB 3.44Å; D435-F438 PolarHBondContact O-N 2.91Å; S436-F438 VanDerWaalsContact C-N 3.31Å; F438-L441 PolarHBondContact O-N 3.06Å; F438-A442 WeakPolarHBondContact O-CB 3.34Å; F438-A442 PolarHBondContact O-N 2.89Å
439	E	91.6	Very high	89.5	Confident	124 Å²	124	48.6 Å²	48.6	58%	0.579	26%	0.255	S	S	*	.	H	α-helix	trans	-59.7	-49.7	171.6	-65.8	172.9	160.5	0	0	110.6	D435 S436 L441 A442 D443	D435-E439 PolarHBondContact O-N 2.96Å; S436-E439 WeakPolarHBondContact CA-OE2 3.31Å; E439-L441 VanDerWaalsContact C-N 3.25Å; E439-L441 PolarHBondContact O-N 3.06Å; E439-A442 WeakPolarHBondContact O-CB 3.42Å; E439-A442 PolarHBondContact O-N 2.94Å; E439-D443 PolarHBondContact O-N 3.42Å
440	R	89.7	Confident	90.7	Very high	43 Å²	43	45.9 Å²	45.9	16%	0.162	24%	0.24	C	C	.	.	H	α-helix	trans	-52.7	-40.8	173.8	-77.5	161.3	163.7	-105.2	-10.3	112.9	S436 Y456 E549 E604	S436-R440 WeakPolarHBondContact O-CB 3.19Å; S436-R440 VanDerWaalsContact O-CD 3.27Å; S436-R440 WeakPolarHBondContact O-CD 3.4Å; S436-R440 WeakPolarHBondContact O-CG 3.33Å; S436-R440 PolarHBondContact O-N 3.04Å; R440-Y456 PolarHBondContact NH1-OH 2.81Å; R440-E549 IonicContact CZ-OE1 3.76Å; R440-E549 IonicContact NE-OE1 3.03Å; R440-E549 PolarHBondContact NE-OE1 3.21Å; R440-E549 VanDerWaalsContact NH2-CD 3.25Å; R440-E549 IonicContact NH2-OE1 2.68Å; R440-E549 PolarHBondContact NH2-OE1 3.14Å; R440-E604 IonicContact CZ-OE1 3.72Å; R440-E604 IonicContact NH1-OE1 3.59Å; R440-E604 PolarHBondContact NH1-OE1 3.11Å; R440-E604 IonicContact NH1-OE2 2.73Å; R440-E604 IonicContact NH2-OE1 2.78Å; R440-E604 PolarHBondContact NH2-OE1 3.31Å
441	L	92.6	Very high	91.6	Very high	4 Å²	4	50.8 Å²	50.8	2%	0.021	26%	0.259	C	S	.	.	H	α-helix	trans	-74.6	-36.3	177.2	179.8	58.4	0	0	0	112.3	K400 L403 K404 F407 D437 F438 E439 D443 V444 L450 V453	K400-L441 WeakPolarHBondContact CE-O 3.41Å; K400-L441 HydrophobicContact CG-CD1 4.25Å; L403-L441 HydrophobicContact CB-CD1 4.39Å; L403-L441 HydrophobicContact CB-CD2 4.37Å; L403-L441 HydrophobicContact CD2-CD1 3.85Å; L403-L441 HydrophobicContact CG-CD1 4.22Å; L403-L441 HydrophobicContact CG-CD2 4.26Å; K404-L441 VanDerWaalsContact CA-CD2 3.49Å; K404-L441 HydrophobicContact CB-CD2 3.78Å; K404-L441 HydrophobicContact CG-CD2 4.25Å; F407-L441 HydrophobicContact CD2-CD2 4.48Å; F407-L441 HydrophobicContact CG-CD2 4.45Å; D437-L441 PolarHBondContact O-N 3.27Å; F438-L441 PolarHBondContact O-N 3.06Å; E439-L441 VanDerWaalsContact C-N 3.25Å; E439-L441 PolarHBondContact O-N 3.06Å; L441-D443 VanDerWaalsContact C-N 3.32Å; L441-V444 HydrophobicContact CD1-CG2 4.34Å; L441-V444 WeakPolarHBondContact O-CB 3.2Å; L441-V444 PolarHBondContact O-N 3.41Å; L441-L450 HydrophobicContact CD1-CD1 3.77Å; L441-V453 HydrophobicContact CB-CG1 4.47Å; L441-V453 HydrophobicContact CD1-CG1 4.09Å
442	A	91.5	Very high	92.1	Very high	60 Å²	60	48 Å²	48	50%	0.496	25%	0.248	S	C	.	.	H	α-helix	trans	-65.5	-35.1	174.9	0	0	0	0	0	112.1	K400 F438 E439 V444	K400-A442 WeakPolarHBondContact CE-O 3.29Å; K400-A442 PolarHBondContact NZ-O 3.24Å; F438-A442 WeakPolarHBondContact O-CB 3.34Å; F438-A442 PolarHBondContact O-N 2.89Å; E439-A442 WeakPolarHBondContact O-CB 3.42Å; E439-A442 PolarHBondContact O-N 2.94Å; A442-V444 VanDerWaalsContact C-N 3.31Å; A442-V444 PolarHBondContact O-N 2.91Å
443	D	91.9	Very high	92.5	Very high	119 Å²	119	45.6 Å²	45.6	64%	0.636	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.2	-18.3	177.8	-82.5	-9.6	0	0	0	114	E439 L441 Q445	E439-D443 PolarHBondContact O-N 3.42Å; L441-D443 VanDerWaalsContact C-N 3.32Å; D443-Q445 VanDerWaalsContact O-CG 3.28Å; D443-Q445 WeakPolarHBondContact O-CG 3.35Å; D443-Q445 PolarHBondContact O-N 3.39Å; D443-Q445 PolarHBondContact O-NE2 3.48Å
444	V	93.4	Very high	92.7	Very high	4 Å²	4	48.9 Å²	48.9	2%	0.024	25%	0.251	C	S	.	.			trans	-54.9	127	-179.3	170.3	0	0	0	0	112.3	L396 K400 L441 A442 S446 E449 L450 V453	L396-V444 HydrophobicContact CD1-CG1 4.35Å; K400-V444 PolarHBondContact NZ-O 3.36Å; L441-V444 HydrophobicContact CD1-CG2 4.34Å; L441-V444 WeakPolarHBondContact O-CB 3.2Å; L441-V444 PolarHBondContact O-N 3.41Å; A442-V444 VanDerWaalsContact C-N 3.31Å; A442-V444 PolarHBondContact O-N 2.91Å; V444-S446 WeakPolarHBondContact CG1-O 3.32Å; V444-E449 HydrophobicContact CG1-CB 3.99Å; V444-E449 HydrophobicContact CG2-CB 4.5Å; V444-L450 HydrophobicContact CG1-CB 3.82Å; V444-L450 HydrophobicContact CG1-CD1 4.08Å; V444-V453 HydrophobicContact CG2-CB 4.42Å; V444-V453 HydrophobicContact CG2-CG2 3.78Å
445	Q	92.4	Very high	92.8	Very high	49 Å²	49	46.8 Å²	46.8	23%	0.229	24%	0.239	C	C	.	.			trans	-117.6	-7.2	-177.1	-53.9	-65.2	-69	0	0	114.6	W316 Y320 L396 D443 E449	W316-Q445 PolarHBondContact NE1-O 2.86Å; Y320-Q445 HydrophobicContact CE2-CB 3.99Å; Y320-Q445 WeakPolarHBondContact OH-CB 3.38Å; L396-Q445 WeakPolarHBondContact CD2-O 3.5Å; D443-Q445 VanDerWaalsContact O-CG 3.28Å; D443-Q445 WeakPolarHBondContact O-CG 3.35Å; D443-Q445 PolarHBondContact O-N 3.39Å; D443-Q445 PolarHBondContact O-NE2 3.48Å; Q445-E449 PolarHBondContact N-OE2 3.29Å
446	S	92.6	Very high	92.9	Very high	15 Å²	15	43 Å²	43	11%	0.105	22%	0.218	C	C	.	.	S	Bend	trans	-147.1	169.3	179.3	82.3	0	0	0	0	113.3	V444 E448 E449 L450	V444-S446 WeakPolarHBondContact CG1-O 3.32Å; S446-E448 VanDerWaalsContact C-N 3.31Å; S446-E448 WeakPolarHBondContact CB-OE2 3.38Å; S446-E448 PolarHBondContact O-N 2.78Å; S446-E448 PolarHBondContact OG-N 2.8Å; S446-E448 PolarHBondContact OG-OE2 2.93Å; S446-E449 PolarHBondContact O-N 2.85Å; S446-E449 PolarHBondContact OG-N 3.42Å; S446-L450 WeakPolarHBondContact O-CB 3.3Å; S446-L450 PolarHBondContact O-N 3.39Å
447	M	92.5	Very high	93	Very high	31 Å²	31	41.2 Å²	41.2	15%	0.153	21%	0.206	C	C	.	.	H	α-helix	trans	-68.3	-31.9	179.4	-67.9	-69.3	179.8	0	0	112.1	Q395 L396 R399 L450 K451	Q395-M447 HydrophobicContact CB-CE 3.75Å; Q395-M447 HydrophobicContact CG-CE 3.87Å; L396-M447 HydrophobicContact CB-CE 3.94Å; L396-M447 HydrophobicContact CD1-CE 4.44Å; L396-M447 HydrophobicContact CD1-SD 4.11Å; R399-M447 PolarHBondContact NH1-SD 2.88Å; M447-L450 PolarHBondContact O-N 3.27Å; M447-K451 WeakPolarHBondContact O-CB 3.31Å; M447-K451 PolarHBondContact O-N 2.68Å
448	E	92.8	Very high	93	Very high	60 Å²	60	44.2 Å²	44.2	28%	0.28	22%	0.221	S	C	.	.	H	α-helix	trans	-70.2	-43.6	177.6	-46.1	70.6	-117.9	0	0	110.3	S446 L450 K451 D452 E734	S446-E448 VanDerWaalsContact C-N 3.31Å; S446-E448 WeakPolarHBondContact CB-OE2 3.38Å; S446-E448 PolarHBondContact O-N 2.78Å; S446-E448 PolarHBondContact OG-N 2.8Å; S446-E448 PolarHBondContact OG-OE2 2.93Å; E448-L450 VanDerWaalsContact C-N 3.32Å; E448-L450 PolarHBondContact O-N 3.37Å; E448-K451 WeakPolarHBondContact O-CB 3.49Å; E448-K451 PolarHBondContact O-N 3.08Å; E448-D452 VanDerWaalsContact O-CG 3.22Å; E448-D452 PolarHBondContact O-N 3.5Å; E448-E734 HydrophobicContact CG-CG 4.3Å
449	E	94.7	Very high	92.9	Very high	23 Å²	23	43.4 Å²	43.4	11%	0.107	22%	0.218	C	C	.	.	H	α-helix	trans	-62.9	-37.9	171.4	-70	-179	172.3	0	0	111.9	V444 Q445 S446 D452 V453 K609	V444-E449 HydrophobicContact CG1-CB 3.99Å; V444-E449 HydrophobicContact CG2-CB 4.5Å; Q445-E449 PolarHBondContact N-OE2 3.29Å; S446-E449 PolarHBondContact O-N 2.85Å; S446-E449 PolarHBondContact OG-N 3.42Å; E449-D452 PolarHBondContact O-N 3.19Å; E449-V453 WeakPolarHBondContact O-CG2 3.4Å; E449-V453 PolarHBondContact O-N 2.79Å; E449-K609 WeakPolarHBondContact OE1-CD 2.97Å; E449-K609 WeakPolarHBondContact OE1-CE 3.49Å; E449-K609 IonicContact OE1-NZ 3.37Å; E449-K609 PolarHBondContact OE1-NZ 3.04Å; E449-K609 IonicContact OE2-NZ 3.19Å
450	L	95.2	Very high	92.7	Very high	15 Å²	15	38.9 Å²	38.9	8%	0.079	20%	0.198	C	C	.	.	H	α-helix	trans	-66.7	-38.5	175	-167.2	66.1	0	0	0	111.8	L396 R399 K400 L403 L441 V444 S446 M447 E448 V453 H454	L396-L450 HydrophobicContact CD1-CB 4.43Å; L396-L450 HydrophobicContact CD1-CD2 4.31Å; R399-L450 HydrophobicContact CB-CD2 3.47Å; R399-L450 VanDerWaalsContact CB-CD2 3.47Å; K400-L450 HydrophobicContact CB-CD1 4.22Å; L403-L450 HydrophobicContact CD2-CD1 3.71Å; L403-L450 HydrophobicContact CD2-CG 4.37Å; L441-L450 HydrophobicContact CD1-CD1 3.77Å; V444-L450 HydrophobicContact CG1-CB 3.82Å; V444-L450 HydrophobicContact CG1-CD1 4.08Å; S446-L450 WeakPolarHBondContact O-CB 3.3Å; S446-L450 PolarHBondContact O-N 3.39Å; M447-L450 PolarHBondContact O-N 3.27Å; E448-L450 VanDerWaalsContact C-N 3.32Å; E448-L450 PolarHBondContact O-N 3.37Å; L450-V453 PolarHBondContact O-N 3.3Å; L450-H454 WeakPolarHBondContact O-CB 3.39Å; L450-H454 PolarHBondContact O-N 3.21Å
451	K	95	Very high	92.7	Very high	137 Å²	137	36.9 Å²	36.9	60%	0.596	19%	0.19	S	C	*	.	H	α-helix	trans	-63.2	-43.2	173.2	-174.7	176.4	-179.3	176.2	0	110.7	M447 E448 H454 M455	M447-K451 WeakPolarHBondContact O-CB 3.31Å; M447-K451 PolarHBondContact O-N 2.68Å; E448-K451 WeakPolarHBondContact O-CB 3.49Å; E448-K451 PolarHBondContact O-N 3.08Å; K451-H454 PolarHBondContact O-N 2.86Å; K451-M455 HydrophobicContact CG-SD 4.36Å; K451-M455 WeakPolarHBondContact O-CB 3.14Å; K451-M455 VanDerWaalsContact O-CG 3.31Å; K451-M455 WeakPolarHBondContact O-CG 3.16Å; K451-M455 PolarHBondContact O-N 3.32Å
452	D	95.7	Very high	92.4	Very high	2 Å²	2	37.8 Å²	37.8	1%	0.011	20%	0.197	C	C	.	.	H	α-helix	trans	-60.9	-46.9	175.8	-67	-22.5	0	0	0	111.5	E448 E449 M455 Y456 P605 R608 R612	E448-D452 VanDerWaalsContact O-CG 3.22Å; E448-D452 PolarHBondContact O-N 3.5Å; E449-D452 PolarHBondContact O-N 3.19Å; D452-M455 PolarHBondContact O-N 3.36Å; D452-Y456 WeakPolarHBondContact O-CB 3.28Å; D452-Y456 PolarHBondContact O-N 3Å; D452-P605 HydrophobicContact CB-CB 4.22Å; D452-R608 WeakPolarHBondContact OD1-CD 3.31Å; D452-R608 IonicContact OD1-CZ 2.83Å; D452-R608 IonicContact OD1-NE 3.76Å; D452-R608 PolarHBondContact OD1-NE 2.98Å; D452-R608 IonicContact OD1-NH2 3.6Å; D452-R608 WeakPolarHBondContact OD2-CB 3.39Å; D452-R612 IonicContact OD1-NH2 2.66Å; D452-R612 PolarHBondContact OD1-NH2 3.42Å; D452-R612 IonicContact OD2-CZ 3.29Å; D452-R612 VanDerWaalsContact OD2-CZ 3.3Å; D452-R612 IonicContact OD2-NH1 3.07Å; D452-R612 PolarHBondContact OD2-NH1 3.28Å; D452-R612 IonicContact OD2-NH2 3.88Å; D452-R612 PolarHBondContact OD2-NH2 2.96Å
453	V	95.1	Very high	92.1	Very high	7 Å²	7	37.5 Å²	37.5	4%	0.042	19%	0.185	C	C	.	.	H	α-helix	trans	-66.6	-35.5	176.7	174.5	0	0	0	0	112.1	L403 F407 L441 V444 E449 L450 Y456 F457 P605	L403-V453 HydrophobicContact CD2-CG1 4.24Å; F407-V453 HydrophobicContact CZ-CG1 3.87Å; L441-V453 HydrophobicContact CB-CG1 4.47Å; L441-V453 HydrophobicContact CD1-CG1 4.09Å; V444-V453 HydrophobicContact CG2-CB 4.42Å; V444-V453 HydrophobicContact CG2-CG2 3.78Å; E449-V453 WeakPolarHBondContact O-CG2 3.4Å; E449-V453 PolarHBondContact O-N 2.79Å; L450-V453 PolarHBondContact O-N 3.3Å; V453-Y456 WeakPolarHBondContact O-CB 3.23Å; V453-Y456 PolarHBondContact O-N 2.94Å; V453-F457 PolarHBondContact O-N 3.12Å; V453-P605 HydrophobicContact CG2-CB 4.08Å; V453-P605 HydrophobicContact CG2-CG 4.03Å
454	H	94.4	Very high	91.9	Very high	78 Å²	78	32.4 Å²	32.4	36%	0.361	16%	0.158	S	C	.	.	H	α-helix	trans	-67.2	-41.8	173.2	-177.5	-143.1	0	0	0	112	L403 L450 K451 Y456 F457 L458	L403-H454 HydrophobicContact CD2-CB 4.11Å; L450-H454 WeakPolarHBondContact O-CB 3.39Å; L450-H454 PolarHBondContact O-N 3.21Å; K451-H454 PolarHBondContact O-N 2.86Å; H454-Y456 VanDerWaalsContact C-N 3.31Å; H454-Y456 PolarHBondContact O-N 2.92Å; H454-F457 WeakPolarHBondContact O-CB 3.32Å; H454-F457 PolarHBondContact O-N 3.39Å; H454-L458 WeakPolarHBondContact O-CG 3.26Å; H454-L458 PolarHBondContact O-N 3.08Å
455	M	92.9	Very high	91.6	Very high	46 Å²	46	33.3 Å²	33.3	23%	0.227	16%	0.162	C	C	.	.	H	α-helix	trans	-63.5	-36.6	174.6	-74.4	-177.7	88.2	0	0	112.2	K451 D452 L458 L459	K451-M455 HydrophobicContact CG-SD 4.36Å; K451-M455 WeakPolarHBondContact O-CB 3.14Å; K451-M455 VanDerWaalsContact O-CG 3.31Å; K451-M455 WeakPolarHBondContact O-CG 3.16Å; K451-M455 PolarHBondContact O-N 3.32Å; D452-M455 PolarHBondContact O-N 3.36Å; M455-L458 PolarHBondContact O-N 3.13Å; M455-L459 PolarHBondContact O-N 3.32Å
456	Y	93.3	Very high	91.3	Very high	17 Å²	17	34 Å²	34	7%	0.067	17%	0.171	C	C	.	.	H	α-helix	trans	-64.4	-42.9	172.1	-175.6	-113.2	0	0	0	112.4	R431 R440 D452 V453 H454 L459 N460 Q603 E604 P605	R431-Y456 PolarHBondContact NH2-OH 2.85Å; R440-Y456 PolarHBondContact NH1-OH 2.81Å; D452-Y456 WeakPolarHBondContact O-CB 3.28Å; D452-Y456 PolarHBondContact O-N 3Å; V453-Y456 WeakPolarHBondContact O-CB 3.23Å; V453-Y456 PolarHBondContact O-N 2.94Å; H454-Y456 VanDerWaalsContact C-N 3.31Å; H454-Y456 PolarHBondContact O-N 2.92Å; Y456-L459 PolarHBondContact O-N 3.27Å; Y456-N460 PolarHBondContact O-N 3.41Å; Y456-N460 PolarHBondContact O-ND2 2.8Å; Y456-Q603 WeakPolarHBondContact CD2-O 3.3Å; Y456-E604 VanDerWaalsContact CE2-OE2 3.22Å; Y456-E604 WeakPolarHBondContact CE2-OE2 3.4Å; Y456-E604 PolarHBondContact OH-OE2 2.88Å; Y456-P605 HydrophobicContact CD1-CG 4.32Å; Y456-P605 HydrophobicContact CD2-CG 4.3Å; Y456-P605 HydrophobicContact CG-CG 3.91Å
457	F	92.9	Very high	91	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-61.1	-46.9	173.1	178.2	-92.4	0	0	0	111.3	L406 F407 M410 I433 V453 H454 L459 N460 Y461 L465	L406-F457 HydrophobicContact CD1-CZ 4.35Å; L406-F457 HydrophobicContact CD2-CD1 4.18Å; L406-F457 HydrophobicContact CD2-CE1 3.58Å; L406-F457 HydrophobicContact CD2-CZ 4Å; L406-F457 HydrophobicContact CG-CE1 3.84Å; L406-F457 HydrophobicContact CG-CE2 4.47Å; L406-F457 HydrophobicContact CG-CZ 3.7Å; F407-F457 AromaticContact CD2-CD2 3.45Å; F407-F457 HydrophobicContact CD2-CD2 3.45Å; F407-F457 VanDerWaalsContact CD2-CD2 3.45Å; F407-F457 AromaticContact CD2-CE2 3.8Å; F407-F457 HydrophobicContact CD2-CE2 3.8Å; F407-F457 HydrophobicContact CD2-CG 4.18Å; F407-F457 HydrophobicContact CE2-CB 3.67Å; F407-F457 AromaticContact CE2-CD2 3.25Å; F407-F457 HydrophobicContact CE2-CD2 3.25Å; F407-F457 HydrophobicContact CE2-CE2 4.08Å; F407-F457 AromaticContact CE2-CG 3.63Å; F407-F457 HydrophobicContact CE2-CG 3.63Å; F407-F457 HydrophobicContact CG-CD2 4.2Å; F407-F457 HydrophobicContact CG-CE2 4.41Å; F407-F457 HydrophobicContact CZ-CB 3.94Å; F407-F457 AromaticContact CZ-CD2 3.86Å; F407-F457 HydrophobicContact CZ-CD2 3.86Å; F407-F457 HydrophobicContact CZ-CG 4.27Å; M410-F457 HydrophobicContact CB-CE2 4.15Å; M410-F457 HydrophobicContact CB-CZ 4.23Å; M410-F457 HydrophobicContact CE-CZ 4.5Å; M410-F457 HydrophobicContact CG-CE2 4.32Å; M410-F457 HydrophobicContact CG-CZ 4.45Å; I433-F457 HydrophobicContact CD1-CE2 4.34Å; V453-F457 PolarHBondContact O-N 3.12Å; H454-F457 WeakPolarHBondContact O-CB 3.32Å; H454-F457 PolarHBondContact O-N 3.39Å; F457-L459 VanDerWaalsContact C-N 3.34Å; F457-L459 PolarHBondContact O-N 3.07Å; F457-N460 PolarHBondContact O-N 3.14Å; F457-Y461 HydrophobicContact CB-CD2 4.39Å; F457-Y461 AromaticContact CD2-CD2 3.33Å; F457-Y461 HydrophobicContact CD2-CD2 3.33Å; F457-Y461 AromaticContact CD2-CE2 3.99Å; F457-Y461 HydrophobicContact CD2-CE2 3.99Å; F457-Y461 HydrophobicContact CD2-CG 4.09Å; F457-Y461 AromaticContact CE2-CD2 3.64Å; F457-Y461 HydrophobicContact CE2-CD2 3.64Å; F457-Y461 HydrophobicContact CE2-CE2 4.48Å; F457-Y461 AromaticContact CE2-CG 3.93Å; F457-Y461 HydrophobicContact CE2-CG 3.93Å; F457-Y461 AromaticContact CG-CD2 3.92Å; F457-Y461 HydrophobicContact CG-CD2 3.92Å; F457-Y461 HydrophobicContact CZ-CD2 4.44Å; F457-Y461 HydrophobicContact CZ-CG 4.44Å; F457-Y461 VanDerWaalsContact O-CD2 3.28Å; F457-Y461 WeakPolarHBondContact O-CD2 3.4Å; F457-Y461 PolarHBondContact O-N 2.99Å; F457-L465 HydrophobicContact CE1-CD1 4.22Å; F457-L465 HydrophobicContact CE1-CD2 4.07Å; F457-L465 HydrophobicContact CE1-CG 4.4Å; F457-L465 HydrophobicContact CZ-CD2 4.16Å
458	L	91.1	Very high	90.8	Very high	64 Å²	64	39 Å²	39	34%	0.335	19%	0.186	S	C	.	.	H	α-helix	trans	-63.9	-35	178.1	-69.4	175.4	0	0	0	112.9	H454 M455 N460 S462 L465	H454-L458 WeakPolarHBondContact O-CG 3.26Å; H454-L458 PolarHBondContact O-N 3.08Å; M455-L458 PolarHBondContact O-N 3.13Å; L458-N460 PolarHBondContact O-N 3.15Å; L458-S462 WeakPolarHBondContact O-CB 3.36Å; L458-S462 PolarHBondContact O-N 3Å; L458-S462 PolarHBondContact O-OG 3.41Å; L458-L465 HydrophobicContact CD2-CD1 4.32Å
459	L	89.3	Confident	90.6	Very high	13 Å²	13	38.7 Å²	38.7	7%	0.068	19%	0.185	C	C	.	.	H	α-helix	trans	-61.8	-44.7	176.7	-179.5	61.1	0	0	0	112.1	M455 Y456 F457 Y529 R599 Q600 Q603	M455-L459 PolarHBondContact O-N 3.32Å; Y456-L459 PolarHBondContact O-N 3.27Å; F457-L459 VanDerWaalsContact C-N 3.34Å; F457-L459 PolarHBondContact O-N 3.07Å; L459-Y529 HydrophobicContact CD1-CD1 3.44Å; L459-Y529 VanDerWaalsContact CD1-CD1 3.44Å; L459-Y529 HydrophobicContact CD1-CD2 3.97Å; L459-Y529 HydrophobicContact CD1-CE1 3.28Å; L459-Y529 HydrophobicContact CD1-CE2 3.83Å; L459-Y529 HydrophobicContact CD1-CG 3.78Å; L459-Y529 VanDerWaalsContact CD1-CZ 3.48Å; L459-Y529 HydrophobicContact CG-CE1 4.06Å; L459-R599 HydrophobicContact CD1-CG 4.29Å; L459-Q600 HydrophobicContact CD2-CB 4.5Å; L459-Q600 HydrophobicContact CD2-CG 4.11Å; L459-Q603 HydrophobicContact CD2-CB 4Å
460	N	87.9	Confident	90.2	Very high	29 Å²	29	39.9 Å²	39.9	16%	0.155	20%	0.198	C	C	.	.	H	α-helix	trans	-81.5	-59.1	-176	-68.2	-72.5	0	0	0	111.5	R431 Y456 F457 L458 H463	R431-N460 WeakPolarHBondContact CD-OD1 3.23Å; Y456-N460 PolarHBondContact O-N 3.41Å; Y456-N460 PolarHBondContact O-ND2 2.8Å; F457-N460 PolarHBondContact O-N 3.14Å; L458-N460 PolarHBondContact O-N 3.15Å; N460-H463 PolarHBondContact O-CE1 3.41Å; N460-H463 VanDerWaalsContact O-CE1 3.24Å; N460-H463 PolarHBondContact O-ND1 3.27Å
461	Y	89.7	Confident	89.7	Confident	1 Å²	1	41.1 Å²	41.1	0%	0.004	20%	0.204	C	C	.	.	H	α-helix	trans	-98.9	-6.1	-161.7	-49.8	-78	0	0	0	115.2	M410 R431 I433 F457 H463 E464 L465	M410-Y461 HydrophobicContact CG-CD1 3.92Å; M410-Y461 HydrophobicContact CG-CG 4.16Å; R431-Y461 PolarHBondContact NH1-OH 2.74Å; R431-Y461 WeakPolarHBondContact O-CE1 3.35Å; I433-Y461 HydrophobicContact CD1-CD1 4.41Å; I433-Y461 HydrophobicContact CD1-CE1 4.13Å; I433-Y461 HydrophobicContact CG1-CD1 4.13Å; I433-Y461 HydrophobicContact CG1-CE1 3.39Å; I433-Y461 HydrophobicContact CG1-CE2 4.12Å; I433-Y461 VanDerWaalsContact CG1-CZ 3.42Å; F457-Y461 HydrophobicContact CB-CD2 4.39Å; F457-Y461 AromaticContact CD2-CD2 3.33Å; F457-Y461 HydrophobicContact CD2-CD2 3.33Å; F457-Y461 AromaticContact CD2-CE2 3.99Å; F457-Y461 HydrophobicContact CD2-CE2 3.99Å; F457-Y461 HydrophobicContact CD2-CG 4.09Å; F457-Y461 AromaticContact CE2-CD2 3.64Å; F457-Y461 HydrophobicContact CE2-CD2 3.64Å; F457-Y461 HydrophobicContact CE2-CE2 4.48Å; F457-Y461 AromaticContact CE2-CG 3.93Å; F457-Y461 HydrophobicContact CE2-CG 3.93Å; F457-Y461 AromaticContact CG-CD2 3.92Å; F457-Y461 HydrophobicContact CG-CD2 3.92Å; F457-Y461 HydrophobicContact CZ-CD2 4.44Å; F457-Y461 HydrophobicContact CZ-CG 4.44Å; F457-Y461 VanDerWaalsContact O-CD2 3.28Å; F457-Y461 WeakPolarHBondContact O-CD2 3.4Å; F457-Y461 PolarHBondContact O-N 2.99Å; Y461-H463 PolarHBondContact O-N 3.14Å; Y461-E464 PolarHBondContact O-N 3.12Å; Y461-L465 PolarHBondContact O-N 3.18Å
462	S	86	Confident	89.2	Confident	23 Å²	23	37.6 Å²	37.6	16%	0.161	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-20.7	-177.3	55.4	0	0	0	0	115.3	L458	L458-S462 WeakPolarHBondContact O-CB 3.36Å; L458-S462 PolarHBondContact O-N 3Å; L458-S462 PolarHBondContact O-OG 3.41Å
463	H	84.6	Confident	88.7	Confident	55 Å²	55	43.9 Å²	43.9	26%	0.255	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.4	-18.4	179.4	76.1	-78.3	0	0	0	113.7	N460 Y461 R533	N460-H463 PolarHBondContact O-CE1 3.41Å; N460-H463 VanDerWaalsContact O-CE1 3.24Å; N460-H463 PolarHBondContact O-ND1 3.27Å; Y461-H463 PolarHBondContact O-N 3.14Å; H463-R533 VanDerWaalsContact CB-NH2 3.29Å
464	E	87.4	Confident	88.2	Confident	11 Å²	11	50.6 Å²	50.6	5%	0.051	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.8	-26.1	173.5	-60.1	-166.6	91.2	0	0	111.5	M410 F413 Q414 Y461 R467 M468	M410-E464 HydrophobicContact CE-CB 3.83Å; M410-E464 HydrophobicContact SD-CB 3.78Å; F413-E464 HydrophobicContact CE1-CB 4.14Å; Q414-E464 PolarHBondContact NE2-OE2 3.44Å; Y461-E464 PolarHBondContact O-N 3.12Å; E464-R467 CarbonylContact O-C 3.55Å; E464-R467 WeakPolarHBondContact O-CA 3.31Å; E464-R467 WeakPolarHBondContact O-CB 3.43Å; E464-R467 PolarHBondContact O-N 3.28Å; E464-M468 PolarHBondContact O-N 2.89Å
465	L	87.5	Confident	87.8	Confident	23 Å²	23	50.7 Å²	50.7	12%	0.12	24%	0.237	C	C	.	.	H	α-helix	trans	-46.7	-46.8	179.8	-77.3	177.3	0	0	0	114.5	L406 M410 F457 L458 Y461 R467 M468 Q469	L406-L465 HydrophobicContact CD1-CD2 4.04Å; M410-L465 HydrophobicContact CE-CD2 3.67Å; M410-L465 HydrophobicContact CE-CG 4.02Å; F457-L465 HydrophobicContact CE1-CD1 4.22Å; F457-L465 HydrophobicContact CE1-CD2 4.07Å; F457-L465 HydrophobicContact CE1-CG 4.4Å; F457-L465 HydrophobicContact CZ-CD2 4.16Å; L458-L465 HydrophobicContact CD2-CD1 4.32Å; Y461-L465 PolarHBondContact O-N 3.18Å; L465-R467 VanDerWaalsContact C-N 3.31Å; L465-R467 PolarHBondContact O-N 2.88Å; L465-M468 HydrophobicContact CD2-CE 3.68Å; L465-M468 HydrophobicContact CD2-SD 4.34Å; L465-M468 PolarHBondContact O-N 3.31Å; L465-Q469 WeakPolarHBondContact O-CB 3.47Å; L465-Q469 VanDerWaalsContact O-CG 3.28Å; L465-Q469 WeakPolarHBondContact O-CG 3.5Å; L465-Q469 PolarHBondContact O-N 2.96Å
466	P	86.1	Confident	87.4	Confident	63 Å²	63	51.1 Å²	51.1	41%	0.409	25%	0.247	S	C	.	.	H	α-helix	trans	-66.6	-31.8	178.5	-22	35.1	0	0	0	113.2	A470	P466-A470 VanDerWaalsContact O-CB 3.31Å; P466-A470 WeakPolarHBondContact O-CB 3.35Å; P466-A470 PolarHBondContact O-N 3.39Å
467	R	86.7	Confident	86.9	Confident	150 Å²	150	54 Å²	54	57%	0.566	26%	0.263	S	S	*	.	H	α-helix	trans	-72.9	-45.2	175.4	-63	179	66.7	-162.9	-1.1	110.7	F413 E464 L465 Q469 A470 E471	F413-R467 HydrophobicContact CE1-CB 4.3Å; F413-R467 HydrophobicContact CE2-CB 4.19Å; F413-R467 HydrophobicContact CZ-CB 3.58Å; E464-R467 CarbonylContact O-C 3.55Å; E464-R467 WeakPolarHBondContact O-CA 3.31Å; E464-R467 WeakPolarHBondContact O-CB 3.43Å; E464-R467 PolarHBondContact O-N 3.28Å; L465-R467 VanDerWaalsContact C-N 3.31Å; L465-R467 PolarHBondContact O-N 2.88Å; R467-Q469 VanDerWaalsContact C-N 3.35Å; R467-Q469 PolarHBondContact O-N 3.41Å; R467-A470 PolarHBondContact O-N 3.36Å; R467-E471 WeakPolarHBondContact O-CB 3.47Å; R467-E471 PolarHBondContact O-N 2.95Å
468	M	89.2	Confident	86.5	Confident	3 Å²	3	58.5 Å²	58.5	2%	0.015	28%	0.284	C	S	.	.	H	α-helix	trans	-57.2	-45.4	173.9	-178	-158.3	73.9	0	0	111.5	L406 K409 M410 F413 E464 L465 E471 Q472	L406-M468 HydrophobicContact CD1-CE 4.09Å; K409-M468 HydrophobicContact CB-SD 4.04Å; M410-M468 HydrophobicContact CB-SD 4.12Å; M410-M468 HydrophobicContact CE-CB 4.02Å; M410-M468 HydrophobicContact CE-CG 4.32Å; M410-M468 HydrophobicContact CE-SD 3.66Å; M410-M468 HydrophobicContact SD-SD 4.35Å; F413-M468 HydrophobicContact CB-CB 4.16Å; F413-M468 HydrophobicContact CB-CG 3.76Å; F413-M468 HydrophobicContact CD1-CB 3.99Å; F413-M468 HydrophobicContact CD1-CG 4.48Å; F413-M468 HydrophobicContact CD2-CB 4.13Å; F413-M468 HydrophobicContact CD2-CG 4.46Å; F413-M468 HydrophobicContact CE1-CB 4.49Å; F413-M468 HydrophobicContact CG-CB 3.8Å; F413-M468 HydrophobicContact CG-CG 3.97Å; E464-M468 PolarHBondContact O-N 2.89Å; L465-M468 HydrophobicContact CD2-CE 3.68Å; L465-M468 HydrophobicContact CD2-SD 4.34Å; L465-M468 PolarHBondContact O-N 3.31Å; M468-E471 PolarHBondContact O-N 3.21Å; M468-Q472 WeakPolarHBondContact O-CB 3.46Å; M468-Q472 VanDerWaalsContact O-CG 3.29Å; M468-Q472 WeakPolarHBondContact O-CG 3.46Å; M468-Q472 PolarHBondContact O-N 2.94Å
469	Q	87.1	Confident	86.1	Confident	53 Å²	53	61.7 Å²	61.7	25%	0.248	30%	0.298	C	S	.	.	H	α-helix	trans	-68.4	-38.3	177.8	-72.2	173.5	-3.4	0	0	112.4	L465 R467 R473	L465-Q469 WeakPolarHBondContact O-CB 3.47Å; L465-Q469 VanDerWaalsContact O-CG 3.28Å; L465-Q469 WeakPolarHBondContact O-CG 3.5Å; L465-Q469 PolarHBondContact O-N 2.96Å; R467-Q469 VanDerWaalsContact C-N 3.35Å; R467-Q469 PolarHBondContact O-N 3.41Å; Q469-R473 WeakPolarHBondContact O-CB 3.3Å; Q469-R473 WeakPolarHBondContact O-CG 3.46Å; Q469-R473 PolarHBondContact O-N 3.01Å
470	A	86.3	Confident	85.7	Confident	48 Å²	48	67.7 Å²	67.7	40%	0.397	32%	0.319	S	S	.	.	H	α-helix	trans	-66.5	-38.7	173.6	0	0	0	0	0	112.5	P466 R467 R474	P466-A470 VanDerWaalsContact O-CB 3.31Å; P466-A470 WeakPolarHBondContact O-CB 3.35Å; P466-A470 PolarHBondContact O-N 3.39Å; R467-A470 PolarHBondContact O-N 3.36Å; A470-R474 WeakPolarHBondContact O-CB 3.42Å; A470-R474 PolarHBondContact O-N 3.37Å
471	E	86	Confident	85.3	Confident	41 Å²	41	72.4 Å²	72.4	19%	0.192	34%	0.335	C	S	.	.	H	α-helix	trans	-63.3	-48	173.8	-174.4	60.9	-141.2	0	0	111.2	F413 R467 M468 R473 R474 K475	F413-E471 HydrophobicContact CD2-CB 3.94Å; F413-E471 HydrophobicContact CD2-CG 4.03Å; F413-E471 HydrophobicContact CE2-CB 3.99Å; F413-E471 HydrophobicContact CE2-CG 4.29Å; R467-E471 WeakPolarHBondContact O-CB 3.47Å; R467-E471 PolarHBondContact O-N 2.95Å; M468-E471 PolarHBondContact O-N 3.21Å; E471-R473 PolarHBondContact O-N 2.98Å; E471-R474 PolarHBondContact O-N 2.71Å; E471-R474 IonicContact OE1-CZ 3.08Å; E471-R474 IonicContact OE1-NH1 3.36Å; E471-R474 IonicContact OE1-NH2 3.29Å; E471-R474 PolarHBondContact OE1-NH2 3.24Å; E471-R474 IonicContact OE2-CZ 3.18Å; E471-R474 IonicContact OE2-NH1 2.68Å; E471-R474 PolarHBondContact OE2-NH1 2.89Å; E471-R474 IonicContact OE2-NH2 2.73Å; E471-R474 PolarHBondContact OE2-NH2 3.25Å; E471-K475 WeakPolarHBondContact O-CG 3.39Å; E471-K475 PolarHBondContact O-N 2.93Å; E471-K475 WeakPolarHBondContact OE1-CE 3.29Å
472	Q	85.1	Confident	85.1	Confident	63 Å²	63	75.9 Å²	75.9	29%	0.294	35%	0.351	S	S	.	.	H	α-helix	trans	-62.5	-41.7	177.2	-74.7	171.1	9.5	0	0	112.2	M468 K475 A476	M468-Q472 WeakPolarHBondContact O-CB 3.46Å; M468-Q472 VanDerWaalsContact O-CG 3.29Å; M468-Q472 WeakPolarHBondContact O-CG 3.46Å; M468-Q472 PolarHBondContact O-N 2.94Å; Q472-K475 PolarHBondContact O-N 3.19Å; Q472-A476 WeakPolarHBondContact O-CB 3.43Å; Q472-A476 PolarHBondContact O-N 2.94Å
473	R	83.2	Confident	84.9	Confident	133 Å²	133	77.1 Å²	77.1	50%	0.502	36%	0.363	S	S	.	.	H	α-helix	trans	-61.4	-44	171.7	-76.9	-174.8	-67.2	-111.5	-2.2	112	Q469 E471 K475 A476 I477	Q469-R473 WeakPolarHBondContact O-CB 3.3Å; Q469-R473 WeakPolarHBondContact O-CG 3.46Å; Q469-R473 PolarHBondContact O-N 3.01Å; E471-R473 PolarHBondContact O-N 2.98Å; R473-K475 VanDerWaalsContact C-N 3.35Å; R473-K475 PolarHBondContact O-N 3.19Å; R473-A476 PolarHBondContact O-N 2.83Å; R473-I477 WeakPolarHBondContact O-CB 3.25Å; R473-I477 WeakPolarHBondContact O-CD1 3.35Å; R473-I477 VanDerWaalsContact O-CG1 3.27Å; R473-I477 WeakPolarHBondContact O-CG1 3.3Å; R473-I477 PolarHBondContact O-N 2.98Å
474	R	85.6	Confident	84.7	Confident	148 Å²	148	79.3 Å²	79.3	56%	0.558	37%	0.371	S	S	*	.	H	α-helix	trans	-62.3	-41.2	177.6	-165.4	176	77.4	-102.5	-3	111.9	A470 E471 Q478	A470-R474 WeakPolarHBondContact O-CB 3.42Å; A470-R474 PolarHBondContact O-N 3.37Å; E471-R474 PolarHBondContact O-N 2.71Å; E471-R474 IonicContact OE1-CZ 3.08Å; E471-R474 IonicContact OE1-NH1 3.36Å; E471-R474 IonicContact OE1-NH2 3.29Å; E471-R474 PolarHBondContact OE1-NH2 3.24Å; E471-R474 IonicContact OE2-CZ 3.18Å; E471-R474 IonicContact OE2-NH1 2.68Å; E471-R474 PolarHBondContact OE2-NH1 2.89Å; E471-R474 IonicContact OE2-NH2 2.73Å; E471-R474 PolarHBondContact OE2-NH2 3.25Å; R474-Q478 WeakPolarHBondContact O-CB 3.42Å; R474-Q478 PolarHBondContact O-N 2.88Å
475	K	85.4	Confident	84.4	Confident	81 Å²	81	81.1 Å²	81.1	35%	0.352	39%	0.389	S	S	.	.	H	α-helix	trans	-64.3	-47.1	174.5	-70.3	-174.1	-177.4	-173.1	0	112	D416 E471 Q472 R473 I477 Q478 E479	D416-K475 IonicContact OD2-NZ 3.39Å; D416-K475 PolarHBondContact OD2-NZ 3.16Å; E471-K475 WeakPolarHBondContact O-CG 3.39Å; E471-K475 PolarHBondContact O-N 2.93Å; E471-K475 WeakPolarHBondContact OE1-CE 3.29Å; Q472-K475 PolarHBondContact O-N 3.19Å; R473-K475 VanDerWaalsContact C-N 3.35Å; R473-K475 PolarHBondContact O-N 3.19Å; K475-I477 PolarHBondContact O-N 3.26Å; K475-Q478 WeakPolarHBondContact O-CB 3.47Å; K475-Q478 PolarHBondContact O-N 3.07Å; K475-Q478 VanDerWaalsContact O-N 3.17Å; K475-E479 WeakPolarHBondContact O-CB 3.36Å; K475-E479 WeakPolarHBondContact O-CG 3.42Å; K475-E479 PolarHBondContact O-N 2.89Å
476	A	84.7	Confident	84	Confident	54 Å²	54	88.1 Å²	88.1	45%	0.446	41%	0.414	S	S	.	.	H	α-helix	trans	-61.8	-39.6	178.1	0	0	0	0	0	113	Q472 R473 E479 R480	Q472-A476 WeakPolarHBondContact O-CB 3.43Å; Q472-A476 PolarHBondContact O-N 2.94Å; R473-A476 PolarHBondContact O-N 2.83Å; A476-E479 PolarHBondContact O-N 2.95Å; A476-R480 WeakPolarHBondContact O-CB 3.47Å; A476-R480 PolarHBondContact O-N 2.83Å
477	I	83.4	Confident	83.5	Confident	78 Å²	78	95 Å²	95	40%	0.4	43%	0.431	S	S	.	.	H	α-helix	trans	-64.9	-44.3	173.9	-67.9	163.6	0	0	0	110.6	R473 K475 R480 R481	R473-I477 WeakPolarHBondContact O-CB 3.25Å; R473-I477 WeakPolarHBondContact O-CD1 3.35Å; R473-I477 VanDerWaalsContact O-CG1 3.27Å; R473-I477 WeakPolarHBondContact O-CG1 3.3Å; R473-I477 PolarHBondContact O-N 2.98Å; K475-I477 PolarHBondContact O-N 3.26Å; I477-R480 PolarHBondContact O-N 2.83Å; I477-R481 WeakPolarHBondContact O-CB 3.25Å; I477-R481 WeakPolarHBondContact O-CG 3.41Å; I477-R481 PolarHBondContact O-N 3.23Å
478	Q	83.4	Confident	82.9	Confident	95 Å²	95	93.6 Å²	93.6	44%	0.444	43%	0.431	S	S	.	.	H	α-helix	trans	-61.6	-43.6	175.7	178.8	62.4	24.5	0	0	111.8	R474 K475 R481 E482	R474-Q478 WeakPolarHBondContact O-CB 3.42Å; R474-Q478 PolarHBondContact O-N 2.88Å; K475-Q478 WeakPolarHBondContact O-CB 3.47Å; K475-Q478 PolarHBondContact O-N 3.07Å; K475-Q478 VanDerWaalsContact O-N 3.17Å; Q478-R481 PolarHBondContact O-N 3.24Å; Q478-E482 PolarHBondContact NE2-OE1 3.31Å; Q478-E482 WeakPolarHBondContact O-CB 3.24Å; Q478-E482 WeakPolarHBondContact O-CG 3.39Å; Q478-E482 PolarHBondContact O-N 2.9Å
479	E	84.3	Confident	82.3	Confident	131 Å²	131	95.8 Å²	95.8	61%	0.612	45%	0.45	S	S	*	.	H	α-helix	trans	-64.7	-41	176.5	-74.1	170.4	-176.5	0	0	112	K475 A476 E482 A483	K475-E479 WeakPolarHBondContact O-CB 3.36Å; K475-E479 WeakPolarHBondContact O-CG 3.42Å; K475-E479 PolarHBondContact O-N 2.89Å; A476-E479 PolarHBondContact O-N 2.95Å; E479-E482 PolarHBondContact O-N 2.94Å; E479-A483 VanDerWaalsContact O-CB 3.3Å; E479-A483 WeakPolarHBondContact O-CB 3.15Å; E479-A483 PolarHBondContact O-N 2.98Å
480	R	80.3	Confident	81.8	Confident	138 Å²	138	95.7 Å²	95.7	52%	0.521	46%	0.458	S	S	.	.	H	α-helix	trans	-63.5	-42	173.9	-168.3	-178.9	-174.4	-177.9	5.2	111.6	A476 I477 A483 K484 D512 L515	A476-R480 WeakPolarHBondContact O-CB 3.47Å; A476-R480 PolarHBondContact O-N 2.83Å; I477-R480 PolarHBondContact O-N 2.83Å; R480-A483 PolarHBondContact O-N 3.19Å; R480-K484 PolarHBondContact O-N 3.13Å; R480-D512 IonicContact CZ-OD2 2.76Å; R480-D512 IonicContact NH1-OD2 2.84Å; R480-D512 PolarHBondContact NH1-OD2 3.31Å; R480-D512 IonicContact NH2-OD2 3.86Å; R480-D512 PolarHBondContact NH2-OD2 3.46Å; R480-L515 VanDerWaalsContact NH1-CD1 3.28Å
481	R	79.9	Confident	80.8	Confident	128 Å²	128	96.9 Å²	96.9	48%	0.483	47%	0.468	S	S	.	.	H	α-helix	trans	-64.8	-44.4	174.9	-74.3	175.7	174.5	-160.2	2	111.9	I477 Q478 A483 K484 A485 D510	I477-R481 WeakPolarHBondContact O-CB 3.25Å; I477-R481 WeakPolarHBondContact O-CG 3.41Å; I477-R481 PolarHBondContact O-N 3.23Å; Q478-R481 PolarHBondContact O-N 3.24Å; R481-A483 VanDerWaalsContact C-N 3.33Å; R481-A483 PolarHBondContact O-N 2.82Å; R481-K484 PolarHBondContact O-N 2.73Å; R481-A485 WeakPolarHBondContact O-CB 3.45Å; R481-A485 PolarHBondContact O-N 3.08Å; R481-D510 IonicContact CZ-OD1 3.13Å; R481-D510 IonicContact CZ-OD2 2.71Å; R481-D510 IonicContact NE-OD1 2.71Å; R481-D510 PolarHBondContact NE-OD1 3.01Å; R481-D510 IonicContact NH2-OD1 2.71Å; R481-D510 PolarHBondContact NH2-OD1 3.09Å; R481-D510 IonicContact NH2-OD2 2.69Å; R481-D510 PolarHBondContact NH2-OD2 3.21Å
482	E	84	Confident	79.9	Confident	74 Å²	74	98.7 Å²	98.7	35%	0.346	49%	0.49	S	S	.	.	H	α-helix	trans	-64.9	-35	174.1	-78.9	-173.6	-144	0	0	112.6	Q478 E479 A485 R486	Q478-E482 PolarHBondContact NE2-OE1 3.31Å; Q478-E482 WeakPolarHBondContact O-CB 3.24Å; Q478-E482 WeakPolarHBondContact O-CG 3.39Å; Q478-E482 PolarHBondContact O-N 2.9Å; E479-E482 PolarHBondContact O-N 2.94Å; E482-A485 PolarHBondContact O-N 3.07Å; E482-R486 WeakPolarHBondContact O-CB 3.28Å; E482-R486 VanDerWaalsContact O-CG 3.22Å; E482-R486 WeakPolarHBondContact O-CG 3.4Å; E482-R486 PolarHBondContact O-N 3.46Å; E482-R486 IonicContact OE2-CZ 3.63Å; E482-R486 IonicContact OE2-NH2 3.7Å; E482-R486 PolarHBondContact OE2-NH2 2.8Å
483	A	82.2	Confident	78.8	Confident	49 Å²	49	103.9 Å²	103.9	41%	0.405	51%	0.514	S	S	.	.	H	α-helix	trans	-67.9	-41.8	173.9	0	0	0	0	0	112	E479 R480 R481 R486 R487	E479-A483 VanDerWaalsContact O-CB 3.3Å; E479-A483 WeakPolarHBondContact O-CB 3.15Å; E479-A483 PolarHBondContact O-N 2.98Å; R480-A483 PolarHBondContact O-N 3.19Å; R481-A483 VanDerWaalsContact C-N 3.33Å; R481-A483 PolarHBondContact O-N 2.82Å; A483-R486 PolarHBondContact O-N 2.75Å; A483-R487 WeakPolarHBondContact O-CG 3.41Å; A483-R487 PolarHBondContact O-N 2.8Å
484	K	80.4	Confident	77.4	Confident	101 Å²	101	104 Å²	104	44%	0.439	53%	0.525	S	S	.	.	H	α-helix	trans	-62	-44.2	172.7	-164.5	166.7	-174.1	171.1	0	110.4	R480 R481 R487 Q488 E506	R480-K484 PolarHBondContact O-N 3.13Å; R481-K484 PolarHBondContact O-N 2.73Å; K484-R487 PolarHBondContact O-N 2.54Å; K484-Q488 WeakPolarHBondContact O-CB 3.19Å; K484-Q488 WeakPolarHBondContact O-CG 3.38Å; K484-Q488 PolarHBondContact O-N 3.31Å; K484-E506 WeakPolarHBondContact CE-OE2 3.3Å; K484-E506 IonicContact NZ-OE2 3.99Å; K484-E506 PolarHBondContact NZ-OE2 3.41Å
485	A	80.9	Confident	75.4	Confident	50 Å²	50	99.8 Å²	99.8	41%	0.413	53%	0.527	S	S	.	.	H	α-helix	trans	-64.4	-40.7	176.1	0	0	0	0	0	113.6	R481 E482 Q488 A489	R481-A485 WeakPolarHBondContact O-CB 3.45Å; R481-A485 PolarHBondContact O-N 3.08Å; E482-A485 PolarHBondContact O-N 3.07Å; A485-Q488 PolarHBondContact O-N 2.72Å; A485-A489 WeakPolarHBondContact O-CB 3.24Å; A485-A489 PolarHBondContact O-N 3.19Å
486	R	79.9	Confident	73.2	Confident	170 Å²	170	103.2 Å²	103.2	64%	0.642	55%	0.549	S	S	*	.	H	α-helix	trans	-67.3	-38.1	175.4	-73	175.2	-152.6	-161.5	9.5	112	E482 A483 A489 A490	E482-R486 WeakPolarHBondContact O-CB 3.28Å; E482-R486 VanDerWaalsContact O-CG 3.22Å; E482-R486 WeakPolarHBondContact O-CG 3.4Å; E482-R486 PolarHBondContact O-N 3.46Å; E482-R486 IonicContact OE2-CZ 3.63Å; E482-R486 IonicContact OE2-NH2 3.7Å; E482-R486 PolarHBondContact OE2-NH2 2.8Å; A483-R486 PolarHBondContact O-N 2.75Å; R486-A489 PolarHBondContact O-N 2.85Å; R486-A490 WeakPolarHBondContact O-CB 3.42Å; R486-A490 PolarHBondContact O-N 3.03Å
487	R	75.7	Confident	71.1	Confident	206 Å²	206	108.5 Å²	108.5	78%	0.777	57%	0.57	S	S	*	*	H	α-helix	trans	-62.9	-44.3	171.7	-76.6	-178.9	174.4	-173.6	-1.5	111.6	A483 K484 A490 A491	A483-R487 WeakPolarHBondContact O-CG 3.41Å; A483-R487 PolarHBondContact O-N 2.8Å; K484-R487 PolarHBondContact O-N 2.54Å; R487-A490 PolarHBondContact O-N 3.39Å; R487-A491 WeakPolarHBondContact O-CB 3.42Å; R487-A491 PolarHBondContact O-N 3.35Å
488	Q	74	Confident	69.1	Low	121 Å²	121	108.9 Å²	108.9	57%	0.565	59%	0.585	S	S	*	*	H	α-helix	trans	-64.5	-40.1	175.9	-73.8	172.2	-19	0	0	112.5	K484 A485 A491 A492	K484-Q488 WeakPolarHBondContact O-CB 3.19Å; K484-Q488 WeakPolarHBondContact O-CG 3.38Å; K484-Q488 PolarHBondContact O-N 3.31Å; A485-Q488 PolarHBondContact O-N 2.72Å; Q488-A491 PolarHBondContact O-N 3.26Å; Q488-A492 WeakPolarHBondContact O-CB 3.32Å; Q488-A492 PolarHBondContact O-N 3.15Å
489	A	76.8	Confident	67	Low	50 Å²	50	109.3 Å²	109.3	41%	0.413	61%	0.605	S	S	.	*	H	α-helix	trans	-65.6	-45.2	175.6	0	0	0	0	0	112.1	A485 R486 A491 A492 E493	A485-A489 WeakPolarHBondContact O-CB 3.24Å; A485-A489 PolarHBondContact O-N 3.19Å; R486-A489 PolarHBondContact O-N 2.85Å; A489-A491 VanDerWaalsContact C-N 3.3Å; A489-A491 PolarHBondContact O-N 3Å; A489-A492 CarbonylContact O-C 3.55Å; A489-A492 WeakPolarHBondContact O-CA 3.23Å; A489-A492 PolarHBondContact O-N 2.88Å; A489-E493 PolarHBondContact O-N 2.85Å
490	A	75.7	Confident	65	Low	50 Å²	50	112.1 Å²	112.1	41%	0.413	62%	0.618	S	S	.	*	H	α-helix	trans	-62.6	-36.2	175.7	0	0	0	0	0	112.5	R486 R487 A492 N494	R486-A490 WeakPolarHBondContact O-CB 3.42Å; R486-A490 PolarHBondContact O-N 3.03Å; R487-A490 PolarHBondContact O-N 3.39Å; A490-A492 VanDerWaalsContact C-N 3.29Å; A490-A492 PolarHBondContact O-N 3.43Å; A490-N494 WeakPolarHBondContact O-CB 3.18Å; A490-N494 PolarHBondContact O-N 3.06Å
491	A	66.9	Low	63.1	Low	74 Å²	74	109 Å²	109	61%	0.612	62%	0.622	S	S	*	*	H	α-helix	trans	-70.2	-22.5	172.2	0	0	0	0	0	113.5	R487 Q488 A489	R487-A491 WeakPolarHBondContact O-CB 3.42Å; R487-A491 PolarHBondContact O-N 3.35Å; Q488-A491 PolarHBondContact O-N 3.26Å; A489-A491 VanDerWaalsContact C-N 3.3Å; A489-A491 PolarHBondContact O-N 3Å
492	A	65.6	Low	61.3	Low	79 Å²	79	110.1 Å²	110.1	65%	0.653	64%	0.636	S	S	*	*	H	α-helix	trans	-90.2	-24.5	177.5	0	0	0	0	0	113.8	Q488 A489 A490	Q488-A492 WeakPolarHBondContact O-CB 3.32Å; Q488-A492 PolarHBondContact O-N 3.15Å; A489-A492 CarbonylContact O-C 3.55Å; A489-A492 WeakPolarHBondContact O-CA 3.23Å; A489-A492 PolarHBondContact O-N 2.88Å; A490-A492 VanDerWaalsContact C-N 3.29Å; A490-A492 PolarHBondContact O-N 3.43Å
493	E	63.1	Low	59.1	Low	171 Å²	171	112.7 Å²	112.7	80%	0.799	66%	0.656	S	S	*	*	H	α-helix	trans	-81.8	-30.3	172.6	-69.8	-170.8	137	0	0	112.3	A489 G495	A489-E493 PolarHBondContact O-N 2.85Å; E493-G495 PolarHBondContact O-N 2.78Å
494	N	53.5	Low	56.9	Low	137 Å²	137	115.6 Å²	115.6	73%	0.733	67%	0.669	S	S	*	*	S	Bend	trans	-82.1	60.6	172.4	-70.8	-19.1	0	0	0	111.9	A490 D496	A490-N494 WeakPolarHBondContact O-CB 3.18Å; A490-N494 PolarHBondContact O-N 3.06Å; N494-D496 PolarHBondContact O-N 3.04Å
495	G	43.8	Very low	55	Low	58 Å²	58	115.7 Å²	115.7	60%	0.598	68%	0.68	S	S	*	*			trans	-87.2	98.2	-176.2	0	0	0	0	0	114.6	E493	E493-G495 PolarHBondContact O-N 2.78Å
496	D	39.2	Very low	53.1	Low	154 Å²	154	119.3 Å²	119.3	82%	0.824	69%	0.688	S	S	*	*	S	Bend	trans	-154.8	156.2	146.5	-97.3	-37.5	0	0	0	110.1	N494	N494-D496 PolarHBondContact O-N 3.04Å
497	D	41.4	Very low	51.3	Low	164 Å²	164	115.4 Å²	115.4	88%	0.877	69%	0.685	S	S	*	*			trans	45.8	81.6	173.3	-69.5	-29.9	0	0	0	119.9
498	A	41	Very low	49.7	Very low	87 Å²	87	114.7 Å²	114.7	72%	0.719	69%	0.69	S	S	*	*			trans	-137	57.5	169.1	0	0	0	0	0	113.6
499	A	38.7	Very low	48.3	Very low	104 Å²	104	113.5 Å²	113.5	86%	0.86	69%	0.688	S	S	*	*	S	Bend	trans	-88.6	-13.7	-175.9	0	0	0	0	0	116
500	E	41.8	Very low	46.9	Very low	189 Å²	189	116.1 Å²	116.1	88%	0.883	70%	0.695	S	S	*	*	S	Bend	trans	-117.3	7.6	-178.6	-66.5	-159.2	131.1	0	0	114.5	I502	E500-I502 PolarHBondContact O-N 3.41Å
501	A	41.6	Very low	45.4	Very low	74 Å²	74	119.7 Å²	119.7	61%	0.612	71%	0.707	S	S	*	*			trans	-69.2	95.8	173.7	0	0	0	0	0	110.5	V503	A501-V503 PolarHBondContact O-N 3.21Å
502	I	40.5	Very low	44.6	Very low	151 Å²	151	117.8 Å²	117.8	77%	0.774	69%	0.687	S	S	*	*			trans	-62.3	105.7	166.6	-63	178	0	0	0	107.3	E500 V504	E500-I502 PolarHBondContact O-N 3.41Å; I502-V504 HydrophobicContact CG2-CG2 4.23Å; I502-V504 PolarHBondContact O-N 3.25Å
503	V	37.9	Very low	43.6	Very low	127 Å²	127	118.7 Å²	118.7	77%	0.77	69%	0.686	S	S	*	*			trans	-68.5	83.6	168.5	-176.3	0	0	0	0	107.9	A501 P505	A501-V503 PolarHBondContact O-N 3.21Å; V503-P505 WeakPolarHBondContact O-CD 3.25Å
504	V	36.9	Very low	43	Very low	111 Å²	111	118.3 Å²	118.3	67%	0.673	68%	0.684	S	S	*	*			trans	-61.5	121.7	151	-178.7	0	0	0	0	105.2	I502 E506	I502-V504 HydrophobicContact CG2-CG2 4.23Å; I502-V504 PolarHBondContact O-N 3.25Å; V504-E506 PolarHBondContact O-N 2.81Å; V504-E506 VanDerWaalsContact O-N 3.09Å
505	P	40.3	Very low	42.8	Very low	103 Å²	103	116.7 Å²	116.7	67%	0.669	68%	0.675	S	S	*	*			trans	-63.6	113.9	165.5	-12.3	27.7	0	0	0	106.5	V503	V503-P505 WeakPolarHBondContact O-CD 3.25Å
506	E	40.6	Very low	43	Very low	126 Å²	126	117.6 Å²	117.6	59%	0.589	67%	0.665	S	S	*	*			trans	-54.6	130.7	150.6	-73.3	-174.7	161.2	0	0	106	K484 V504	K484-E506 WeakPolarHBondContact CE-OE2 3.3Å; K484-E506 IonicContact NZ-OE2 3.99Å; K484-E506 PolarHBondContact NZ-OE2 3.41Å; V504-E506 PolarHBondContact O-N 2.81Å; V504-E506 VanDerWaalsContact O-N 3.09Å
507	P	42.9	Very low	43.4	Very low	87 Å²	87	117.2 Å²	117.2	57%	0.565	66%	0.663	S	S	*	*			trans	-58	166.1	168.7	23.5	-29.1	0	0	0	110.2	D509	P507-D509 PolarHBondContact O-N 3Å
508	E	41.4	Very low	43.6	Very low	191 Å²	191	118.3 Å²	118.3	89%	0.893	66%	0.656	S	S	*	*			trans	-75.5	71.5	-179.6	-62.9	-172.1	141.7	0	0	110.1	D510	E508-D510 PolarHBondContact O-N 2.93Å
509	D	45.3	Very low	43.8	Very low	96 Å²	96	121.6 Å²	121.6	51%	0.513	66%	0.656	S	S	.	*			trans	-68.9	64.6	-175.7	-67.6	-36.4	0	0	0	112.9	P507 D511	P507-D509 PolarHBondContact O-N 3Å; D509-D511 VanDerWaalsContact C-N 3.28Å
510	D	45.8	Very low	44.2	Very low	106 Å²	106	124.1 Å²	124.1	57%	0.567	66%	0.655	S	S	*	*			trans	-78.4	-16.3	152.8	-87.9	-36.4	0	0	0	111.4	R481 E508 D512	R481-D510 IonicContact CZ-OD1 3.13Å; R481-D510 IonicContact CZ-OD2 2.71Å; R481-D510 IonicContact NE-OD1 2.71Å; R481-D510 PolarHBondContact NE-OD1 3.01Å; R481-D510 IonicContact NH2-OD1 2.71Å; R481-D510 PolarHBondContact NH2-OD1 3.09Å; R481-D510 IonicContact NH2-OD2 2.69Å; R481-D510 PolarHBondContact NH2-OD2 3.21Å; E508-D510 PolarHBondContact O-N 2.93Å; D510-D512 PolarHBondContact O-N 3.08Å
511	D	45.7	Very low	44.2	Very low	124 Å²	124	124.8 Å²	124.8	66%	0.663	66%	0.655	S	S	*	*			trans	-94	46	-179.2	-71.1	-53.8	0	0	0	113.4	D509 P513	D509-D511 VanDerWaalsContact C-N 3.28Å; D511-P513 WeakPolarHBondContact O-CD 3.44Å
512	D	49.1	Very low	44.6	Very low	35 Å²	35	126.8 Å²	126.8	19%	0.187	65%	0.652	C	S	.	*			trans	-63.5	111.3	174.4	-174.8	-21	0	0	0	111	R480 D510 E514 L515	R480-D512 IonicContact CZ-OD2 2.76Å; R480-D512 IonicContact NH1-OD2 2.84Å; R480-D512 PolarHBondContact NH1-OD2 3.31Å; R480-D512 IonicContact NH2-OD2 3.86Å; R480-D512 PolarHBondContact NH2-OD2 3.46Å; D510-D512 PolarHBondContact O-N 3.08Å; D512-E514 VanDerWaalsContact C-N 3.27Å; D512-E514 PolarHBondContact O-N 3.21Å; D512-E514 PolarHBondContact OD1-N 3.22Å; D512-L515 HydrophobicContact CB-CB 4.47Å; D512-L515 HydrophobicContact CB-CD1 4.26Å; D512-L515 HydrophobicContact CB-CG 4.47Å; D512-L515 PolarHBondContact O-N 3.41Å
513	P	45.6	Very low	45.1	Very low	97 Å²	97	124.2 Å²	124.2	63%	0.63	65%	0.653	S	S	*	*	H	α-helix	trans	-63.5	-30.3	-170.9	-22.9	34.9	0	0	0	113.6	D511 L515 I516	D511-P513 WeakPolarHBondContact O-CD 3.44Å; P513-L515 PolarHBondContact O-N 3.47Å; P513-I516 PolarHBondContact O-N 3.18Å; P513-I516 VanDerWaalsContact O-N 3.08Å
514	E	50.8	Low	46	Very low	163 Å²	163	123.5 Å²	123.5	76%	0.762	65%	0.653	S	S	*	*	H	α-helix	trans	-71.1	-15.4	179.8	-61.7	-171.8	166.2	0	0	112.4	D512	D512-E514 VanDerWaalsContact C-N 3.27Å; D512-E514 PolarHBondContact O-N 3.21Å; D512-E514 PolarHBondContact OD1-N 3.22Å
515	L	49.5	Very low	47.1	Very low	103 Å²	103	122.1 Å²	122.1	54%	0.539	64%	0.642	S	S	.	*	H	α-helix	trans	-90.1	-17.2	170.3	-74.4	178.3	0	0	0	113.8	R480 D512 P513	R480-L515 VanDerWaalsContact NH1-CD1 3.28Å; D512-L515 HydrophobicContact CB-CB 4.47Å; D512-L515 HydrophobicContact CB-CD1 4.26Å; D512-L515 HydrophobicContact CB-CG 4.47Å; D512-L515 PolarHBondContact O-N 3.41Å; P513-L515 PolarHBondContact O-N 3.47Å
516	I	47.6	Very low	48.3	Very low	78 Å²	78	121.6 Å²	121.6	40%	0.4	64%	0.641	S	S	.	*	H	α-helix	trans	-83.3	-32.3	-175.3	-64.6	174.5	0	0	0	111.5	P513 Y518 Q519	P513-I516 PolarHBondContact O-N 3.18Å; P513-I516 VanDerWaalsContact O-N 3.08Å; I516-Y518 PolarHBondContact O-N 3.19Å; I516-Q519 WeakPolarHBondContact O-CG 3.35Å; I516-Q519 PolarHBondContact O-N 2.95Å
517	D	47	Very low	50.2	Low	146 Å²	146	117.7 Å²	117.7	78%	0.781	63%	0.627	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.9	-12.7	-172.2	-152.5	31.1	0	0	0	114.4	Q519	D517-Q519 PolarHBondContact O-N 3.36Å
518	Y	46.6	Very low	52.3	Low	187 Å²	187	116.3 Å²	116.3	73%	0.733	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.7	16.7	170.4	-73.8	-83	0	0	0	114.2	I516 L520	I516-Y518 PolarHBondContact O-N 3.19Å; Y518-L520 PolarHBondContact O-N 3.05Å; Y518-L520 VanDerWaalsContact O-N 3.13Å
519	Q	45.2	Very low	54.5	Low	155 Å²	155	108 Å²	108	72%	0.724	58%	0.579	S	S	*	*			trans	-80.3	35.4	171.1	-76.7	-169.8	71	0	0	113.9	I516 D517 K521	I516-Q519 WeakPolarHBondContact O-CG 3.35Å; I516-Q519 PolarHBondContact O-N 2.95Å; D517-Q519 PolarHBondContact O-N 3.36Å; Q519-K521 PolarHBondContact O-N 2.85Å
520	L	45.4	Very low	56.4	Low	157 Å²	157	103.5 Å²	103.5	82%	0.822	56%	0.556	S	S	*	*			trans	-53.9	111.5	162.7	-112.1	164.6	0	0	0	109	Y518 Q522	Y518-L520 PolarHBondContact O-N 3.05Å; Y518-L520 VanDerWaalsContact O-N 3.13Å; L520-Q522 VanDerWaalsContact C-N 3.25Å; L520-Q522 PolarHBondContact O-N 3.04Å
521	K	42.4	Very low	58.4	Low	204 Å²	204	100.7 Å²	100.7	89%	0.887	54%	0.542	S	S	*	.			trans	-79.9	66.4	-157.2	-163	178.5	-169.6	173	0	111.7	Q519 A523	Q519-K521 PolarHBondContact O-N 2.85Å; K521-A523 PolarHBondContact O-N 3.33Å; K521-A523 VanDerWaalsContact O-N 3.12Å
522	Q	50	Low	60.5	Low	116 Å²	116	96.2 Å²	96.2	54%	0.542	52%	0.517	S	S	.	.			trans	-37.7	115	-170.8	-72.1	179	17.7	0	0	112.5	L520 S524	L520-Q522 VanDerWaalsContact C-N 3.25Å; L520-Q522 PolarHBondContact O-N 3.04Å; Q522-S524 PolarHBondContact O-N 3.39Å; Q522-S524 VanDerWaalsContact O-N 3.12Å
523	A	51.7	Low	62.3	Low	97 Å²	97	95.4 Å²	95.4	80%	0.802	51%	0.511	S	S	*	.			trans	-51.4	119.5	-176.6	0	0	0	0	0	110.4	K521 N525	K521-A523 PolarHBondContact O-N 3.33Å; K521-A523 VanDerWaalsContact O-N 3.12Å; A523-N525 PolarHBondContact O-N 3.12Å
524	S	55.4	Low	64.2	Low	111 Å²	111	98.3 Å²	98.3	78%	0.776	51%	0.514	S	S	*	.			trans	-65.3	106.7	-173.5	67.3	0	0	0	0	109.3	Q522 S526	Q522-S524 PolarHBondContact O-N 3.39Å; Q522-S524 VanDerWaalsContact O-N 3.12Å; S524-S526 PolarHBondContact O-N 3.04Å
525	N	60.4	Low	65.9	Low	82 Å²	82	91.9 Å²	91.9	44%	0.439	49%	0.488	S	S	.	.			trans	-58.4	97.9	-171.3	-173.5	-23.5	0	0	0	111.1	A523 S527 A530	A523-N525 PolarHBondContact O-N 3.12Å; N525-S527 VanDerWaalsContact OD1-CB 3.31Å; N525-S527 WeakPolarHBondContact OD1-CB 3.42Å; N525-S527 PolarHBondContact OD1-N 3.21Å; N525-S527 PolarHBondContact OD1-OG 3.2Å; N525-A530 WeakPolarHBondContact O-CB 3.3Å
526	S	67	Low	67.6	Low	92 Å²	92	88.9 Å²	88.9	64%	0.643	48%	0.483	S	S	*	.			trans	-103.8	19.2	-176	-171.2	0	0	0	0	111.7	S524	S524-S526 PolarHBondContact O-N 3.04Å
527	S	79.5	Confident	69.7	Low	44 Å²	44	85.2 Å²	85.2	31%	0.308	46%	0.464	S	S	.	.			trans	-55.1	147.5	174.2	60.7	0	0	0	0	110.9	N525 Y529 A530 V531	N525-S527 VanDerWaalsContact OD1-CB 3.31Å; N525-S527 WeakPolarHBondContact OD1-CB 3.42Å; N525-S527 PolarHBondContact OD1-N 3.21Å; N525-S527 PolarHBondContact OD1-OG 3.2Å; S527-Y529 PolarHBondContact O-N 2.67Å; S527-Y529 VanDerWaalsContact O-N 3.13Å; S527-A530 WeakPolarHBondContact O-CB 3.36Å; S527-A530 PolarHBondContact O-N 3.02Å; S527-A530 WeakPolarHBondContact OG-CB 3.22Å; S527-A530 PolarHBondContact OG-N 3.26Å; S527-V531 PolarHBondContact O-N 2.68Å
528	P	86.6	Confident	71.6	Confident	58 Å²	58	78.9 Å²	78.9	38%	0.377	43%	0.431	S	S	.	.	H	α-helix	trans	-55.8	-35	179.4	-25.5	34	0	0	0	112.4	A530 V531 F532 Y595	P528-A530 PolarHBondContact O-N 3.25Å; P528-V531 WeakPolarHBondContact O-CB 3.27Å; P528-V531 PolarHBondContact O-N 3.47Å; P528-F532 HydrophobicContact CB-CE2 4Å; P528-F532 HydrophobicContact CB-CZ 4.06Å; P528-F532 WeakPolarHBondContact O-CB 3.31Å; P528-F532 WeakPolarHBondContact O-CD1 3.35Å; P528-F532 WeakPolarHBondContact O-CD2 3.33Å; P528-F532 WeakPolarHBondContact O-CG 3.46Å; P528-F532 PolarHBondContact O-N 2.83Å; P528-Y595 HydrophobicContact CB-CD1 4.43Å; P528-Y595 HydrophobicContact CB-CE1 3.83Å; P528-Y595 HydrophobicContact CB-CE2 4.29Å
529	Y	88.6	Confident	73.5	Confident	16 Å²	16	70.6 Å²	70.6	6%	0.063	40%	0.402	C	S	.	.	H	α-helix	trans	-57.7	-47.6	172	-172.1	-93.3	0	0	0	112.9	L459 S527 V531 F532 R533 V596 R599 Q600	L459-Y529 HydrophobicContact CD1-CD1 3.44Å; L459-Y529 VanDerWaalsContact CD1-CD1 3.44Å; L459-Y529 HydrophobicContact CD1-CD2 3.97Å; L459-Y529 HydrophobicContact CD1-CE1 3.28Å; L459-Y529 HydrophobicContact CD1-CE2 3.83Å; L459-Y529 HydrophobicContact CD1-CG 3.78Å; L459-Y529 VanDerWaalsContact CD1-CZ 3.48Å; L459-Y529 HydrophobicContact CG-CE1 4.06Å; S527-Y529 PolarHBondContact O-N 2.67Å; S527-Y529 VanDerWaalsContact O-N 3.13Å; Y529-V531 VanDerWaalsContact C-N 3.29Å; Y529-V531 PolarHBondContact O-N 2.66Å; Y529-F532 PolarHBondContact O-N 3.42Å; Y529-R533 WeakPolarHBondContact O-CB 3.27Å; Y529-R533 PolarHBondContact O-N 2.87Å; Y529-V596 HydrophobicContact CD2-CG2 4.24Å; Y529-V596 HydrophobicContact CE2-CB 4.34Å; Y529-V596 HydrophobicContact CE2-CG1 3.91Å; Y529-V596 HydrophobicContact CE2-CG2 4.34Å; Y529-R599 HydrophobicContact CD2-CB 4.09Å; Y529-R599 HydrophobicContact CD2-CG 4.11Å; Y529-Q600 HydrophobicContact CE2-CG 3.95Å; Y529-Q600 PolarHBondContact OH-NE2 2.95Å
530	A	85.8	Confident	75.7	Confident	3 Å²	3	63.2 Å²	63.2	3%	0.025	37%	0.368	C	S	.	.	H	α-helix	trans	-66.1	-31.6	177.5	0	0	0	0	0	112.5	N525 S527 P528 K534	N525-A530 WeakPolarHBondContact O-CB 3.3Å; S527-A530 WeakPolarHBondContact O-CB 3.36Å; S527-A530 PolarHBondContact O-N 3.02Å; S527-A530 WeakPolarHBondContact OG-CB 3.22Å; S527-A530 PolarHBondContact OG-N 3.26Å; P528-A530 PolarHBondContact O-N 3.25Å; A530-K534 WeakPolarHBondContact O-CB 3.48Å; A530-K534 VanDerWaalsContact O-CG 3.24Å; A530-K534 WeakPolarHBondContact O-CG 3.45Å; A530-K534 PolarHBondContact O-N 2.72Å
531	V	86.7	Confident	77.8	Confident	46 Å²	46	56.2 Å²	56.2	28%	0.279	33%	0.333	S	S	.	.	H	α-helix	trans	-69.1	-42.4	173.1	177.3	0	0	0	0	111.5	S527 P528 Y529 A535	S527-V531 PolarHBondContact O-N 2.68Å; P528-V531 WeakPolarHBondContact O-CB 3.27Å; P528-V531 PolarHBondContact O-N 3.47Å; Y529-V531 VanDerWaalsContact C-N 3.29Å; Y529-V531 PolarHBondContact O-N 2.66Å; V531-A535 PolarHBondContact O-N 3.17Å
532	F	89.8	Confident	79.9	Confident	31 Å²	31	52.1 Å²	52.1	14%	0.136	32%	0.315	C	S	.	.	H	α-helix	trans	-74.9	-38.2	-178.3	-59.3	-16.4	0	0	0	112.4	P528 Y529 A535 G536 I537 F583 A592 Y595 V596	P528-F532 HydrophobicContact CB-CE2 4Å; P528-F532 HydrophobicContact CB-CZ 4.06Å; P528-F532 WeakPolarHBondContact O-CB 3.31Å; P528-F532 WeakPolarHBondContact O-CD1 3.35Å; P528-F532 WeakPolarHBondContact O-CD2 3.33Å; P528-F532 WeakPolarHBondContact O-CG 3.46Å; P528-F532 PolarHBondContact O-N 2.83Å; Y529-F532 PolarHBondContact O-N 3.42Å; F532-A535 CarbonylContact O-C 3.56Å; F532-A535 PolarHBondContact O-N 3.05Å; F532-G536 PolarHBondContact O-N 3.33Å; F532-I537 HydrophobicContact CB-CB 4.28Å; F532-I537 HydrophobicContact CB-CG1 4.44Å; F532-I537 PolarHBondContact O-N 2.75Å; F532-F583 HydrophobicContact CD1-CE1 4.24Å; F532-F583 AromaticContact CD1-CZ 3.7Å; F532-F583 HydrophobicContact CD1-CZ 3.7Å; F532-F583 HydrophobicContact CE1-CE1 4.12Å; F532-F583 HydrophobicContact CE1-CZ 4.05Å; F532-A592 HydrophobicContact CD1-CB 4.13Å; F532-A592 HydrophobicContact CD2-CB 3.94Å; F532-A592 HydrophobicContact CE1-CB 4.23Å; F532-A592 HydrophobicContact CE2-CB 4.06Å; F532-A592 HydrophobicContact CG-CB 3.98Å; F532-A592 HydrophobicContact CZ-CB 4.2Å; F532-Y595 AromaticContact CD2-CD1 3.83Å; F532-Y595 HydrophobicContact CD2-CD1 3.83Å; F532-Y595 HydrophobicContact CD2-CG 4.22Å; F532-Y595 AromaticContact CE2-CD1 3.75Å; F532-Y595 HydrophobicContact CE2-CD1 3.75Å; F532-Y595 HydrophobicContact CE2-CD2 4.48Å; F532-Y595 HydrophobicContact CE2-CE1 4.5Å; F532-Y595 AromaticContact CE2-CG 3.76Å; F532-Y595 HydrophobicContact CE2-CG 3.76Å; F532-V596 HydrophobicContact CB-CG2 3.74Å; F532-V596 HydrophobicContact CD2-CG2 4.16Å; F532-V596 HydrophobicContact CG-CG2 4.48Å
533	R	86.8	Confident	81.9	Confident	18 Å²	18	49.3 Å²	49.3	7%	0.068	30%	0.302	C	S	.	.	H	α-helix	trans	-59	-48.6	169.5	-174.2	-173.8	64	-124.1	-20.9	110.9	D429 H463 Y529 A535 G536	D429-R533 HydrophobicContact CB-CG 4.09Å; H463-R533 VanDerWaalsContact CB-NH2 3.29Å; Y529-R533 WeakPolarHBondContact O-CB 3.27Å; Y529-R533 PolarHBondContact O-N 2.87Å; R533-A535 PolarHBondContact O-N 3.1Å; R533-G536 PolarHBondContact O-N 2.66Å
534	K	85.2	Confident	83.9	Confident	158 Å²	158	44.7 Å²	44.7	69%	0.687	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-9.6	174.4	-77.2	176.2	176.9	175.9	0	114.3	A530	A530-K534 WeakPolarHBondContact O-CB 3.48Å; A530-K534 VanDerWaalsContact O-CG 3.24Å; A530-K534 WeakPolarHBondContact O-CG 3.45Å; A530-K534 PolarHBondContact O-N 2.72Å
535	A	86.5	Confident	85.6	Confident	27 Å²	27	39.9 Å²	39.9	22%	0.223	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.9	12.3	175.7	0	0	0	0	0	113.3	V531 F532 R533 I537 F583	V531-A535 PolarHBondContact O-N 3.17Å; F532-A535 CarbonylContact O-C 3.56Å; F532-A535 PolarHBondContact O-N 3.05Å; R533-A535 PolarHBondContact O-N 3.1Å; A535-I537 VanDerWaalsContact C-N 3.31Å; A535-I537 PolarHBondContact O-N 3.28Å; A535-F583 HydrophobicContact CB-CE2 3.62Å; A535-F583 HydrophobicContact CB-CZ 4.29Å
536	G	86.6	Confident	87.1	Confident	41 Å²	41	36.7 Å²	36.7	42%	0.423	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	79.2	2.6	174.2	0	0	0	0	0	115.9	F532 R533 C538 G539	F532-G536 PolarHBondContact O-N 3.33Å; R533-G536 PolarHBondContact O-N 2.66Å; G536-C538 PolarHBondContact O-N 3.42Å; G536-C538 VanDerWaalsContact O-N 3.16Å; G536-G539 PolarHBondContact O-N 3.06Å
537	I	90.9	Very high	88.3	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-64.7	-22.3	-174.6	-61.1	-61.1	0	0	0	112.9	F532 A535 G539 F540 A541 F583 V589 A592 A593 V596	F532-I537 HydrophobicContact CB-CB 4.28Å; F532-I537 HydrophobicContact CB-CG1 4.44Å; F532-I537 PolarHBondContact O-N 2.75Å; A535-I537 VanDerWaalsContact C-N 3.31Å; A535-I537 PolarHBondContact O-N 3.28Å; I537-G539 PolarHBondContact O-N 3.09Å; I537-F540 PolarHBondContact O-N 2.77Å; I537-F540 VanDerWaalsContact O-N 3.12Å; I537-A541 PolarHBondContact O-N 3.44Å; I537-A541 VanDerWaalsContact O-N 3.14Å; I537-F583 HydrophobicContact CD1-CD2 3.81Å; I537-F583 HydrophobicContact CD1-CE2 3.58Å; I537-F583 HydrophobicContact CD1-CZ 4.43Å; I537-F583 HydrophobicContact CG1-CD2 4.21Å; I537-F583 HydrophobicContact CG1-CE2 3.45Å; I537-F583 VanDerWaalsContact CG1-CE2 3.45Å; I537-F583 HydrophobicContact CG1-CZ 4.03Å; I537-V589 HydrophobicContact CD1-CG1 4.27Å; I537-A592 HydrophobicContact CD1-CB 4.5Å; I537-A592 HydrophobicContact CG1-CB 4.17Å; I537-A592 HydrophobicContact CG2-CB 4.09Å; I537-A593 HydrophobicContact CG2-CB 4.05Å; I537-V596 HydrophobicContact CG2-CG2 3.99Å
538	C	87.2	Confident	89	Confident	13 Å²	13	34.7 Å²	34.7	9%	0.088	20%	0.197	C	C	.	.	H	α-helix	trans	-60.6	-21.7	172	-64.7	0	0	0	0	113.5	G536	G536-C538 PolarHBondContact O-N 3.42Å; G536-C538 VanDerWaalsContact O-N 3.16Å
539	G	86.6	Confident	89.2	Confident	13 Å²	13	35.2 Å²	35.2	13%	0.134	19%	0.194	C	C	.	.	H	α-helix	trans	-65.5	-52.1	169.9	0	0	0	0	0	111.8	G536 I537 A541 K542 H543	G536-G539 PolarHBondContact O-N 3.06Å; I537-G539 PolarHBondContact O-N 3.09Å; G539-A541 PolarHBondContact O-N 2.86Å; G539-K542 WeakPolarHBondContact O-CB 3.45Å; G539-K542 PolarHBondContact O-N 3.11Å; G539-K542 VanDerWaalsContact O-N 3.14Å; G539-H543 PolarHBondContact O-CD2 3.47Å
540	F	90.3	Very high	89.5	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-58	-38.5	177.4	-175.1	-75.9	0	0	0	111.7	I537 K542 H543 F544 P571 L574 A575 Y578 V589 I590 A593 W711	I537-F540 PolarHBondContact O-N 2.77Å; I537-F540 VanDerWaalsContact O-N 3.12Å; F540-K542 PolarHBondContact O-N 3.29Å; F540-K542 VanDerWaalsContact O-N 3.15Å; F540-H543 PolarHBondContact O-N 2.81Å; F540-F544 AromaticContact CD1-CE2 3.91Å; F540-F544 HydrophobicContact CD1-CE2 3.91Å; F540-F544 AromaticContact CE1-CE2 3.7Å; F540-F544 HydrophobicContact CE1-CE2 3.7Å; F540-F544 HydrophobicContact CE1-CZ 4.37Å; F540-P571 HydrophobicContact CZ-CB 4.38Å; F540-L574 HydrophobicContact CD2-CB 4.44Å; F540-L574 HydrophobicContact CD2-CD2 3.79Å; F540-L574 HydrophobicContact CD2-CG 3.78Å; F540-L574 HydrophobicContact CE2-CB 3.87Å; F540-L574 HydrophobicContact CE2-CD2 3.69Å; F540-L574 HydrophobicContact CE2-CG 3.69Å; F540-L574 HydrophobicContact CG-CD2 4.42Å; F540-L574 HydrophobicContact CZ-CD2 4.26Å; F540-A575 HydrophobicContact CE2-CB 3.98Å; F540-Y578 HydrophobicContact CB-CD1 4.27Å; F540-Y578 HydrophobicContact CB-CD2 4Å; F540-Y578 HydrophobicContact CB-CE1 4.15Å; F540-Y578 HydrophobicContact CB-CE2 3.86Å; F540-Y578 HydrophobicContact CB-CG 4.21Å; F540-Y578 AromaticContact CD2-CD2 3.71Å; F540-Y578 HydrophobicContact CD2-CD2 3.71Å; F540-Y578 AromaticContact CD2-CE2 3.9Å; F540-Y578 HydrophobicContact CD2-CE2 3.9Å; F540-Y578 HydrophobicContact CD2-CG 4.47Å; F540-Y578 HydrophobicContact CG-CD2 4.35Å; F540-Y578 HydrophobicContact CG-CE2 4.37Å; F540-Y578 PolarHBondContact N-OH 2.79Å; F540-V589 HydrophobicContact CD2-CG1 4.44Å; F540-I590 HydrophobicContact CZ-CG1 4.45Å; F540-A593 HydrophobicContact CD1-CB 3.28Å; F540-A593 HydrophobicContact CE1-CB 3.6Å; F540-A593 HydrophobicContact CG-CB 4.13Å; F540-W711 AromaticContact CE1-CH2 3.83Å; F540-W711 HydrophobicContact CE1-CH2 3.83Å; F540-W711 HydrophobicContact CE1-CZ3 4.13Å; F540-W711 AromaticContact CZ-CH2 3.83Å; F540-W711 HydrophobicContact CZ-CH2 3.83Å; F540-W711 HydrophobicContact CZ-CZ3 4.43Å
541	A	89.6	Confident	90	Very high	11 Å²	11	37.4 Å²	37.4	9%	0.091	20%	0.204	C	C	.	.	H	α-helix	trans	-55.7	-30.8	179.1	0	0	0	0	0	113.6	I537 G539 H543 F544 V596 V597	I537-A541 PolarHBondContact O-N 3.44Å; I537-A541 VanDerWaalsContact O-N 3.14Å; G539-A541 PolarHBondContact O-N 2.86Å; A541-H543 PolarHBondContact O-N 3.44Å; A541-F544 WeakPolarHBondContact O-CD2 3.36Å; A541-F544 PolarHBondContact O-N 3.36Å; A541-V596 HydrophobicContact CB-CG1 3.76Å; A541-V597 HydrophobicContact CB-CG2 3.73Å
542	K	87.8	Confident	90.4	Very high	118 Å²	118	35.2 Å²	35.2	51%	0.513	19%	0.191	S	C	.	.	G	3₁₀ helix	trans	-63.7	-27.1	178.4	-60.1	-174.2	-175.8	-173.6	0	113.2	D428 G539 F540 F544	D428-K542 VanDerWaalsContact O-CE 3.26Å; D428-K542 WeakPolarHBondContact O-CE 3.46Å; D428-K542 PolarHBondContact O-NZ 2.85Å; D428-K542 IonicContact OD1-NZ 3.39Å; D428-K542 PolarHBondContact OD1-NZ 2.66Å; G539-K542 WeakPolarHBondContact O-CB 3.45Å; G539-K542 PolarHBondContact O-N 3.11Å; G539-K542 VanDerWaalsContact O-N 3.14Å; F540-K542 PolarHBondContact O-N 3.29Å; F540-K542 VanDerWaalsContact O-N 3.15Å; K542-F544 PolarHBondContact O-N 2.88Å
543	H	92	Very high	90.6	Very high	56 Å²	56	35.3 Å²	35.3	26%	0.259	19%	0.192	S	C	.	.	G	3₁₀ helix	trans	-77.8	-2.7	-178.2	-62.7	-97.3	0	0	0	114.1	G539 F540 A541 G545 E567 L574 W711	G539-H543 PolarHBondContact O-CD2 3.47Å; F540-H543 PolarHBondContact O-N 2.81Å; A541-H543 PolarHBondContact O-N 3.44Å; H543-G545 VanDerWaalsContact C-N 3.27Å; H543-G545 PolarHBondContact O-N 3.5Å; H543-E567 HydrophobicContact CB-CB 4.4Å; H543-E567 HydrophobicContact CB-CG 4.44Å; H543-E567 IonicContact CE1-OE2 3.16Å; H543-E567 IonicContact CG-OE2 2.69Å; H543-E567 IonicContact ND1-OE2 2.7Å; H543-E567 PolarHBondContact ND1-OE2 3.43Å; H543-L574 HydrophobicContact CB-CD2 3.61Å; H543-W711 HydrophobicContact CB-CH2 3.88Å; H543-W711 HydrophobicContact CB-CZ2 4.16Å
544	F	93.3	Very high	90.9	Very high	1 Å²	1	34.4 Å²	34.4	0%	0.004	19%	0.189	C	C	.	.	G	3₁₀ helix	trans	-67.4	-26.2	173.5	-81.8	-108.5	0	0	0	112.8	F540 A541 K542 A593 V597 Y699 W711 L714 R715 C718	F540-F544 AromaticContact CD1-CE2 3.91Å; F540-F544 HydrophobicContact CD1-CE2 3.91Å; F540-F544 AromaticContact CE1-CE2 3.7Å; F540-F544 HydrophobicContact CE1-CE2 3.7Å; F540-F544 HydrophobicContact CE1-CZ 4.37Å; A541-F544 WeakPolarHBondContact O-CD2 3.36Å; A541-F544 PolarHBondContact O-N 3.36Å; K542-F544 PolarHBondContact O-N 2.88Å; F544-A593 HydrophobicContact CE2-CB 4.25Å; F544-V597 HydrophobicContact CD1-CG1 4.27Å; F544-V597 HydrophobicContact CD1-CG2 4.29Å; F544-V597 HydrophobicContact CD2-CG2 3.65Å; F544-V597 HydrophobicContact CE1-CG2 4.39Å; F544-V597 HydrophobicContact CE2-CG2 3.75Å; F544-V597 HydrophobicContact CG-CG1 4.45Å; F544-V597 HydrophobicContact CG-CG2 3.92Å; F544-V597 HydrophobicContact CZ-CG2 4.13Å; F544-Y699 WeakPolarHBondContact CB-OH 3.22Å; F544-W711 HydrophobicContact CD1-CE3 4.49Å; F544-W711 HydrophobicContact CD1-CZ3 4.31Å; F544-W711 HydrophobicContact CD2-CH2 4.5Å; F544-W711 AromaticContact CD2-CZ3 3.73Å; F544-W711 HydrophobicContact CD2-CZ3 3.73Å; F544-W711 HydrophobicContact CE1-CZ3 4.42Å; F544-W711 AromaticContact CE2-CZ3 3.87Å; F544-W711 HydrophobicContact CE2-CZ3 3.87Å; F544-W711 HydrophobicContact CG-CE3 4.46Å; F544-W711 AromaticContact CG-CZ3 3.98Å; F544-W711 HydrophobicContact CG-CZ3 3.98Å; F544-W711 HydrophobicContact CZ-CZ3 4.22Å; F544-L714 HydrophobicContact CE1-CB 3.97Å; F544-L714 HydrophobicContact CZ-CB 4.45Å; F544-R715 HydrophobicContact CD1-CG 4.06Å; F544-R715 VanDerWaalsContact O-CZ 3.27Å; F544-R715 PolarHBondContact O-NE 2.69Å; F544-R715 PolarHBondContact O-NH2 3.21Å; F544-C718 VanDerWaalsContact CE1-SG 3.52Å
545	G	90.2	Very high	91.3	Very high	10 Å²	10	27 Å²	27	10%	0.103	16%	0.156	C	C	.	.	S	Bend	trans	100.9	-6.2	161.4	0	0	0	0	0	117.9	H543 T565	H543-G545 VanDerWaalsContact C-N 3.27Å; H543-G545 PolarHBondContact O-N 3.5Å; G545-T565 WeakPolarHBondContact CA-O 3.27Å; G545-T565 WeakPolarHBondContact O-CB 3.48Å; G545-T565 PolarHBondContact O-N 2.87Å
546	L	92.9	Very high	91.5	Very high	15 Å²	15	30.9 Å²	30.9	8%	0.079	17%	0.165	C	C	.	.	S	Bend	trans	-128.3	148.9	162.4	-68	177.2	0	0	0	109.2	Q550 N562 E563 I564 Y699	L546-Q550 HydrophobicContact CB-CB 4.29Å; L546-Q550 HydrophobicContact CD2-CB 4.14Å; L546-N562 HydrophobicContact CD2-CB 3.89Å; L546-E563 WeakPolarHBondContact CD2-O 3.4Å; L546-I564 HydrophobicContact CD1-CG1 3.72Å; L546-I564 HydrophobicContact CD2-CG1 4.24Å; L546-I564 HydrophobicContact CG-CB 4.45Å; L546-I564 HydrophobicContact CG-CG1 3.75Å; L546-Y699 HydrophobicContact CB-CE2 3.79Å; L546-Y699 HydrophobicContact CD1-CD2 3.85Å; L546-Y699 HydrophobicContact CD1-CE2 3.96Å; L546-Y699 HydrophobicContact CD1-CG 4.49Å; L546-Y699 HydrophobicContact CG-CD2 4.33Å; L546-Y699 HydrophobicContact CG-CE2 3.96Å; L546-Y699 PolarHBondContact O-OH 3.33Å; L546-Y699 VanDerWaalsContact O-OH 3.13Å
547	T	92.1	Very high	91.7	Very high	62 Å²	62	31.3 Å²	31.3	38%	0.38	16%	0.158	S	C	.	.			trans	-72.6	158.2	164.2	71.7	0	0	0	0	110.5	E549 Q550 Y551	T547-E549 PolarHBondContact O-N 3.48Å; T547-Q550 PolarHBondContact O-N 2.92Å; T547-Q550 VanDerWaalsContact O-N 3.17Å; T547-Q550 WeakPolarHBondContact OG1-CB 3.38Å; T547-Q550 VanDerWaalsContact OG1-CG 3.29Å; T547-Q550 WeakPolarHBondContact OG1-CG 3.48Å; T547-Q550 PolarHBondContact OG1-N 3.29Å; T547-Y551 PolarHBondContact O-N 3.49Å; T547-Y551 VanDerWaalsContact O-N 3.08Å
548	P	93.3	Very high	91.5	Very high	31 Å²	31	33.9 Å²	33.9	20%	0.201	17%	0.172	C	C	.	.	H	α-helix	trans	-55.4	-41.2	174.1	-25.2	34.2	0	0	0	112.4	Y551 A552 Q600 L601 E604	P548-Y551 PolarHBondContact O-N 3.2Å; P548-A552 WeakPolarHBondContact O-CB 3.17Å; P548-A552 PolarHBondContact O-N 3.02Å; P548-Q600 HydrophobicContact CG-CB 3.78Å; P548-L601 HydrophobicContact CB-CD2 4.28Å; P548-E604 HydrophobicContact CB-CB 4.1Å; P548-E604 HydrophobicContact CB-CG 4.17Å
549	E	92.1	Very high	91.6	Very high	70 Å²	70	39 Å²	39	33%	0.327	19%	0.19	S	C	.	.	H	α-helix	trans	-58.5	-49.8	173	172.5	170	-123.1	0	0	112.7	R440 T547 Y551 A552 E553	R440-E549 IonicContact CZ-OE1 3.76Å; R440-E549 IonicContact NE-OE1 3.03Å; R440-E549 PolarHBondContact NE-OE1 3.21Å; R440-E549 VanDerWaalsContact NH2-CD 3.25Å; R440-E549 IonicContact NH2-OE1 2.68Å; R440-E549 PolarHBondContact NH2-OE1 3.14Å; T547-E549 PolarHBondContact O-N 3.48Å; E549-Y551 VanDerWaalsContact C-N 3.28Å; E549-Y551 PolarHBondContact O-N 3.46Å; E549-A552 WeakPolarHBondContact O-CB 3.3Å; E549-A552 PolarHBondContact O-N 2.96Å; E549-A552 VanDerWaalsContact O-N 3.1Å; E549-E553 WeakPolarHBondContact O-CG 3.22Å; E549-E553 PolarHBondContact O-N 3.35Å
550	Q	94.6	Very high	91.7	Very high	63 Å²	63	42.1 Å²	42.1	29%	0.294	20%	0.201	S	C	.	.	H	α-helix	trans	-61.8	-35.8	179.1	-77	172.8	-30.6	0	0	112.8	L546 T547 N554 N562	L546-Q550 HydrophobicContact CB-CB 4.29Å; L546-Q550 HydrophobicContact CD2-CB 4.14Å; T547-Q550 PolarHBondContact O-N 2.92Å; T547-Q550 VanDerWaalsContact O-N 3.17Å; T547-Q550 WeakPolarHBondContact OG1-CB 3.38Å; T547-Q550 VanDerWaalsContact OG1-CG 3.29Å; T547-Q550 WeakPolarHBondContact OG1-CG 3.48Å; T547-Q550 PolarHBondContact OG1-N 3.29Å; Q550-N554 PolarHBondContact O-N 3.37Å; Q550-N554 PolarHBondContact O-OD1 3.45Å; Q550-N562 WeakPolarHBondContact CA-ND2 3.12Å; Q550-N562 HydrophobicContact CB-CB 3.87Å; Q550-N562 HydrophobicContact CG-CB 4.15Å; Q550-N562 PolarHBondContact O-ND2 2.95Å
551	Y	95.5	Very high	91.6	Very high	1 Å²	1	48.1 Å²	48.1	0%	0.004	22%	0.224	C	C	.	.	H	α-helix	trans	-71.9	-39.7	172.6	172.4	-95.2	0	0	0	112	T547 P548 E549 E553 N554 L555 L601 L607 S695 L698 Y699 V719	T547-Y551 PolarHBondContact O-N 3.49Å; T547-Y551 VanDerWaalsContact O-N 3.08Å; P548-Y551 PolarHBondContact O-N 3.2Å; E549-Y551 VanDerWaalsContact C-N 3.28Å; E549-Y551 PolarHBondContact O-N 3.46Å; Y551-E553 VanDerWaalsContact C-N 3.3Å; Y551-E553 PolarHBondContact O-N 2.98Å; Y551-N554 WeakPolarHBondContact O-CB 3.47Å; Y551-N554 PolarHBondContact O-N 3.22Å; Y551-N554 VanDerWaalsContact O-N 3.12Å; Y551-L555 HydrophobicContact CE1-CD2 4.49Å; Y551-L555 PolarHBondContact O-N 3.06Å; Y551-L601 HydrophobicContact CD1-CD2 3.52Å; Y551-L601 HydrophobicContact CE1-CD2 4.23Å; Y551-L601 HydrophobicContact CG-CD2 4.06Å; Y551-L607 HydrophobicContact CD1-CD1 3.87Å; Y551-L607 HydrophobicContact CE1-CD1 3.64Å; Y551-S695 PolarHBondContact OH-O 2.81Å; Y551-L698 HydrophobicContact CE2-CB 4.03Å; Y551-Y699 AromaticContact CD2-CD1 3.75Å; Y551-Y699 HydrophobicContact CD2-CD1 3.75Å; Y551-Y699 AromaticContact CD2-CG 3.87Å; Y551-Y699 HydrophobicContact CD2-CG 3.87Å; Y551-Y699 HydrophobicContact CE2-CD1 4.22Å; Y551-Y699 HydrophobicContact CE2-CG 4.31Å; Y551-Y699 HydrophobicContact CG-CD1 4.1Å; Y551-V719 HydrophobicContact CE1-CG2 4.31Å; Y551-V719 HydrophobicContact CE2-CG2 3.92Å; Y551-V719 VanDerWaalsContact OH-CG1 3.28Å; Y551-V719 WeakPolarHBondContact OH-CG1 3.49Å
552	A	94.5	Very high	91.7	Very high	0 Å²	0	49 Å²	49	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-63.1	-35.4	175.7	0	0	0	0	0	112.4	P548 E549 L555 R556 E604 L606 L607	P548-A552 WeakPolarHBondContact O-CB 3.17Å; P548-A552 PolarHBondContact O-N 3.02Å; E549-A552 WeakPolarHBondContact O-CB 3.3Å; E549-A552 PolarHBondContact O-N 2.96Å; E549-A552 VanDerWaalsContact O-N 3.1Å; A552-L555 PolarHBondContact O-N 3.34Å; A552-R556 WeakPolarHBondContact O-CB 3.29Å; A552-R556 PolarHBondContact O-N 3.03Å; A552-E604 HydrophobicContact CB-CG 3.78Å; A552-L606 HydrophobicContact CB-CB 3.88Å; A552-L606 HydrophobicContact CB-CD2 4.06Å; A552-L606 HydrophobicContact CB-CG 4Å; A552-L607 HydrophobicContact CB-CB 3.89Å
553	E	94.4	Very high	91.8	Very high	33 Å²	33	51.2 Å²	51.2	15%	0.154	24%	0.239	C	C	.	.	H	α-helix	trans	-63.2	-46.3	168.9	-70.8	-166	126.8	0	0	112.3	E549 Y551 L555 R556 D557 R561 N562 L606	E549-E553 WeakPolarHBondContact O-CG 3.22Å; E549-E553 PolarHBondContact O-N 3.35Å; Y551-E553 VanDerWaalsContact C-N 3.3Å; Y551-E553 PolarHBondContact O-N 2.98Å; E553-L555 PolarHBondContact O-N 3.43Å; E553-R556 PolarHBondContact O-N 2.99Å; E553-D557 VanDerWaalsContact O-CB 3.3Å; E553-D557 WeakPolarHBondContact O-CB 3.44Å; E553-D557 PolarHBondContact O-N 3.34Å; E553-R561 IonicContact OE1-CZ 2.84Å; E553-R561 IonicContact OE1-NH1 2.66Å; E553-R561 PolarHBondContact OE1-NH1 3.01Å; E553-R561 IonicContact OE2-CZ 2.63Å; E553-R561 IonicContact OE2-NH1 3.81Å; E553-R561 PolarHBondContact OE2-NH1 3.27Å; E553-N562 PolarHBondContact OE2-ND2 3.16Å; E553-L606 HydrophobicContact CG-CD2 3.97Å
554	N	94.3	Very high	91.8	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-57.8	-38.8	176.3	-71.2	-1.8	0	0	0	111.2	Q550 Y551 N558 Y559 R561 N562 L698	Q550-N554 PolarHBondContact O-N 3.37Å; Q550-N554 PolarHBondContact O-OD1 3.45Å; Y551-N554 WeakPolarHBondContact O-CB 3.47Å; Y551-N554 PolarHBondContact O-N 3.22Å; Y551-N554 VanDerWaalsContact O-N 3.12Å; N554-N558 WeakPolarHBondContact O-CA 3.12Å; N554-N558 PolarHBondContact O-N 2.89Å; N554-Y559 VanDerWaalsContact CA-O 3.29Å; N554-Y559 WeakPolarHBondContact CA-O 3.39Å; N554-Y559 PolarHBondContact O-N 2.84Å; N554-R561 PolarHBondContact OD1-N 3.29Å; N554-N562 PolarHBondContact ND2-O 3.48Å; N554-N562 VanDerWaalsContact ND2-O 3.13Å; N554-N562 PolarHBondContact OD1-N 3.22Å; N554-L698 HydrophobicContact CB-CB 4.28Å; N554-L698 PolarHBondContact ND2-O 2.74Å
555	L	92.4	Very high	91.6	Very high	1 Å²	1	54.2 Å²	54.2	1%	0.005	26%	0.261	C	S	.	.	H	α-helix	trans	-67.7	-50.6	177.8	-171.4	66.4	0	0	0	112.3	Y551 A552 E553 D557 N558 L607 T610 M611 Y691 S695 L698	Y551-L555 HydrophobicContact CE1-CD2 4.49Å; Y551-L555 PolarHBondContact O-N 3.06Å; A552-L555 PolarHBondContact O-N 3.34Å; E553-L555 PolarHBondContact O-N 3.43Å; L555-D557 VanDerWaalsContact C-N 3.32Å; L555-D557 PolarHBondContact O-N 3.25Å; L555-N558 PolarHBondContact O-N 2.86Å; L555-L607 HydrophobicContact CD2-CD1 4.35Å; L555-L607 HydrophobicContact CD2-CG 3.91Å; L555-T610 HydrophobicContact CD2-CG2 4.42Å; L555-T610 HydrophobicContact CG-CG2 4.09Å; L555-M611 HydrophobicContact CD2-CG 4.19Å; L555-M611 HydrophobicContact CD2-SD 4.11Å; L555-Y691 HydrophobicContact CD1-CE1 4.18Å; L555-S695 WeakPolarHBondContact CD1-OG 3.1Å; L555-L698 HydrophobicContact CD1-CD1 4.02Å
556	R	92	Very high	91.6	Very high	110 Å²	110	56 Å²	56	42%	0.415	27%	0.267	S	S	.	.	H	α-helix	trans	-55.2	-47.9	175.6	-179.4	-160.5	65.4	-142.7	-6.5	111.6	A552 E553 N558 T610	A552-R556 WeakPolarHBondContact O-CB 3.29Å; A552-R556 PolarHBondContact O-N 3.03Å; E553-R556 PolarHBondContact O-N 2.99Å; R556-N558 VanDerWaalsContact C-N 3.29Å; R556-N558 PolarHBondContact O-N 3.28Å; R556-T610 HydrophobicContact CB-CG2 4.44Å
557	D	90.5	Very high	91.3	Very high	50 Å²	50	57 Å²	57	27%	0.267	27%	0.271	S	S	.	.	H	α-helix	trans	-76.7	-18.1	-176.6	-84.6	29.6	0	0	0	112.7	E553 L555 Y559	E553-D557 VanDerWaalsContact O-CB 3.3Å; E553-D557 WeakPolarHBondContact O-CB 3.44Å; E553-D557 PolarHBondContact O-N 3.34Å; L555-D557 VanDerWaalsContact C-N 3.32Å; L555-D557 PolarHBondContact O-N 3.25Å; D557-Y559 HydrophobicContact CB-CD1 3.71Å; D557-Y559 HydrophobicContact CB-CE1 3.42Å; D557-Y559 VanDerWaalsContact CB-CE1 3.42Å; D557-Y559 WeakPolarHBondContact O-CD1 3.4Å; D557-Y559 PolarHBondContact O-N 3.35Å; D557-Y559 VanDerWaalsContact OD2-CE1 3.25Å; D557-Y559 WeakPolarHBondContact OD2-CE1 3.09Å; D557-Y559 VanDerWaalsContact OD2-CZ 3.24Å; D557-Y559 PolarHBondContact OD2-OH 2.97Å
558	N	87	Confident	91.1	Very high	54 Å²	54	58.4 Å²	58.4	29%	0.289	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	52	36.4	-171.6	-163.1	97.7	0	0	0	112.9	N554 L555 R556 N681	N554-N558 WeakPolarHBondContact O-CA 3.12Å; N554-N558 PolarHBondContact O-N 2.89Å; L555-N558 PolarHBondContact O-N 2.86Å; R556-N558 VanDerWaalsContact C-N 3.29Å; R556-N558 PolarHBondContact O-N 3.28Å; N558-N681 PolarHBondContact OD1-ND2 3.29Å
559	Y	88.2	Confident	91	Very high	121 Å²	121	59.6 Å²	59.6	48%	0.475	29%	0.287	S	S	.	.	S	Bend	trans	-150.6	158.2	164.2	70.6	-89.2	0	0	0	109.2	N554 D557 R561	N554-Y559 VanDerWaalsContact CA-O 3.29Å; N554-Y559 WeakPolarHBondContact CA-O 3.39Å; N554-Y559 PolarHBondContact O-N 2.84Å; D557-Y559 HydrophobicContact CB-CD1 3.71Å; D557-Y559 HydrophobicContact CB-CE1 3.42Å; D557-Y559 VanDerWaalsContact CB-CE1 3.42Å; D557-Y559 WeakPolarHBondContact O-CD1 3.4Å; D557-Y559 PolarHBondContact O-N 3.35Å; D557-Y559 VanDerWaalsContact OD2-CE1 3.25Å; D557-Y559 WeakPolarHBondContact OD2-CE1 3.09Å; D557-Y559 VanDerWaalsContact OD2-CZ 3.24Å; D557-Y559 PolarHBondContact OD2-OH 2.97Å; Y559-R561 HydrophobicContact CD2-CB 4.32Å; Y559-R561 HydrophobicContact CE2-CB 3.63Å; Y559-R561 HydrophobicContact CE2-CG 4.18Å; Y559-R561 PolarHBondContact O-N 2.97Å
560	Q	88.1	Confident	91	Very high	77 Å²	77	56.6 Å²	56.6	36%	0.36	28%	0.275	S	S	.	.			trans	-72.2	93.1	173.7	-65.9	-174.3	1.6	0	0	109.6	A697 L698 Q700	Q560-A697 PolarHBondContact NE2-O 3.06Å; Q560-L698 HydrophobicContact CG-CD2 4.3Å; Q560-Q700 PolarHBondContact NE2-O 3.01Å
561	R	89.4	Confident	90.8	Very high	126 Å²	126	53.8 Å²	53.8	48%	0.475	26%	0.262	S	S	.	.			trans	-75.7	-40.9	172.2	-177.3	-174.5	-173.2	-116.5	13.6	111	E553 N554 Y559	E553-R561 IonicContact OE1-CZ 2.84Å; E553-R561 IonicContact OE1-NH1 2.66Å; E553-R561 PolarHBondContact OE1-NH1 3.01Å; E553-R561 IonicContact OE2-CZ 2.63Å; E553-R561 IonicContact OE2-NH1 3.81Å; E553-R561 PolarHBondContact OE2-NH1 3.27Å; N554-R561 PolarHBondContact OD1-N 3.29Å; Y559-R561 HydrophobicContact CD2-CB 4.32Å; Y559-R561 HydrophobicContact CE2-CB 3.63Å; Y559-R561 HydrophobicContact CE2-CG 4.18Å; Y559-R561 PolarHBondContact O-N 2.97Å
562	N	91.6	Very high	90.7	Very high	30 Å²	30	56.6 Å²	56.6	16%	0.16	28%	0.28	C	S	.	.	S	Bend	trans	-103.4	118.7	177.6	-60.6	-65.7	0	0	0	109.1	L546 Q550 E553 N554	L546-N562 HydrophobicContact CD2-CB 3.89Å; Q550-N562 WeakPolarHBondContact CA-ND2 3.12Å; Q550-N562 HydrophobicContact CB-CB 3.87Å; Q550-N562 HydrophobicContact CG-CB 4.15Å; Q550-N562 PolarHBondContact O-ND2 2.95Å; E553-N562 PolarHBondContact OE2-ND2 3.16Å; N554-N562 PolarHBondContact ND2-O 3.48Å; N554-N562 VanDerWaalsContact ND2-O 3.13Å; N554-N562 PolarHBondContact OD1-N 3.22Å
563	E	89.3	Confident	90.6	Very high	165 Å²	165	62.1 Å²	62.1	77%	0.771	31%	0.306	S	S	*	.	P	Polyproline II helix	trans	-76.2	146.7	172.9	-66.9	-175.1	-175.1	0	0	111.1	L546	L546-E563 WeakPolarHBondContact CD2-O 3.4Å
564	I	91.5	Very high	90.5	Very high	11 Å²	11	60.8 Å²	60.8	6%	0.056	30%	0.299	C	S	.	.	P	Polyproline II helix	trans	-79.1	123.5	-173.4	-65.5	153.4	0	0	0	111	L546 Q566 Y699 L701 R715	L546-I564 HydrophobicContact CD1-CG1 3.72Å; L546-I564 HydrophobicContact CD2-CG1 4.24Å; L546-I564 HydrophobicContact CG-CB 4.45Å; L546-I564 HydrophobicContact CG-CG1 3.75Å; I564-Q566 PolarHBondContact O-N 2.88Å; I564-Q566 VanDerWaalsContact O-N 3.11Å; I564-Y699 HydrophobicContact CD1-CD2 4.24Å; I564-Y699 HydrophobicContact CG1-CD2 4.3Å; I564-L701 HydrophobicContact CB-CB 4.34Å; I564-L701 HydrophobicContact CD1-CB 4Å; I564-R715 VanDerWaalsContact CG2-CZ 3.43Å; I564-R715 VanDerWaalsContact CG2-NH2 3.33Å
565	T	90.7	Very high	90.4	Very high	108 Å²	108	60.8 Å²	60.8	66%	0.663	30%	0.299	S	S	*	.			trans	-71.9	102.9	172	-58.3	0	0	0	0	109.6	G545	G545-T565 WeakPolarHBondContact CA-O 3.27Å; G545-T565 WeakPolarHBondContact O-CB 3.48Å; G545-T565 PolarHBondContact O-N 2.87Å
566	Q	88.7	Confident	90.4	Very high	48 Å²	48	66.2 Å²	66.2	22%	0.224	32%	0.323	C	S	.	.			trans	-86.9	123.1	-170.8	-178.2	53.1	54.1	0	0	113.2	I564 L701 V708 R715	I564-Q566 PolarHBondContact O-N 2.88Å; I564-Q566 VanDerWaalsContact O-N 3.11Å; Q566-L701 HydrophobicContact CB-CD2 3.68Å; Q566-L701 HydrophobicContact CG-CD2 3.99Å; Q566-V708 HydrophobicContact CG-CG2 3.79Å; Q566-R715 VanDerWaalsContact OE1-CZ 3.31Å
567	E	87.5	Confident	90.4	Very high	36 Å²	36	67.2 Å²	67.2	17%	0.168	33%	0.332	C	S	.	.			trans	-67.6	138.5	170.1	-179.2	50.3	-106	0	0	111.8	H543 I569 W711	H543-E567 HydrophobicContact CB-CB 4.4Å; H543-E567 HydrophobicContact CB-CG 4.44Å; H543-E567 IonicContact CE1-OE2 3.16Å; H543-E567 IonicContact CG-OE2 2.69Å; H543-E567 IonicContact ND1-OE2 2.7Å; H543-E567 PolarHBondContact ND1-OE2 3.43Å; E567-I569 HydrophobicContact CG-CB 4.22Å; E567-I569 PolarHBondContact OE1-N 3.18Å; E567-I569 VanDerWaalsContact OE1-N 3.1Å; E567-W711 HydrophobicContact CB-CZ2 4.18Å; E567-W711 HydrophobicContact CG-CZ2 4.19Å
568	S	88.1	Confident	90.3	Very high	91 Å²	91	67.4 Å²	67.4	64%	0.636	33%	0.33	S	S	*	.	S	Bend	trans	-74.8	-28.3	178.2	65.3	0	0	0	0	114.2
569	I	90.8	Very high	90.5	Very high	56 Å²	56	68.6 Å²	68.6	29%	0.287	34%	0.336	S	S	.	.	S	Bend	trans	-90.3	140.7	-179.5	-56.9	176.9	0	0	0	109.9	E567 E573 L574 W711	E567-I569 HydrophobicContact CG-CB 4.22Å; E567-I569 PolarHBondContact OE1-N 3.18Å; E567-I569 VanDerWaalsContact OE1-N 3.1Å; I569-E573 HydrophobicContact CG2-CB 3.63Å; I569-L574 HydrophobicContact CG2-CB 4.14Å; I569-W711 PolarHBondContact O-NE1 3.38Å
570	G	91	Very high	90.3	Very high	7 Å²	7	64.3 Å²	64.3	7%	0.072	32%	0.324	C	S	.	.			trans	-67.6	145.6	173.2	0	0	0	0	0	111.7	T572 E573 L574	G570-T572 VanDerWaalsContact C-N 3.3Å; G570-T572 PolarHBondContact O-N 3.36Å; G570-E573 WeakPolarHBondContact O-CA 3.46Å; G570-E573 WeakPolarHBondContact O-CB 3.31Å; G570-E573 PolarHBondContact O-N 2.87Å; G570-L574 PolarHBondContact O-N 2.96Å
571	P	92.5	Very high	90.1	Very high	4 Å²	4	67 Å²	67	3%	0.026	35%	0.347	C	S	.	.	H	α-helix	trans	-60.2	-37.1	-170.7	22.1	-32.2	0	0	0	113.2	F540 E573 L574 A575 E710 W711 L714	F540-P571 HydrophobicContact CZ-CB 4.38Å; P571-E573 VanDerWaalsContact C-N 3.25Å; P571-E573 PolarHBondContact O-N 3.2Å; P571-L574 PolarHBondContact O-N 2.93Å; P571-A575 VanDerWaalsContact O-CB 3.28Å; P571-A575 WeakPolarHBondContact O-CB 3.3Å; P571-A575 PolarHBondContact O-N 2.77Å; P571-E710 HydrophobicContact CG-CB 3.82Å; P571-W711 HydrophobicContact CB-CD2 4.15Å; P571-W711 HydrophobicContact CB-CE3 4.34Å; P571-W711 HydrophobicContact CB-CH2 4.16Å; P571-W711 HydrophobicContact CB-CZ2 3.94Å; P571-W711 HydrophobicContact CB-CZ3 4.35Å; P571-W711 HydrophobicContact CG-CD2 4.39Å; P571-L714 HydrophobicContact CB-CD1 3.41Å; P571-L714 VanDerWaalsContact CB-CD1 3.41Å; P571-L714 HydrophobicContact CG-CD1 3.63Å
572	T	92.9	Very high	89.8	Confident	60 Å²	60	68 Å²	68	37%	0.368	35%	0.351	S	S	.	.	H	α-helix	trans	-69.6	-18.3	175.1	-40.7	0	0	0	0	113.6	G570 K576 T586	G570-T572 VanDerWaalsContact C-N 3.3Å; G570-T572 PolarHBondContact O-N 3.36Å; T572-K576 VanDerWaalsContact O-CE 3.26Å; T572-K576 WeakPolarHBondContact O-CE 3.03Å; T572-T586 HydrophobicContact CG2-CG2 4.45Å
573	E	92	Very high	89.5	Confident	117 Å²	117	67.4 Å²	67.4	55%	0.547	35%	0.347	S	S	.	.	H	α-helix	trans	-87.9	-38.6	173.3	-64.3	-171.7	145.6	0	0	111.6	I569 G570 P571 A575	I569-E573 HydrophobicContact CG2-CB 3.63Å; G570-E573 WeakPolarHBondContact O-CA 3.46Å; G570-E573 WeakPolarHBondContact O-CB 3.31Å; G570-E573 PolarHBondContact O-N 2.87Å; P571-E573 VanDerWaalsContact C-N 3.25Å; P571-E573 PolarHBondContact O-N 3.2Å; E573-A575 VanDerWaalsContact C-N 3.33Å
574	L	91.7	Very high	89.5	Confident	4 Å²	4	66.2 Å²	66.2	2%	0.021	34%	0.343	C	S	.	.	H	α-helix	trans	-63.5	-39.1	170.8	-175.2	66.6	0	0	0	111.4	F540 H543 I569 G570 P571 K576 Q577 Y578 W711	F540-L574 HydrophobicContact CD2-CB 4.44Å; F540-L574 HydrophobicContact CD2-CD2 3.79Å; F540-L574 HydrophobicContact CD2-CG 3.78Å; F540-L574 HydrophobicContact CE2-CB 3.87Å; F540-L574 HydrophobicContact CE2-CD2 3.69Å; F540-L574 HydrophobicContact CE2-CG 3.69Å; F540-L574 HydrophobicContact CG-CD2 4.42Å; F540-L574 HydrophobicContact CZ-CD2 4.26Å; H543-L574 HydrophobicContact CB-CD2 3.61Å; I569-L574 HydrophobicContact CG2-CB 4.14Å; G570-L574 PolarHBondContact O-N 2.96Å; P571-L574 PolarHBondContact O-N 2.93Å; L574-K576 PolarHBondContact O-N 3.25Å; L574-K576 VanDerWaalsContact O-N 3.12Å; L574-Q577 VanDerWaalsContact O-CB 3.31Å; L574-Q577 WeakPolarHBondContact O-CB 3.35Å; L574-Q577 WeakPolarHBondContact O-CG 3.47Å; L574-Q577 PolarHBondContact O-N 2.9Å; L574-Y578 HydrophobicContact CD1-CE2 4.37Å; L574-Y578 HydrophobicContact CG-CE2 4.37Å; L574-W711 HydrophobicContact CD2-CH2 3.92Å; L574-W711 HydrophobicContact CD2-CZ2 3.8Å
575	A	92.6	Very high	89.5	Confident	0 Å²	0	68.7 Å²	68.7	0%	0	36%	0.359	C	S	.	.	G	3₁₀ helix	trans	-60.1	-28.1	-177	0	0	0	0	0	113.2	F540 P571 E573 Q577 Y578 T586 V589 I590	F540-A575 HydrophobicContact CE2-CB 3.98Å; P571-A575 VanDerWaalsContact O-CB 3.28Å; P571-A575 WeakPolarHBondContact O-CB 3.3Å; P571-A575 PolarHBondContact O-N 2.77Å; E573-A575 VanDerWaalsContact C-N 3.33Å; A575-Q577 PolarHBondContact O-N 3.12Å; A575-Q577 VanDerWaalsContact O-N 3.16Å; A575-Y578 PolarHBondContact O-N 2.94Å; A575-Y578 VanDerWaalsContact O-N 3.08Å; A575-T586 HydrophobicContact CB-CG2 4.2Å; A575-V589 HydrophobicContact CB-CB 4.2Å; A575-V589 HydrophobicContact CB-CG1 3.86Å; A575-I590 HydrophobicContact CB-CD1 4.19Å; A575-I590 HydrophobicContact CB-CG1 3.92Å
576	K	92.2	Very high	89.6	Confident	116 Å²	116	64.9 Å²	64.9	50%	0.504	34%	0.335	S	S	.	.	G	3₁₀ helix	trans	-61.9	-21.3	176.1	-64.2	165.7	-172	164.4	0	113	T572 L574 Y578 L579 T586	T572-K576 VanDerWaalsContact O-CE 3.26Å; T572-K576 WeakPolarHBondContact O-CE 3.03Å; L574-K576 PolarHBondContact O-N 3.25Å; L574-K576 VanDerWaalsContact O-N 3.12Å; K576-Y578 VanDerWaalsContact C-N 3.35Å; K576-L579 HydrophobicContact CB-CD1 4.46Å; K576-T586 HydrophobicContact CG-CG2 3.65Å
577	Q	91.1	Very high	89.8	Confident	130 Å²	130	67.4 Å²	67.4	61%	0.607	35%	0.351	S	S	*	.	G	3₁₀ helix	trans	-80.2	-16.6	178.4	-53.5	-177.6	33.6	0	0	112.8	L574 A575	L574-Q577 VanDerWaalsContact O-CB 3.31Å; L574-Q577 WeakPolarHBondContact O-CB 3.35Å; L574-Q577 WeakPolarHBondContact O-CG 3.47Å; L574-Q577 PolarHBondContact O-N 2.9Å; A575-Q577 PolarHBondContact O-N 3.12Å; A575-Q577 VanDerWaalsContact O-N 3.16Å
578	Y	90.2	Very high	90	Very high	55 Å²	55	69 Å²	69	22%	0.216	36%	0.358	C	S	.	.	S	Bend	trans	-112.8	11.8	-177	-63.6	-95.1	0	0	0	113.1	F540 L574 A575 K576	F540-Y578 HydrophobicContact CB-CD1 4.27Å; F540-Y578 HydrophobicContact CB-CD2 4Å; F540-Y578 HydrophobicContact CB-CE1 4.15Å; F540-Y578 HydrophobicContact CB-CE2 3.86Å; F540-Y578 HydrophobicContact CB-CG 4.21Å; F540-Y578 AromaticContact CD2-CD2 3.71Å; F540-Y578 HydrophobicContact CD2-CD2 3.71Å; F540-Y578 AromaticContact CD2-CE2 3.9Å; F540-Y578 HydrophobicContact CD2-CE2 3.9Å; F540-Y578 HydrophobicContact CD2-CG 4.47Å; F540-Y578 HydrophobicContact CG-CD2 4.35Å; F540-Y578 HydrophobicContact CG-CE2 4.37Å; F540-Y578 PolarHBondContact N-OH 2.79Å; L574-Y578 HydrophobicContact CD1-CE2 4.37Å; L574-Y578 HydrophobicContact CG-CE2 4.37Å; A575-Y578 PolarHBondContact O-N 2.94Å; A575-Y578 VanDerWaalsContact O-N 3.08Å; K576-Y578 VanDerWaalsContact C-N 3.35Å
579	L	90.2	Very high	90.3	Very high	78 Å²	78	64.7 Å²	64.7	41%	0.408	33%	0.328	S	S	.	.			trans	-61.8	136.6	170.3	-66.8	171.9	0	0	0	110	K576 T585 V589	K576-L579 HydrophobicContact CB-CD1 4.46Å; L579-T585 VanDerWaalsContact CD2-C 3.4Å; L579-T585 WeakPolarHBondContact CD2-O 3.23Å; L579-V589 HydrophobicContact CD2-CG2 4.08Å
580	S	84.4	Confident	90.4	Very high	32 Å²	32	63 Å²	63	22%	0.224	32%	0.319	C	S	.	.	B	Isolated β-bridge	trans	-150.1	170.6	-174.6	74.8	0	0	0	0	111	R582 F583 M584	S580-R582 PolarHBondContact O-N 2.84Å; S580-R582 PolarHBondContact OG-N 3.26Å; S580-F583 PolarHBondContact N-O 2.83Å; S580-F583 CarbonylContact O-C 3.55Å; S580-F583 VanDerWaalsContact O-C 3.24Å; S580-F583 PolarHBondContact O-N 3.36Å; S580-F583 PolarHBondContact OG-N 3.02Å; S580-M584 WeakPolarHBondContact O-CE 3.47Å
581	P	84.6	Confident	90.5	Very high	132 Å²	132	68.2 Å²	68.2	86%	0.857	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-7.3	171.3	-24.7	35.7	0	0	0	115.2
582	R	81.8	Confident	90.5	Very high	149 Å²	149	68.1 Å²	68.1	56%	0.562	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.7	-16.3	171.6	-75.6	-177.2	167.6	-176.3	-4.5	114.5	S580	S580-R582 PolarHBondContact O-N 2.84Å; S580-R582 PolarHBondContact OG-N 3.26Å
583	F	86.7	Confident	90.6	Very high	17 Å²	17	65.2 Å²	65.2	8%	0.075	32%	0.323	C	S	.	.	B	Isolated β-bridge	trans	-134.8	93.8	-178.5	-56	-55.5	0	0	0	108.5	F532 A535 I537 S580 E588 V589 A592	F532-F583 HydrophobicContact CD1-CE1 4.24Å; F532-F583 AromaticContact CD1-CZ 3.7Å; F532-F583 HydrophobicContact CD1-CZ 3.7Å; F532-F583 HydrophobicContact CE1-CE1 4.12Å; F532-F583 HydrophobicContact CE1-CZ 4.05Å; A535-F583 HydrophobicContact CB-CE2 3.62Å; A535-F583 HydrophobicContact CB-CZ 4.29Å; I537-F583 HydrophobicContact CD1-CD2 3.81Å; I537-F583 HydrophobicContact CD1-CE2 3.58Å; I537-F583 HydrophobicContact CD1-CZ 4.43Å; I537-F583 HydrophobicContact CG1-CD2 4.21Å; I537-F583 HydrophobicContact CG1-CE2 3.45Å; I537-F583 VanDerWaalsContact CG1-CE2 3.45Å; I537-F583 HydrophobicContact CG1-CZ 4.03Å; S580-F583 PolarHBondContact N-O 2.83Å; S580-F583 CarbonylContact O-C 3.55Å; S580-F583 VanDerWaalsContact O-C 3.24Å; S580-F583 PolarHBondContact O-N 3.36Å; S580-F583 PolarHBondContact OG-N 3.02Å; F583-E588 VanDerWaalsContact CA-OE2 3.25Å; F583-E588 WeakPolarHBondContact CA-OE2 3.19Å; F583-E588 HydrophobicContact CB-CB 4.27Å; F583-E588 HydrophobicContact CD1-CB 4.11Å; F583-V589 HydrophobicContact CB-CG2 3.64Å; F583-V589 HydrophobicContact CG-CG2 4.28Å; F583-A592 HydrophobicContact CE1-CB 3.88Å; F583-A592 HydrophobicContact CE2-CB 4.47Å; F583-A592 HydrophobicContact CZ-CB 3.79Å
584	M	88.6	Confident	90.7	Very high	140 Å²	140	61.9 Å²	61.9	69%	0.69	31%	0.307	S	S	*	.			trans	-81.9	-30	-172.1	-64.3	-90.4	74	0	0	112.1	S580 E588	S580-M584 WeakPolarHBondContact O-CE 3.47Å; M584-E588 PolarHBondContact N-OE2 3.02Å
585	T	91.4	Very high	90.8	Very high	62 Å²	62	63.6 Å²	63.6	38%	0.38	31%	0.313	S	S	.	.	S	Bend	trans	-109.7	159.7	177.3	66.8	0	0	0	0	112.8	L579 D587 E588 V589	L579-T585 VanDerWaalsContact CD2-C 3.4Å; L579-T585 WeakPolarHBondContact CD2-O 3.23Å; T585-D587 PolarHBondContact O-N 2.76Å; T585-E588 VanDerWaalsContact CB-OE1 3.26Å; T585-E588 WeakPolarHBondContact CB-OE1 3.5Å; T585-E588 VanDerWaalsContact CG2-OE1 3.22Å; T585-E588 WeakPolarHBondContact CG2-OE1 3.47Å; T585-E588 PolarHBondContact N-OE1 2.87Å; T585-E588 VanDerWaalsContact OG1-CD 3.24Å; T585-E588 VanDerWaalsContact OG1-CG 3.31Å; T585-E588 WeakPolarHBondContact OG1-CG 3.41Å; T585-E588 PolarHBondContact OG1-N 2.72Å; T585-E588 PolarHBondContact OG1-OE1 3.21Å; T585-V589 PolarHBondContact O-N 2.71Å
586	T	92.9	Very high	90.9	Very high	28 Å²	28	63.6 Å²	63.6	17%	0.172	31%	0.313	C	S	.	.	H	α-helix	trans	-63.9	-24.7	172.2	45.2	0	0	0	0	112.6	T572 A575 K576 V589 I590	T572-T586 HydrophobicContact CG2-CG2 4.45Å; A575-T586 HydrophobicContact CB-CG2 4.2Å; K576-T586 HydrophobicContact CG-CG2 3.65Å; T586-V589 WeakPolarHBondContact O-CB 3.49Å; T586-V589 PolarHBondContact O-N 3.09Å; T586-I590 VanDerWaalsContact O-CG1 3.29Å; T586-I590 WeakPolarHBondContact O-CG1 3.26Å; T586-I590 PolarHBondContact O-N 2.78Å
587	D	92.8	Very high	91	Very high	102 Å²	102	58.4 Å²	58.4	55%	0.545	29%	0.291	S	S	.	.	H	α-helix	trans	-87.1	-31.9	-170.3	-51.3	-30.7	0	0	0	110.3	T585 I590 H591	T585-D587 PolarHBondContact O-N 2.76Å; D587-I590 PolarHBondContact O-N 2.97Å; D587-H591 VanDerWaalsContact O-CB 3.3Å; D587-H591 WeakPolarHBondContact O-CB 3.35Å; D587-H591 PolarHBondContact O-N 2.89Å
588	E	92.5	Very high	91.2	Very high	70 Å²	70	52.2 Å²	52.2	33%	0.327	26%	0.262	S	S	.	.	H	α-helix	trans	-56.8	-46.2	161.6	-75.1	155.8	-111.4	0	0	112	F583 M584 T585 H591 A592	F583-E588 VanDerWaalsContact CA-OE2 3.25Å; F583-E588 WeakPolarHBondContact CA-OE2 3.19Å; F583-E588 HydrophobicContact CB-CB 4.27Å; F583-E588 HydrophobicContact CD1-CB 4.11Å; M584-E588 PolarHBondContact N-OE2 3.02Å; T585-E588 VanDerWaalsContact CB-OE1 3.26Å; T585-E588 WeakPolarHBondContact CB-OE1 3.5Å; T585-E588 VanDerWaalsContact CG2-OE1 3.22Å; T585-E588 WeakPolarHBondContact CG2-OE1 3.47Å; T585-E588 PolarHBondContact N-OE1 2.87Å; T585-E588 VanDerWaalsContact OG1-CD 3.24Å; T585-E588 VanDerWaalsContact OG1-CG 3.31Å; T585-E588 WeakPolarHBondContact OG1-CG 3.41Å; T585-E588 PolarHBondContact OG1-N 2.72Å; T585-E588 PolarHBondContact OG1-OE1 3.21Å; E588-H591 PolarHBondContact O-N 3.06Å; E588-A592 WeakPolarHBondContact O-CB 3.34Å; E588-A592 PolarHBondContact O-N 3.27Å
589	V	93.3	Very high	91.4	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-61.5	-46.6	177	171.8	0	0	0	0	111	I537 F540 A575 L579 F583 T585 T586 H591 A592 A593	I537-V589 HydrophobicContact CD1-CG1 4.27Å; F540-V589 HydrophobicContact CD2-CG1 4.44Å; A575-V589 HydrophobicContact CB-CB 4.2Å; A575-V589 HydrophobicContact CB-CG1 3.86Å; L579-V589 HydrophobicContact CD2-CG2 4.08Å; F583-V589 HydrophobicContact CB-CG2 3.64Å; F583-V589 HydrophobicContact CG-CG2 4.28Å; T585-V589 PolarHBondContact O-N 2.71Å; T586-V589 WeakPolarHBondContact O-CB 3.49Å; T586-V589 PolarHBondContact O-N 3.09Å; V589-H591 VanDerWaalsContact C-N 3.34Å; V589-H591 PolarHBondContact O-N 3.41Å; V589-A592 PolarHBondContact O-N 3.36Å; V589-A593 VanDerWaalsContact O-CB 3.32Å; V589-A593 WeakPolarHBondContact O-CB 3.36Å; V589-A593 PolarHBondContact O-N 2.94Å
590	I	93.5	Very high	91.6	Very high	19 Å²	19	50.5 Å²	50.5	10%	0.097	25%	0.252	C	S	.	.	H	α-helix	trans	-64.8	-38.5	178	-70.6	165.7	0	0	0	111	F540 A575 T586 D587 A593 K594 L714	F540-I590 HydrophobicContact CZ-CG1 4.45Å; A575-I590 HydrophobicContact CB-CD1 4.19Å; A575-I590 HydrophobicContact CB-CG1 3.92Å; T586-I590 VanDerWaalsContact O-CG1 3.29Å; T586-I590 WeakPolarHBondContact O-CG1 3.26Å; T586-I590 PolarHBondContact O-N 2.78Å; D587-I590 PolarHBondContact O-N 2.97Å; I590-A593 PolarHBondContact O-N 2.96Å; I590-K594 HydrophobicContact CG2-CD 4.22Å; I590-K594 HydrophobicContact CG2-CG 4.49Å; I590-K594 WeakPolarHBondContact O-CB 3.08Å; I590-K594 WeakPolarHBondContact O-CG 3.4Å; I590-K594 PolarHBondContact O-N 3.3Å; I590-L714 HydrophobicContact CG2-CD1 4.2Å; I590-L714 HydrophobicContact CG2-CD2 3.61Å
591	H	93	Very high	92.2	Very high	118 Å²	118	49.1 Å²	49.1	55%	0.546	24%	0.242	S	C	.	.	H	α-helix	trans	-63.9	-48.2	175.3	-173.1	111.5	0	0	0	111.5	D587 E588 V589 A593 K594 Y595	D587-H591 VanDerWaalsContact O-CB 3.3Å; D587-H591 WeakPolarHBondContact O-CB 3.35Å; D587-H591 PolarHBondContact O-N 2.89Å; E588-H591 PolarHBondContact O-N 3.06Å; V589-H591 VanDerWaalsContact C-N 3.34Å; V589-H591 PolarHBondContact O-N 3.41Å; H591-A593 VanDerWaalsContact C-N 3.3Å; H591-A593 PolarHBondContact O-N 2.87Å; H591-K594 PolarHBondContact O-N 3.12Å; H591-Y595 PolarHBondContact O-N 3.11Å
592	A	93	Very high	92.7	Very high	1 Å²	1	42.8 Å²	42.8	1%	0.008	20%	0.201	C	C	.	.	H	α-helix	trans	-60.5	-41.1	176.8	0	0	0	0	0	111.5	F532 I537 F583 E588 V589 Y595 V596	F532-A592 HydrophobicContact CD1-CB 4.13Å; F532-A592 HydrophobicContact CD2-CB 3.94Å; F532-A592 HydrophobicContact CE1-CB 4.23Å; F532-A592 HydrophobicContact CE2-CB 4.06Å; F532-A592 HydrophobicContact CG-CB 3.98Å; F532-A592 HydrophobicContact CZ-CB 4.2Å; I537-A592 HydrophobicContact CD1-CB 4.5Å; I537-A592 HydrophobicContact CG1-CB 4.17Å; I537-A592 HydrophobicContact CG2-CB 4.09Å; F583-A592 HydrophobicContact CE1-CB 3.88Å; F583-A592 HydrophobicContact CE2-CB 4.47Å; F583-A592 HydrophobicContact CZ-CB 3.79Å; E588-A592 WeakPolarHBondContact O-CB 3.34Å; E588-A592 PolarHBondContact O-N 3.27Å; V589-A592 PolarHBondContact O-N 3.36Å; A592-Y595 PolarHBondContact O-N 3.32Å; A592-V596 WeakPolarHBondContact O-CG2 3.46Å; A592-V596 PolarHBondContact O-N 3.31Å
593	A	93.6	Very high	93.3	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-64.3	-46.3	175.6	0	0	0	0	0	112.8	I537 F540 F544 V589 I590 H591 Y595 V596 V597	I537-A593 HydrophobicContact CG2-CB 4.05Å; F540-A593 HydrophobicContact CD1-CB 3.28Å; F540-A593 HydrophobicContact CE1-CB 3.6Å; F540-A593 HydrophobicContact CG-CB 4.13Å; F544-A593 HydrophobicContact CE2-CB 4.25Å; V589-A593 VanDerWaalsContact O-CB 3.32Å; V589-A593 WeakPolarHBondContact O-CB 3.36Å; V589-A593 PolarHBondContact O-N 2.94Å; I590-A593 PolarHBondContact O-N 2.96Å; H591-A593 VanDerWaalsContact C-N 3.3Å; H591-A593 PolarHBondContact O-N 2.87Å; A593-Y595 VanDerWaalsContact C-N 3.29Å; A593-Y595 PolarHBondContact O-N 3.18Å; A593-V596 PolarHBondContact O-N 2.59Å; A593-V597 PolarHBondContact O-N 2.93Å
594	K	94.2	Very high	93.7	Very high	46 Å²	46	35.6 Å²	35.6	20%	0.2	17%	0.174	C	C	.	.	H	α-helix	trans	-55.3	-45	173.1	-80	173.2	55.1	172.6	0	111.4	I590 H591 A598 L714 E717	I590-K594 HydrophobicContact CG2-CD 4.22Å; I590-K594 HydrophobicContact CG2-CG 4.49Å; I590-K594 WeakPolarHBondContact O-CB 3.08Å; I590-K594 WeakPolarHBondContact O-CG 3.4Å; I590-K594 PolarHBondContact O-N 3.3Å; H591-K594 PolarHBondContact O-N 3.12Å; K594-A598 WeakPolarHBondContact O-CB 3.3Å; K594-A598 PolarHBondContact O-N 3.08Å; K594-L714 HydrophobicContact CD-CD2 3.89Å; K594-L714 HydrophobicContact CG-CD2 4.24Å; K594-E717 WeakPolarHBondContact CE-OE2 3.45Å; K594-E717 IonicContact NZ-OE2 3.98Å; K594-E717 PolarHBondContact NZ-OE2 2.79Å
595	Y	94.5	Very high	94	Very high	40 Å²	40	29.7 Å²	29.7	16%	0.157	15%	0.146	C	C	.	.	H	α-helix	trans	-63.1	-44.6	177.7	-174.6	-77.6	0	0	0	111.9	P528 F532 H591 A592 A593 R599 W726	P528-Y595 HydrophobicContact CB-CD1 4.43Å; P528-Y595 HydrophobicContact CB-CE1 3.83Å; P528-Y595 HydrophobicContact CB-CE2 4.29Å; F532-Y595 AromaticContact CD2-CD1 3.83Å; F532-Y595 HydrophobicContact CD2-CD1 3.83Å; F532-Y595 HydrophobicContact CD2-CG 4.22Å; F532-Y595 AromaticContact CE2-CD1 3.75Å; F532-Y595 HydrophobicContact CE2-CD1 3.75Å; F532-Y595 HydrophobicContact CE2-CD2 4.48Å; F532-Y595 HydrophobicContact CE2-CE1 4.5Å; F532-Y595 AromaticContact CE2-CG 3.76Å; F532-Y595 HydrophobicContact CE2-CG 3.76Å; H591-Y595 PolarHBondContact O-N 3.11Å; A592-Y595 PolarHBondContact O-N 3.32Å; A593-Y595 VanDerWaalsContact C-N 3.29Å; A593-Y595 PolarHBondContact O-N 3.18Å; Y595-R599 HydrophobicContact CE1-CB 4.32Å; Y595-R599 WeakPolarHBondContact O-CB 3.43Å; Y595-R599 PolarHBondContact O-N 3.23Å; Y595-W726 HydrophobicContact CD2-CH2 4.09Å; Y595-W726 HydrophobicContact CD2-CZ2 4.39Å; Y595-W726 AromaticContact CE2-CH2 3.84Å; Y595-W726 HydrophobicContact CE2-CH2 3.84Å; Y595-W726 AromaticContact CE2-CZ2 3.71Å; Y595-W726 HydrophobicContact CE2-CZ2 3.71Å; Y595-W726 AromaticContact CZ-CZ2 3.89Å
596	V	93.5	Very high	94.2	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-59	-50.2	177.5	165.4	0	0	0	0	111.1	Y529 F532 I537 A541 A592 A593 R599 Q600	Y529-V596 HydrophobicContact CD2-CG2 4.24Å; Y529-V596 HydrophobicContact CE2-CB 4.34Å; Y529-V596 HydrophobicContact CE2-CG1 3.91Å; Y529-V596 HydrophobicContact CE2-CG2 4.34Å; F532-V596 HydrophobicContact CB-CG2 3.74Å; F532-V596 HydrophobicContact CD2-CG2 4.16Å; F532-V596 HydrophobicContact CG-CG2 4.48Å; I537-V596 HydrophobicContact CG2-CG2 3.99Å; A541-V596 HydrophobicContact CB-CG1 3.76Å; A592-V596 WeakPolarHBondContact O-CG2 3.46Å; A592-V596 PolarHBondContact O-N 3.31Å; A593-V596 PolarHBondContact O-N 2.59Å; V596-R599 PolarHBondContact O-N 3.07Å; V596-Q600 VanDerWaalsContact O-CG 3.28Å; V596-Q600 WeakPolarHBondContact O-CG 3.28Å; V596-Q600 PolarHBondContact O-N 2.92Å
597	V	94.8	Very high	94.3	Very high	7 Å²	7	27.4 Å²	27.4	4%	0.042	13%	0.13	C	C	.	.	H	α-helix	trans	-66.4	-46.5	179.7	175.3	0	0	0	0	111.5	A541 F544 A593 R599 Q600 L601 C718	A541-V597 HydrophobicContact CB-CG2 3.73Å; F544-V597 HydrophobicContact CD1-CG1 4.27Å; F544-V597 HydrophobicContact CD1-CG2 4.29Å; F544-V597 HydrophobicContact CD2-CG2 3.65Å; F544-V597 HydrophobicContact CE1-CG2 4.39Å; F544-V597 HydrophobicContact CE2-CG2 3.75Å; F544-V597 HydrophobicContact CG-CG1 4.45Å; F544-V597 HydrophobicContact CG-CG2 3.92Å; F544-V597 HydrophobicContact CZ-CG2 4.13Å; A593-V597 PolarHBondContact O-N 2.93Å; V597-R599 VanDerWaalsContact C-N 3.28Å; V597-R599 PolarHBondContact O-N 2.78Å; V597-Q600 PolarHBondContact O-N 2.84Å; V597-L601 HydrophobicContact CG1-CD1 4.14Å; V597-L601 HydrophobicContact CG1-CG 4.45Å; V597-L601 WeakPolarHBondContact O-CG 3.41Å; V597-L601 PolarHBondContact O-N 3Å; V597-C718 HydrophobicContact CB-CB 4.49Å; V597-C718 HydrophobicContact CG1-CB 4.02Å
598	A	95.8	Very high	94.5	Very high	0 Å²	0	23 Å²	23	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-62.2	-35.9	178.7	0	0	0	0	0	112.3	K594 A602 C718 L721 A722 W726	K594-A598 WeakPolarHBondContact O-CB 3.3Å; K594-A598 PolarHBondContact O-N 3.08Å; A598-A602 VanDerWaalsContact O-CB 3.31Å; A598-A602 WeakPolarHBondContact O-CB 3.2Å; A598-A602 PolarHBondContact O-N 3.34Å; A598-C718 HydrophobicContact CB-CB 4.41Å; A598-C718 WeakPolarHBondContact CB-O 3.31Å; A598-L721 HydrophobicContact CB-CB 3.92Å; A598-L721 HydrophobicContact CB-CD2 3.76Å; A598-L721 HydrophobicContact CB-CG 3.85Å; A598-A722 HydrophobicContact CB-CB 4.25Å; A598-A722 VanDerWaalsContact O-CB 3.28Å; A598-A722 WeakPolarHBondContact O-CB 3.44Å; A598-W726 HydrophobicContact CB-CZ3 3.85Å
599	R	94.8	Very high	94.6	Very high	58 Å²	58	22.8 Å²	22.8	22%	0.219	10%	0.104	C	C	.	.	H	α-helix	trans	-71.9	-35.6	176.1	-171.2	62.2	-179	-167.3	1.5	112.4	L459 Y529 Y595 V596 V597 A602 Q603 W726	L459-R599 HydrophobicContact CD1-CG 4.29Å; Y529-R599 HydrophobicContact CD2-CB 4.09Å; Y529-R599 HydrophobicContact CD2-CG 4.11Å; Y595-R599 HydrophobicContact CE1-CB 4.32Å; Y595-R599 WeakPolarHBondContact O-CB 3.43Å; Y595-R599 PolarHBondContact O-N 3.23Å; V596-R599 PolarHBondContact O-N 3.07Å; V597-R599 VanDerWaalsContact C-N 3.28Å; V597-R599 PolarHBondContact O-N 2.78Å; R599-A602 PolarHBondContact O-N 2.91Å; R599-Q603 PolarHBondContact O-N 3.08Å; R599-W726 HydrophobicContact CB-CH2 4.23Å; R599-W726 HydrophobicContact CB-CZ3 4.24Å; R599-W726 VanDerWaalsContact NH1-CD1 3.32Å
600	Q	94.6	Very high	94.6	Very high	40 Å²	40	23.4 Å²	23.4	19%	0.187	11%	0.108	C	C	.	.	H	α-helix	trans	-64.1	-44	172.2	-74.2	167.1	-7.2	0	0	111.8	L459 Y529 P548 V596 V597 Q603 E604	L459-Q600 HydrophobicContact CD2-CB 4.5Å; L459-Q600 HydrophobicContact CD2-CG 4.11Å; Y529-Q600 HydrophobicContact CE2-CG 3.95Å; Y529-Q600 PolarHBondContact OH-NE2 2.95Å; P548-Q600 HydrophobicContact CG-CB 3.78Å; V596-Q600 VanDerWaalsContact O-CG 3.28Å; V596-Q600 WeakPolarHBondContact O-CG 3.28Å; V596-Q600 PolarHBondContact O-N 2.92Å; V597-Q600 PolarHBondContact O-N 2.84Å; Q600-Q603 PolarHBondContact O-N 2.79Å; Q600-E604 PolarHBondContact O-N 2.87Å
601	L	96	Very high	94.6	Very high	2 Å²	2	22.5 Å²	22.5	1%	0.01	10%	0.103	C	C	.	.	H	α-helix	trans	-60	-48.4	172.9	-68.7	171	0	0	0	111.7	P548 Y551 V597 Q603 E604 L607 Y699 C718 V719 A722	P548-L601 HydrophobicContact CB-CD2 4.28Å; Y551-L601 HydrophobicContact CD1-CD2 3.52Å; Y551-L601 HydrophobicContact CE1-CD2 4.23Å; Y551-L601 HydrophobicContact CG-CD2 4.06Å; V597-L601 HydrophobicContact CG1-CD1 4.14Å; V597-L601 HydrophobicContact CG1-CG 4.45Å; V597-L601 WeakPolarHBondContact O-CG 3.41Å; V597-L601 PolarHBondContact O-N 3Å; L601-Q603 PolarHBondContact O-N 2.87Å; L601-Q603 VanDerWaalsContact O-N 3.14Å; L601-E604 WeakPolarHBondContact O-CB 3.24Å; L601-E604 PolarHBondContact O-N 3.3Å; L601-L607 HydrophobicContact CB-CD1 4.29Å; L601-L607 HydrophobicContact CD2-CD1 4.44Å; L601-Y699 HydrophobicContact CD1-CE1 4.32Å; L601-C718 HydrophobicContact CD1-CB 4.31Å; L601-V719 HydrophobicContact CD1-CG2 4.35Å; L601-A722 HydrophobicContact CB-CB 3.72Å; L601-A722 HydrophobicContact CD1-CB 4.31Å
602	A	95.6	Very high	94.7	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-68.5	-11.9	-175.3	0	0	0	0	0	115.5	A598 R599 R608 A722 W726 V727	A598-A602 VanDerWaalsContact O-CB 3.31Å; A598-A602 WeakPolarHBondContact O-CB 3.2Å; A598-A602 PolarHBondContact O-N 3.34Å; R599-A602 PolarHBondContact O-N 2.91Å; A602-R608 WeakPolarHBondContact O-CD 3.22Å; A602-R608 PolarHBondContact O-NH1 3.05Å; A602-A722 HydrophobicContact CB-CB 4.2Å; A602-W726 HydrophobicContact CB-CB 3.88Å; A602-W726 HydrophobicContact CB-CD2 4.23Å; A602-W726 HydrophobicContact CB-CE3 3.63Å; A602-W726 HydrophobicContact CB-CG 4.37Å; A602-V727 HydrophobicContact CB-CG2 3.82Å
603	Q	94.3	Very high	94.6	Very high	13 Å²	13	23.9 Å²	23.9	6%	0.061	11%	0.108	C	C	.	.	T	Hydrogen-bonded Turn	trans	-117.6	10.8	177.2	-57.1	-167.4	-93.9	0	0	113	Y456 L459 R599 Q600 L601 P605	Y456-Q603 WeakPolarHBondContact CD2-O 3.3Å; L459-Q603 HydrophobicContact CD2-CB 4Å; R599-Q603 PolarHBondContact O-N 3.08Å; Q600-Q603 PolarHBondContact O-N 2.79Å; L601-Q603 PolarHBondContact O-N 2.87Å; L601-Q603 VanDerWaalsContact O-N 3.14Å; Q603-P605 WeakPolarHBondContact O-CD 3.45Å
604	E	95.5	Very high	94.6	Very high	2 Å²	2	25 Å²	25	1%	0.009	12%	0.115	C	C	.	.			trans	-76.9	115.9	172.2	178.3	56.9	-129.9	0	0	109.9	R440 Y456 P548 A552 Q600 L601 L606 L607 R608	R440-E604 IonicContact CZ-OE1 3.72Å; R440-E604 IonicContact NH1-OE1 3.59Å; R440-E604 PolarHBondContact NH1-OE1 3.11Å; R440-E604 IonicContact NH1-OE2 2.73Å; R440-E604 IonicContact NH2-OE1 2.78Å; R440-E604 PolarHBondContact NH2-OE1 3.31Å; Y456-E604 VanDerWaalsContact CE2-OE2 3.22Å; Y456-E604 WeakPolarHBondContact CE2-OE2 3.4Å; Y456-E604 PolarHBondContact OH-OE2 2.88Å; P548-E604 HydrophobicContact CB-CB 4.1Å; P548-E604 HydrophobicContact CB-CG 4.17Å; A552-E604 HydrophobicContact CB-CG 3.78Å; Q600-E604 PolarHBondContact O-N 2.87Å; L601-E604 WeakPolarHBondContact O-CB 3.24Å; L601-E604 PolarHBondContact O-N 3.3Å; E604-L606 VanDerWaalsContact C-N 3.32Å; E604-L606 PolarHBondContact O-N 3.27Å; E604-L607 HydrophobicContact CB-CB 4.13Å; E604-L607 HydrophobicContact CG-CB 4.3Å; E604-L607 WeakPolarHBondContact O-CB 3.18Å; E604-L607 PolarHBondContact O-N 2.84Å; E604-R608 PolarHBondContact O-N 3.35Å; E604-R608 VanDerWaalsContact O-N 3.11Å
605	P	94.9	Very high	94.6	Very high	16 Å²	16	22.8 Å²	22.8	10%	0.104	11%	0.106	C	C	.	.	H	α-helix	trans	-60.1	-37.2	-170.5	-27.4	35.8	0	0	0	114.1	D452 V453 Y456 Q603 L607 R608 K609	D452-P605 HydrophobicContact CB-CB 4.22Å; V453-P605 HydrophobicContact CG2-CB 4.08Å; V453-P605 HydrophobicContact CG2-CG 4.03Å; Y456-P605 HydrophobicContact CD1-CG 4.32Å; Y456-P605 HydrophobicContact CD2-CG 4.3Å; Y456-P605 HydrophobicContact CG-CG 3.91Å; Q603-P605 WeakPolarHBondContact O-CD 3.45Å; P605-L607 VanDerWaalsContact C-N 3.3Å; P605-L607 PolarHBondContact O-N 3.16Å; P605-R608 PolarHBondContact O-N 2.76Å; P605-K609 WeakPolarHBondContact O-CB 3.41Å; P605-K609 PolarHBondContact O-N 3.29Å
606	L	94.4	Very high	94.5	Very high	40 Å²	40	22.2 Å²	22.2	21%	0.209	10%	0.104	C	C	.	.	H	α-helix	trans	-65.5	-34.6	178.6	-176.9	61.6	0	0	0	112.3	A552 E553 E604 T610	A552-L606 HydrophobicContact CB-CB 3.88Å; A552-L606 HydrophobicContact CB-CD2 4.06Å; A552-L606 HydrophobicContact CB-CG 4Å; E553-L606 HydrophobicContact CG-CD2 3.97Å; E604-L606 VanDerWaalsContact C-N 3.32Å; E604-L606 PolarHBondContact O-N 3.27Å; L606-T610 WeakPolarHBondContact O-CB 3.37Å; L606-T610 PolarHBondContact O-N 3.43Å; L606-T610 VanDerWaalsContact O-N 3.09Å; L606-T610 PolarHBondContact O-OG1 2.9Å
607	L	95.9	Very high	94.4	Very high	1 Å²	1	27.9 Å²	27.9	1%	0.005	13%	0.134	C	C	.	.	H	α-helix	trans	-68.8	-48	175.2	-179.1	152.1	0	0	0	110.1	Y551 A552 L555 L601 E604 P605 K609 T610 M611 L723 V727	Y551-L607 HydrophobicContact CD1-CD1 3.87Å; Y551-L607 HydrophobicContact CE1-CD1 3.64Å; A552-L607 HydrophobicContact CB-CB 3.89Å; L555-L607 HydrophobicContact CD2-CD1 4.35Å; L555-L607 HydrophobicContact CD2-CG 3.91Å; L601-L607 HydrophobicContact CB-CD1 4.29Å; L601-L607 HydrophobicContact CD2-CD1 4.44Å; E604-L607 HydrophobicContact CB-CB 4.13Å; E604-L607 HydrophobicContact CG-CB 4.3Å; E604-L607 WeakPolarHBondContact O-CB 3.18Å; E604-L607 PolarHBondContact O-N 2.84Å; P605-L607 VanDerWaalsContact C-N 3.3Å; P605-L607 PolarHBondContact O-N 3.16Å; L607-K609 PolarHBondContact O-N 3.28Å; L607-T610 PolarHBondContact O-N 3.41Å; L607-M611 HydrophobicContact CD2-CG 4Å; L607-M611 HydrophobicContact CG-CG 4.47Å; L607-M611 WeakPolarHBondContact O-CB 3.37Å; L607-M611 VanDerWaalsContact O-CG 3.3Å; L607-M611 WeakPolarHBondContact O-CG 3.31Å; L607-M611 PolarHBondContact O-N 3.03Å; L607-L723 HydrophobicContact CD2-CD2 3.99Å; L607-V727 HydrophobicContact CD2-CG1 4.26Å; L607-V727 HydrophobicContact CD2-CG2 3.87Å
608	R	95.9	Very high	94.2	Very high	10 Å²	10	30.4 Å²	30.4	4%	0.038	14%	0.143	C	C	.	.	H	α-helix	trans	-61.4	-44.6	180	-65.6	-177.6	68.7	88.5	-0	111.7	D452 A602 E604 P605 M611 R612 D730	D452-R608 WeakPolarHBondContact OD1-CD 3.31Å; D452-R608 IonicContact OD1-CZ 2.83Å; D452-R608 IonicContact OD1-NE 3.76Å; D452-R608 PolarHBondContact OD1-NE 2.98Å; D452-R608 IonicContact OD1-NH2 3.6Å; D452-R608 WeakPolarHBondContact OD2-CB 3.39Å; A602-R608 WeakPolarHBondContact O-CD 3.22Å; A602-R608 PolarHBondContact O-NH1 3.05Å; E604-R608 PolarHBondContact O-N 3.35Å; E604-R608 VanDerWaalsContact O-N 3.11Å; P605-R608 PolarHBondContact O-N 2.76Å; R608-M611 PolarHBondContact O-N 3.16Å; R608-R612 VanDerWaalsContact O-CB 3.3Å; R608-R612 WeakPolarHBondContact O-CB 3.35Å; R608-R612 PolarHBondContact O-N 3.19Å; R608-D730 IonicContact CZ-OD2 3.84Å; R608-D730 VanDerWaalsContact CZ-OD2 3.23Å; R608-D730 IonicContact NH1-OD2 2.46Å; R608-D730 PolarHBondContact NH1-OD2 3.29Å; R608-D730 IonicContact NH2-OD2 3.58Å; R608-D730 PolarHBondContact NH2-OD2 3.07Å
609	K	94.6	Very high	94.1	Very high	66 Å²	66	30.5 Å²	30.5	29%	0.287	14%	0.144	S	C	.	.	H	α-helix	trans	-57.9	-49.2	173	178.5	167.8	-178.4	152.3	0	112.9	E449 P605 L607 M611 R612 E613	E449-K609 WeakPolarHBondContact OE1-CD 2.97Å; E449-K609 WeakPolarHBondContact OE1-CE 3.49Å; E449-K609 IonicContact OE1-NZ 3.37Å; E449-K609 PolarHBondContact OE1-NZ 3.04Å; E449-K609 IonicContact OE2-NZ 3.19Å; P605-K609 WeakPolarHBondContact O-CB 3.41Å; P605-K609 PolarHBondContact O-N 3.29Å; L607-K609 PolarHBondContact O-N 3.28Å; K609-M611 PolarHBondContact O-N 2.98Å; K609-R612 WeakPolarHBondContact O-CB 3.38Å; K609-R612 PolarHBondContact O-N 3.26Å; K609-E613 WeakPolarHBondContact CE-OE1 3.49Å; K609-E613 WeakPolarHBondContact O-CG 3.2Å; K609-E613 PolarHBondContact O-N 2.84Å
610	T	94	Very high	94.1	Very high	13 Å²	13	30.8 Å²	30.8	8%	0.08	15%	0.145	C	C	.	.	H	α-helix	trans	-61.4	-45	178.4	-55.5	0	0	0	0	111.3	L555 R556 L606 L607 E613 V614	L555-T610 HydrophobicContact CD2-CG2 4.42Å; L555-T610 HydrophobicContact CG-CG2 4.09Å; R556-T610 HydrophobicContact CB-CG2 4.44Å; L606-T610 WeakPolarHBondContact O-CB 3.37Å; L606-T610 PolarHBondContact O-N 3.43Å; L606-T610 VanDerWaalsContact O-N 3.09Å; L606-T610 PolarHBondContact O-OG1 2.9Å; L607-T610 PolarHBondContact O-N 3.41Å; T610-E613 PolarHBondContact O-N 3.47Å; T610-V614 WeakPolarHBondContact O-CG2 3.32Å; T610-V614 PolarHBondContact O-N 2.93Å; T610-V614 VanDerWaalsContact O-N 3.11Å
611	M	94.5	Very high	94.1	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-64	-39.7	177.6	-72.4	-63.1	-53.1	0	0	112.2	L555 L607 R608 K609 Y615 F678 Y691 L723 V727 I728 L731	L555-M611 HydrophobicContact CD2-CG 4.19Å; L555-M611 HydrophobicContact CD2-SD 4.11Å; L607-M611 HydrophobicContact CD2-CG 4Å; L607-M611 HydrophobicContact CG-CG 4.47Å; L607-M611 WeakPolarHBondContact O-CB 3.37Å; L607-M611 VanDerWaalsContact O-CG 3.3Å; L607-M611 WeakPolarHBondContact O-CG 3.31Å; L607-M611 PolarHBondContact O-N 3.03Å; R608-M611 PolarHBondContact O-N 3.16Å; K609-M611 PolarHBondContact O-N 2.98Å; M611-Y615 WeakPolarHBondContact O-CB 3.43Å; M611-Y615 PolarHBondContact O-N 3.26Å; M611-F678 HydrophobicContact CE-CE1 4.23Å; M611-F678 HydrophobicContact CE-CZ 3.8Å; M611-Y691 HydrophobicContact CE-CD1 4.45Å; M611-Y691 HydrophobicContact CE-CE1 4.48Å; M611-Y691 HydrophobicContact SD-CD1 4.27Å; M611-Y691 HydrophobicContact SD-CE1 3.77Å; M611-L723 HydrophobicContact CE-CD1 4.4Å; M611-L723 HydrophobicContact CE-CD2 3.93Å; M611-L723 HydrophobicContact CG-CD2 3.83Å; M611-L723 HydrophobicContact SD-CD1 4.23Å; M611-L723 HydrophobicContact SD-CD2 3.74Å; M611-V727 HydrophobicContact CB-CG1 3.78Å; M611-V727 HydrophobicContact CG-CG1 3.98Å; M611-I728 HydrophobicContact CE-CD1 4.4Å; M611-I728 HydrophobicContact CE-CG1 4.11Å; M611-L731 HydrophobicContact CB-CD1 3.72Å
612	R	94.5	Very high	94	Very high	25 Å²	25	30.4 Å²	30.4	9%	0.094	14%	0.144	C	C	.	.	H	α-helix	trans	-58.6	-54	175.5	-178.6	-178.3	-71.8	113.3	2.9	111.6	D452 R608 K609 V614 Y615 F616 L731 E734	D452-R612 IonicContact OD1-NH2 2.66Å; D452-R612 PolarHBondContact OD1-NH2 3.42Å; D452-R612 IonicContact OD2-CZ 3.29Å; D452-R612 VanDerWaalsContact OD2-CZ 3.3Å; D452-R612 IonicContact OD2-NH1 3.07Å; D452-R612 PolarHBondContact OD2-NH1 3.28Å; D452-R612 IonicContact OD2-NH2 3.88Å; D452-R612 PolarHBondContact OD2-NH2 2.96Å; R608-R612 VanDerWaalsContact O-CB 3.3Å; R608-R612 WeakPolarHBondContact O-CB 3.35Å; R608-R612 PolarHBondContact O-N 3.19Å; K609-R612 WeakPolarHBondContact O-CB 3.38Å; K609-R612 PolarHBondContact O-N 3.26Å; R612-V614 PolarHBondContact O-N 3.47Å; R612-Y615 PolarHBondContact O-N 3.39Å; R612-F616 HydrophobicContact CG-CD1 4.34Å; R612-F616 HydrophobicContact CG-CE1 4.15Å; R612-F616 HydrophobicContact CG-CZ 4.3Å; R612-F616 WeakPolarHBondContact O-CB 3.05Å; R612-F616 VanDerWaalsContact O-CD1 3.31Å; R612-F616 WeakPolarHBondContact O-CD1 3.5Å; R612-F616 PolarHBondContact O-N 2.79Å; R612-L731 HydrophobicContact CB-CD1 4.47Å; R612-L731 HydrophobicContact CB-CD2 3.64Å; R612-L731 HydrophobicContact CG-CD2 3.93Å; R612-E734 VanDerWaalsContact CD-OE1 3.23Å; R612-E734 WeakPolarHBondContact CD-OE1 3.42Å; R612-E734 IonicContact CZ-OE1 2.66Å; R612-E734 IonicContact CZ-OE2 2.69Å; R612-E734 VanDerWaalsContact NE-CD 3.31Å; R612-E734 IonicContact NE-OE1 2.66Å; R612-E734 PolarHBondContact NE-OE1 3.08Å; R612-E734 IonicContact NE-OE2 3.8Å; R612-E734 PolarHBondContact NE-OE2 3.23Å; R612-E734 VanDerWaalsContact NE-OE2 3.13Å; R612-E734 IonicContact NH2-OE1 3.91Å; R612-E734 IonicContact NH2-OE2 3.18Å; R612-E734 PolarHBondContact NH2-OE2 3.35Å
613	E	91.4	Very high	94.1	Very high	122 Å²	122	30.4 Å²	30.4	57%	0.57	14%	0.144	S	C	*	.	H	α-helix	trans	-60.2	-44.1	-179	-70.6	176	-166.4	0	0	112	K609 T610	K609-E613 WeakPolarHBondContact CE-OE1 3.49Å; K609-E613 WeakPolarHBondContact O-CG 3.2Å; K609-E613 PolarHBondContact O-N 2.84Å; T610-E613 PolarHBondContact O-N 3.47Å
614	V	92.5	Very high	94.1	Very high	24 Å²	24	35.5 Å²	35.5	15%	0.145	16%	0.163	C	C	.	.	H	α-helix	trans	-76.2	-36.3	-179.8	-177	0	0	0	0	112.3	T610 R612 R618 F678 Y691	T610-V614 WeakPolarHBondContact O-CG2 3.32Å; T610-V614 PolarHBondContact O-N 2.93Å; T610-V614 VanDerWaalsContact O-N 3.11Å; R612-V614 PolarHBondContact O-N 3.47Å; V614-R618 WeakPolarHBondContact O-CB 3.44Å; V614-R618 WeakPolarHBondContact O-CG 3.4Å; V614-R618 PolarHBondContact O-N 2.63Å; V614-F678 HydrophobicContact CG1-CE2 3.92Å; V614-Y691 HydrophobicContact CG1-CD2 4.29Å; V614-Y691 HydrophobicContact CG1-CE1 4.28Å; V614-Y691 HydrophobicContact CG1-CE2 4.03Å
615	Y	94.2	Very high	94	Very high	0 Å²	0	36 Å²	36	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-69	-47.9	179.2	-171.7	-111.4	0	0	0	111.1	M611 R612 D617 R618 A619 L675 F678 I728 L731 I732 L735	M611-Y615 WeakPolarHBondContact O-CB 3.43Å; M611-Y615 PolarHBondContact O-N 3.26Å; R612-Y615 PolarHBondContact O-N 3.39Å; Y615-D617 VanDerWaalsContact C-N 3.33Å; Y615-D617 PolarHBondContact O-N 3.12Å; Y615-R618 CarbonylContact O-C 3.21Å; Y615-R618 PolarHBondContact O-N 2.7Å; Y615-A619 HydrophobicContact CD1-CB 4.41Å; Y615-A619 HydrophobicContact CE1-CB 4.12Å; Y615-A619 WeakPolarHBondContact O-CA 3.41Å; Y615-A619 VanDerWaalsContact O-CB 3.24Å; Y615-A619 WeakPolarHBondContact O-CB 3.5Å; Y615-A619 PolarHBondContact O-N 3.26Å; Y615-L675 VanDerWaalsContact CE2-O 3.32Å; Y615-L675 WeakPolarHBondContact CE2-O 3.45Å; Y615-L675 PolarHBondContact OH-O 2.82Å; Y615-F678 AromaticContact CD2-CD1 3.53Å; Y615-F678 HydrophobicContact CD2-CD1 3.53Å; Y615-F678 AromaticContact CD2-CE1 3.6Å; Y615-F678 HydrophobicContact CD2-CE1 3.6Å; Y615-F678 HydrophobicContact CD2-CG 4.03Å; Y615-F678 HydrophobicContact CD2-CZ 4.13Å; Y615-F678 AromaticContact CE2-CD1 3.76Å; Y615-F678 HydrophobicContact CE2-CD1 3.76Å; Y615-F678 HydrophobicContact CE2-CE1 4.16Å; Y615-F678 HydrophobicContact CE2-CG 4.34Å; Y615-I728 HydrophobicContact CE2-CG2 4.46Å; Y615-L731 HydrophobicContact CD1-CB 4.17Å; Y615-I732 HydrophobicContact CE1-CG1 3.8Å; Y615-I732 WeakPolarHBondContact OH-CG1 3.43Å; Y615-L735 HydrophobicContact CD1-CD2 4.24Å; Y615-L735 HydrophobicContact CE1-CD2 3.77Å
616	F	93.9	Very high	94	Very high	28 Å²	28	37 Å²	37	12%	0.123	17%	0.172	C	C	.	.	H	α-helix	trans	-64.9	-35.7	-175	-78.2	36.8	0	0	0	112.3	V327 R612 R618 L731 E734 L735	V327-F616 HydrophobicContact CG1-CB 4.32Å; V327-F616 HydrophobicContact CG2-CD2 3.92Å; R612-F616 HydrophobicContact CG-CD1 4.34Å; R612-F616 HydrophobicContact CG-CE1 4.15Å; R612-F616 HydrophobicContact CG-CZ 4.3Å; R612-F616 WeakPolarHBondContact O-CB 3.05Å; R612-F616 VanDerWaalsContact O-CD1 3.31Å; R612-F616 WeakPolarHBondContact O-CD1 3.5Å; R612-F616 PolarHBondContact O-N 2.79Å; F616-R618 VanDerWaalsContact C-N 3.3Å; F616-R618 PolarHBondContact O-N 3.39Å; F616-L731 HydrophobicContact CE1-CB 4.34Å; F616-L731 HydrophobicContact CE1-CD2 4.15Å; F616-E734 HydrophobicContact CZ-CB 4.15Å; F616-E734 HydrophobicContact CZ-CG 4.15Å; F616-E734 WeakPolarHBondContact CZ-OE1 3.25Å; F616-L735 HydrophobicContact CD1-CB 4.37Å; F616-L735 HydrophobicContact CD1-CD1 4.17Å; F616-L735 HydrophobicContact CD2-CD1 3.85Å; F616-L735 HydrophobicContact CE1-CB 3.82Å; F616-L735 HydrophobicContact CE1-CD1 4.31Å; F616-L735 HydrophobicContact CE2-CB 4.41Å; F616-L735 HydrophobicContact CE2-CD1 4.01Å; F616-L735 HydrophobicContact CG-CD1 3.93Å; F616-L735 HydrophobicContact CZ-CB 3.85Å; F616-L735 HydrophobicContact CZ-CD1 4.24Å
617	D	90.5	Very high	93.8	Very high	119 Å²	119	43.6 Å²	43.6	64%	0.636	20%	0.199	S	C	*	.	H	α-helix	trans	-65.5	-29.6	174.1	177.7	67.3	0	0	0	113.1	Y615	Y615-D617 VanDerWaalsContact C-N 3.33Å; Y615-D617 PolarHBondContact O-N 3.12Å
618	R	91.2	Very high	93.5	Very high	59 Å²	59	47.8 Å²	47.8	22%	0.223	22%	0.222	C	C	.	.	H	α-helix	trans	-114.7	-4.3	-170.4	-57.5	-176.6	-169.1	-175.3	6.9	114.4	V614 Y615 F616 F678 E679 G680 N681	V614-R618 WeakPolarHBondContact O-CB 3.44Å; V614-R618 WeakPolarHBondContact O-CG 3.4Å; V614-R618 PolarHBondContact O-N 2.63Å; Y615-R618 CarbonylContact O-C 3.21Å; Y615-R618 PolarHBondContact O-N 2.7Å; F616-R618 VanDerWaalsContact C-N 3.3Å; F616-R618 PolarHBondContact O-N 3.39Å; R618-F678 HydrophobicContact CB-CD2 4.23Å; R618-E679 VanDerWaalsContact CD-O 3.25Å; R618-E679 WeakPolarHBondContact CD-O 3.25Å; R618-E679 PolarHBondContact NH1-O 2.75Å; R618-G680 PolarHBondContact NH1-O 3.13Å; R618-N681 PolarHBondContact NH1-OD1 3.42Å; R618-N681 PolarHBondContact NH2-OD1 3.39Å
619	A	93.2	Very high	93.3	Very high	2 Å²	2	47.3 Å²	47.3	2%	0.017	22%	0.22	C	C	.	.			trans	-59.9	139.5	-175.8	0	0	0	0	0	110.9	Y615 V650 L735	Y615-A619 HydrophobicContact CD1-CB 4.41Å; Y615-A619 HydrophobicContact CE1-CB 4.12Å; Y615-A619 WeakPolarHBondContact O-CA 3.41Å; Y615-A619 VanDerWaalsContact O-CB 3.24Å; Y615-A619 WeakPolarHBondContact O-CB 3.5Å; Y615-A619 PolarHBondContact O-N 3.26Å; A619-V650 HydrophobicContact CB-CB 4.29Å; A619-V650 HydrophobicContact CB-CG2 3.75Å; A619-V650 WeakPolarHBondContact O-CG2 3.49Å; A619-V650 PolarHBondContact O-N 3.38Å; A619-L735 HydrophobicContact CB-CD2 3.49Å; A619-L735 VanDerWaalsContact CB-CD2 3.49Å
620	R	94.2	Very high	93	Very high	64 Å²	64	46.9 Å²	46.9	24%	0.242	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	141.2	-177.7	-75.2	173.8	-176.6	172.8	6.4	110.1	K647 K648 L675 E679	R620-K647 WeakPolarHBondContact CD-O 3.46Å; R620-K648 CarbonylContact C-O 3.57Å; R620-K648 WeakPolarHBondContact CA-O 3.34Å; R620-L675 HydrophobicContact CB-CD1 4Å; R620-L675 PolarHBondContact O-N 2.78Å; R620-E679 IonicContact CZ-OE1 3.24Å; R620-E679 IonicContact CZ-OE2 2.7Å; R620-E679 IonicContact NH1-OE1 2.72Å; R620-E679 PolarHBondContact NH1-OE1 2.94Å; R620-E679 IonicContact NH1-OE2 3.68Å; R620-E679 IonicContact NH2-OE1 2.88Å; R620-E679 PolarHBondContact NH2-OE1 3.24Å; R620-E679 IonicContact NH2-OE2 2.81Å; R620-E679 PolarHBondContact NH2-OE2 3.26Å
621	I	94.8	Very high	92.7	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	146	177.7	77.5	174.3	0	0	0	111.1	I623 K647 K648 V650 L653 L661 T673 F674	I621-I623 HydrophobicContact CD1-CD1 3.72Å; I621-I623 HydrophobicContact CD1-CG1 3.96Å; I621-I623 HydrophobicContact CG1-CD1 4.41Å; I621-I623 HydrophobicContact CG1-CG1 4.39Å; I621-K647 PolarHBondContact O-N 2.7Å; I621-K647 VanDerWaalsContact O-N 3.16Å; I621-K648 HydrophobicContact CG1-CB 4.25Å; I621-K648 PolarHBondContact N-O 2.78Å; I621-K648 PolarHBondContact O-N 3.5Å; I621-K648 VanDerWaalsContact O-N 3.07Å; I621-V650 HydrophobicContact CG2-CG2 3.77Å; I621-L653 HydrophobicContact CD1-CD1 4.45Å; I621-L653 HydrophobicContact CD1-CD2 4.05Å; I621-L661 HydrophobicContact CD1-CD1 4.4Å; I621-T673 CarbonylContact C-O 3.6Å; I621-T673 WeakPolarHBondContact CA-O 3.05Å; I621-F674 HydrophobicContact CG2-CD1 3.75Å; I621-F674 HydrophobicContact CG2-CE1 3.64Å; I621-F674 HydrophobicContact CG2-CG 4.35Å; I621-F674 HydrophobicContact CG2-CZ 4.16Å
622	N	95.5	Very high	92.5	Very high	34 Å²	34	57.2 Å²	57.2	18%	0.182	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	147	156.3	-64.7	-22.6	0	0	0	108.5	V645 A646 K647 T673	N622-V645 CarbonylContact C-O 3.49Å; N622-V645 VanDerWaalsContact CA-O 3.31Å; N622-V645 WeakPolarHBondContact CA-O 3.45Å; N622-A646 WeakPolarHBondContact OD1-CA 3.39Å; N622-K647 PolarHBondContact OD1-N 3.04Å; N622-T673 PolarHBondContact N-O 3.18Å; N622-T673 PolarHBondContact O-N 3.24Å
623	I	95.8	Very high	92.2	Very high	0 Å²	0	56.1 Å²	56.1	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	126.9	170.4	-59.9	156.3	0	0	0	107	I621 M642 Y644 V645 L661 L670 E671	I621-I623 HydrophobicContact CD1-CD1 3.72Å; I621-I623 HydrophobicContact CD1-CG1 3.96Å; I621-I623 HydrophobicContact CG1-CD1 4.41Å; I621-I623 HydrophobicContact CG1-CG1 4.39Å; I623-M642 HydrophobicContact CD1-CB 4.26Å; I623-M642 WeakPolarHBondContact CG2-O 3.27Å; I623-Y644 WeakPolarHBondContact O-CA 3.46Å; I623-V645 HydrophobicContact CB-CB 4.09Å; I623-V645 HydrophobicContact CD1-CB 3.98Å; I623-V645 HydrophobicContact CD1-CG1 4.34Å; I623-V645 HydrophobicContact CD1-CG2 4.27Å; I623-V645 HydrophobicContact CG1-CB 4.36Å; I623-V645 PolarHBondContact N-O 3.13Å; I623-V645 PolarHBondContact O-N 2.97Å; I623-L661 HydrophobicContact CD1-CD1 3.71Å; I623-L661 HydrophobicContact CD1-CD2 3.56Å; I623-L661 HydrophobicContact CD1-CG 4.28Å; I623-L661 HydrophobicContact CG1-CD2 4.28Å; I623-L661 HydrophobicContact CG2-CD2 4.32Å; I623-L670 HydrophobicContact CG2-CB 4.25Å; I623-L670 HydrophobicContact CG2-CD1 3.75Å; I623-L670 HydrophobicContact CG2-CD2 3.92Å; I623-L670 HydrophobicContact CG2-CG 4.19Å; I623-E671 WeakPolarHBondContact CA-O 3.3Å
624	R	94.3	Very high	91.9	Very high	121 Å²	121	53.7 Å²	53.7	46%	0.457	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	150.7	175	-76.7	-178.9	162.5	177.7	-9.2	111	L670 E671 T1309	R624-L670 CarbonylContact O-C 3.24Å; R624-L670 WeakPolarHBondContact O-CA 3.49Å; R624-E671 PolarHBondContact N-O 2.92Å; R624-E671 PolarHBondContact O-N 2.78Å; R624-T1309 PolarHBondContact NH2-OG1 3.26Å
625	P	94.7	Very high	91.3	Very high	13 Å²	13	53.7 Å²	53.7	8%	0.084	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	136.2	177.6	33.1	-27.6	0	0	0	111	M630 K643 Y644 L669 L670	P625-M630 HydrophobicContact CB-CG 4.05Å; P625-M630 HydrophobicContact CG-CG 3.81Å; P625-K643 HydrophobicContact CB-CG 4.02Å; P625-K643 VanDerWaalsContact CD-O 3.27Å; P625-K643 WeakPolarHBondContact CD-O 3.2Å; P625-K643 HydrophobicContact CG-CG 4.18Å; P625-Y644 VanDerWaalsContact CD-CE1 3.41Å; P625-Y644 HydrophobicContact CG-CD1 4.04Å; P625-Y644 HydrophobicContact CG-CD2 4.32Å; P625-Y644 HydrophobicContact CG-CE1 3.49Å; P625-Y644 VanDerWaalsContact CG-CE1 3.49Å; P625-Y644 HydrophobicContact CG-CE2 3.82Å; P625-Y644 HydrophobicContact CG-CG 4.43Å; P625-L669 WeakPolarHBondContact CA-O 3.38Å; P625-L670 HydrophobicContact CB-CD2 4.16Å
626	T	93.7	Very high	90.5	Very high	36 Å²	36	56.9 Å²	56.9	22%	0.221	28%	0.28	C	S	.	.			trans	-66.8	176.3	169.7	74.9	0	0	0	0	110.7	N628 G629 M630 K668 L669	T626-N628 PolarHBondContact O-N 3.32Å; T626-N628 PolarHBondContact OG1-N 2.73Å; T626-N628 VanDerWaalsContact OG1-N 3.11Å; T626-G629 PolarHBondContact O-N 3.49Å; T626-G629 PolarHBondContact OG1-N 3.43Å; T626-G629 VanDerWaalsContact OG1-N 3.12Å; T626-M630 WeakPolarHBondContact O-CB 2.97Å; T626-M630 WeakPolarHBondContact O-CG 3.28Å; T626-M630 PolarHBondContact O-N 2.98Å; T626-K668 WeakPolarHBondContact CB-O 3.17Å; T626-K668 VanDerWaalsContact CG2-O 3.29Å; T626-K668 WeakPolarHBondContact CG2-O 3.09Å; T626-K668 PolarHBondContact OG1-O 2.97Å; T626-L669 PolarHBondContact N-O 2.82Å; T626-L669 PolarHBondContact OG1-O 2.84Å
627	K	90	Very high	90.1	Very high	178 Å²	178	56.8 Å²	56.8	77%	0.774	28%	0.283	S	S	*	.	H	α-helix	trans	-54.8	-32.2	170.3	-66.9	173.1	-175.8	168	0	112.6	M630	K627-M630 HydrophobicContact CG-CE 4.41Å
628	N	90.9	Very high	89.9	Confident	90 Å²	90	55.3 Å²	55.3	48%	0.481	28%	0.28	S	S	.	.	H	α-helix	trans	-80.5	-49.2	178.6	-65.6	-0	0	0	0	110.8	T626 M630 V631 L632 L669	T626-N628 PolarHBondContact O-N 3.32Å; T626-N628 PolarHBondContact OG1-N 2.73Å; T626-N628 VanDerWaalsContact OG1-N 3.11Å; N628-M630 VanDerWaalsContact C-N 3.27Å; N628-M630 PolarHBondContact O-N 3.41Å; N628-V631 WeakPolarHBondContact O-CA 3.28Å; N628-V631 PolarHBondContact O-N 3.11Å; N628-L632 HydrophobicContact CB-CD1 4.47Å; N628-L632 PolarHBondContact O-N 3.3Å; N628-L669 HydrophobicContact CB-CD2 4.1Å
629	G	90.6	Very high	89.9	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-66	-26.5	179.3	0	0	0	0	0	114	T626 V631 I633 K643 L669	T626-G629 PolarHBondContact O-N 3.49Å; T626-G629 PolarHBondContact OG1-N 3.43Å; T626-G629 VanDerWaalsContact OG1-N 3.12Å; G629-V631 PolarHBondContact O-N 3.03Å; G629-I633 VanDerWaalsContact O-CB 3.28Å; G629-I633 WeakPolarHBondContact O-CB 3.44Å; G629-I633 WeakPolarHBondContact O-CG1 3.45Å; G629-I633 PolarHBondContact O-N 3.06Å; G629-K643 WeakPolarHBondContact O-CE 3.42Å; G629-K643 PolarHBondContact O-NZ 3.3Å; G629-L669 VanDerWaalsContact CA-O 3.28Å; G629-L669 WeakPolarHBondContact CA-O 3.42Å
630	M	89.2	Confident	89.7	Confident	56 Å²	56	54 Å²	54	28%	0.276	28%	0.275	S	S	.	.	H	α-helix	trans	-54.5	-38.4	168	-85.9	-163.8	-77	0	0	111.9	P625 T626 K627 N628 K643 D1313 V1317	P625-M630 HydrophobicContact CB-CG 4.05Å; P625-M630 HydrophobicContact CG-CG 3.81Å; T626-M630 WeakPolarHBondContact O-CB 2.97Å; T626-M630 WeakPolarHBondContact O-CG 3.28Å; T626-M630 PolarHBondContact O-N 2.98Å; K627-M630 HydrophobicContact CG-CE 4.41Å; N628-M630 VanDerWaalsContact C-N 3.27Å; N628-M630 PolarHBondContact O-N 3.41Å; M630-K643 PolarHBondContact O-NZ 3.47Å; M630-D1313 HydrophobicContact SD-CB 4.18Å; M630-V1317 HydrophobicContact CE-CG2 4.41Å; M630-V1317 HydrophobicContact SD-CG2 4.08Å
631	V	87.4	Confident	89.4	Confident	118 Å²	118	52.4 Å²	52.4	72%	0.715	27%	0.273	S	S	*	.	H	α-helix	trans	-88.2	-45.5	-179.9	-178.1	0	0	0	0	112.6	N628 G629	N628-V631 WeakPolarHBondContact O-CA 3.28Å; N628-V631 PolarHBondContact O-N 3.11Å; G629-V631 PolarHBondContact O-N 3.03Å
632	L	89.8	Confident	89.2	Confident	112 Å²	112	52.7 Å²	52.7	59%	0.586	28%	0.275	S	S	*	.	H	α-helix	trans	-88.3	-26.8	-167.9	-64.2	174.5	0	0	0	114.7	N628 D634 L669	N628-L632 HydrophobicContact CB-CD1 4.47Å; N628-L632 PolarHBondContact O-N 3.3Å; L632-D634 PolarHBondContact O-N 2.8Å; L632-L669 HydrophobicContact CB-CD2 4.15Å; L632-L669 HydrophobicContact CD1-CD2 3.75Å
633	I	89.4	Confident	89.1	Confident	3 Å²	3	52 Å²	52	2%	0.015	27%	0.27	C	S	.	.			trans	-77.6	89.8	176.9	-56.7	168.2	0	0	0	108.6	G629 V639 Y640 K643 L669 L670	G629-I633 VanDerWaalsContact O-CB 3.28Å; G629-I633 WeakPolarHBondContact O-CB 3.44Å; G629-I633 WeakPolarHBondContact O-CG1 3.45Å; G629-I633 PolarHBondContact O-N 3.06Å; I633-V639 HydrophobicContact CD1-CG2 4.13Å; I633-V639 HydrophobicContact CG1-CG2 4.32Å; I633-V639 HydrophobicContact CG2-CG2 4.14Å; I633-Y640 HydrophobicContact CG2-CD2 4.44Å; I633-K643 HydrophobicContact CB-CD 3.92Å; I633-K643 HydrophobicContact CB-CG 4.4Å; I633-K643 HydrophobicContact CD1-CG 4.23Å; I633-K643 HydrophobicContact CG2-CB 4.29Å; I633-K643 HydrophobicContact CG2-CD 3.79Å; I633-K643 HydrophobicContact CG2-CG 4.12Å; I633-K643 PolarHBondContact O-NZ 2.91Å; I633-L669 HydrophobicContact CD1-CB 4.02Å; I633-L669 HydrophobicContact CG1-CB 4.21Å; I633-L669 HydrophobicContact CG1-CD1 4.37Å; I633-L670 HydrophobicContact CD1-CD1 4.45Å; I633-L670 HydrophobicContact CD1-CD2 3.38Å; I633-L670 HydrophobicContact CD1-CG 3.76Å
634	D	84.3	Confident	89	Confident	71 Å²	71	52.2 Å²	52.2	38%	0.38	27%	0.271	S	S	.	.			trans	-88.5	-172	174.4	90.4	-34.3	0	0	0	111.9	L632 N636 S637 Y640	L632-D634 PolarHBondContact O-N 2.8Å; D634-N636 VanDerWaalsContact C-N 3.27Å; D634-N636 PolarHBondContact O-N 2.73Å; D634-N636 WeakPolarHBondContact OD1-CA 3.39Å; D634-N636 WeakPolarHBondContact OD1-CB 3.29Å; D634-N636 PolarHBondContact OD1-N 2.92Å; D634-N636 PolarHBondContact OD2-N 3.48Å; D634-N636 PolarHBondContact OD2-ND2 3.37Å; D634-S637 PolarHBondContact O-N 3.02Å; D634-S637 PolarHBondContact OD1-N 3.42Å; D634-Y640 VanDerWaalsContact C-CD2 3.47Å; D634-Y640 VanDerWaalsContact O-CB 3.25Å; D634-Y640 WeakPolarHBondContact O-CB 3.39Å; D634-Y640 WeakPolarHBondContact O-CD2 3.36Å; D634-Y640 VanDerWaalsContact O-CG 3.28Å
635	E	79.5	Confident	88.9	Confident	24 Å²	24	46.6 Å²	46.6	11%	0.112	25%	0.25	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-8.1	179.7	64.7	-174.5	-119.7	0	0	115.6	Y640 R1270 R1298	E635-Y640 HydrophobicContact CB-CD1 4.49Å; E635-Y640 HydrophobicContact CB-CE1 4.28Å; E635-R1270 IonicContact OE1-CZ 2.73Å; E635-R1270 IonicContact OE1-NH1 3.23Å; E635-R1270 PolarHBondContact OE1-NH1 3.36Å; E635-R1270 IonicContact OE1-NH2 3.46Å; E635-R1270 PolarHBondContact OE1-NH2 3.22Å; E635-R1270 IonicContact OE2-NH2 2.63Å; E635-R1298 IonicContact OE2-CZ 3.45Å; E635-R1298 IonicContact OE2-NH1 2.67Å; E635-R1298 PolarHBondContact OE2-NH1 2.97Å; E635-R1298 IonicContact OE2-NH2 2.79Å; E635-R1298 PolarHBondContact OE2-NH2 3.01Å
636	N	78.5	Confident	88.8	Confident	66 Å²	66	47.5 Å²	47.5	35%	0.353	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.3	-21.2	174.5	-61.6	-78.7	0	0	0	112.1	D634 K1167	D634-N636 VanDerWaalsContact C-N 3.27Å; D634-N636 PolarHBondContact O-N 2.73Å; D634-N636 WeakPolarHBondContact OD1-CA 3.39Å; D634-N636 WeakPolarHBondContact OD1-CB 3.29Å; D634-N636 PolarHBondContact OD1-N 2.92Å; D634-N636 PolarHBondContact OD2-N 3.48Å; D634-N636 PolarHBondContact OD2-ND2 3.37Å; N636-K1167 WeakPolarHBondContact OD1-CE 3.37Å
637	S	85.6	Confident	88.8	Confident	26 Å²	26	51.5 Å²	51.5	18%	0.182	27%	0.273	C	S	.	.	S	Bend	trans	-60.7	132.2	176.9	-178.7	0	0	0	0	112.1	D634 V639 Y640	D634-S637 PolarHBondContact O-N 3.02Å; D634-S637 PolarHBondContact OD1-N 3.42Å; S637-V639 PolarHBondContact O-N 2.84Å; S637-V639 VanDerWaalsContact O-N 3.1Å; S637-V639 WeakPolarHBondContact OG-CG2 3.49Å; S637-Y640 VanDerWaalsContact O-CB 3.25Å; S637-Y640 WeakPolarHBondContact O-CB 3.42Å; S637-Y640 PolarHBondContact O-N 3.29Å
638	P	85	Confident	88.9	Confident	89 Å²	89	43.2 Å²	43.2	58%	0.578	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-17.6	-176.6	26.9	-35.6	0	0	0	113.8	K660	P638-K660 HydrophobicContact CB-CD 4.35Å
639	V	90.6	Very high	89.1	Confident	3 Å²	3	40 Å²	40	2%	0.018	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.1	4.5	176.6	-63.1	0	0	0	0	113.7	I633 S637 S641 M642 K643 K660 L661 A664 L670	I633-V639 HydrophobicContact CD1-CG2 4.13Å; I633-V639 HydrophobicContact CG1-CG2 4.32Å; I633-V639 HydrophobicContact CG2-CG2 4.14Å; S637-V639 PolarHBondContact O-N 2.84Å; S637-V639 VanDerWaalsContact O-N 3.1Å; S637-V639 WeakPolarHBondContact OG-CG2 3.49Å; V639-S641 VanDerWaalsContact C-N 3.3Å; V639-S641 PolarHBondContact O-N 3.48Å; V639-M642 HydrophobicContact CG1-CE 4.29Å; V639-M642 CarbonylContact O-C 3.57Å; V639-M642 WeakPolarHBondContact O-CA 3.48Å; V639-M642 PolarHBondContact O-N 2.86Å; V639-K643 PolarHBondContact O-N 3.08Å; V639-K660 HydrophobicContact CG1-CB 4.2Å; V639-K660 WeakPolarHBondContact CG1-O 3.11Å; V639-L661 HydrophobicContact CG1-CD2 4.13Å; V639-A664 HydrophobicContact CG1-CB 4.2Å; V639-A664 HydrophobicContact CG2-CB 4.03Å; V639-L670 HydrophobicContact CB-CD1 3.91Å; V639-L670 HydrophobicContact CG1-CD1 4.28Å; V639-L670 HydrophobicContact CG2-CD1 3.86Å
640	Y	89.1	Confident	89.2	Confident	30 Å²	30	40 Å²	40	12%	0.118	22%	0.221	C	C	.	.	G	3₁₀ helix	trans	-54.4	-42.6	-179.4	179	-108.5	0	0	0	113.8	I633 D634 E635 S637 M642 K643 R1298 P1299	I633-Y640 HydrophobicContact CG2-CD2 4.44Å; D634-Y640 VanDerWaalsContact C-CD2 3.47Å; D634-Y640 VanDerWaalsContact O-CB 3.25Å; D634-Y640 WeakPolarHBondContact O-CB 3.39Å; D634-Y640 WeakPolarHBondContact O-CD2 3.36Å; D634-Y640 VanDerWaalsContact O-CG 3.28Å; E635-Y640 HydrophobicContact CB-CD1 4.49Å; E635-Y640 HydrophobicContact CB-CE1 4.28Å; S637-Y640 VanDerWaalsContact O-CB 3.25Å; S637-Y640 WeakPolarHBondContact O-CB 3.42Å; S637-Y640 PolarHBondContact O-N 3.29Å; Y640-M642 PolarHBondContact O-N 3.31Å; Y640-K643 WeakPolarHBondContact O-CB 3.2Å; Y640-K643 PolarHBondContact O-N 2.97Å; Y640-R1298 PolarHBondContact OH-NH1 2.93Å; Y640-R1298 VanDerWaalsContact OH-NH1 3.08Å; Y640-P1299 HydrophobicContact CD1-CB 4.45Å; Y640-P1299 HydrophobicContact CD1-CG 4.42Å
641	S	89.2	Confident	89.3	Confident	30 Å²	30	40 Å²	40	21%	0.21	23%	0.227	C	C	.	.	G	3₁₀ helix	trans	-64.8	-19.3	176.9	51.7	0	0	0	0	113.3	V639 R1300 D1302 Y1305	V639-S641 VanDerWaalsContact C-N 3.3Å; V639-S641 PolarHBondContact O-N 3.48Å; S641-R1300 WeakPolarHBondContact CB-O 3.38Å; S641-D1302 WeakPolarHBondContact O-CB 3.5Å; S641-D1302 PolarHBondContact O-N 3.28Å; S641-Y1305 VanDerWaalsContact O-CD2 3.27Å; S641-Y1305 WeakPolarHBondContact O-CD2 3.47Å
642	M	90.7	Very high	89.5	Confident	6 Å²	6	37.8 Å²	37.8	3%	0.03	21%	0.211	C	C	.	.	G	3₁₀ helix	trans	-113.6	6	-177.4	-59.8	-175	-69.2	0	0	113.2	I623 V639 Y640 Y644 V645 Q657 L661 D1302	I623-M642 HydrophobicContact CD1-CB 4.26Å; I623-M642 WeakPolarHBondContact CG2-O 3.27Å; V639-M642 HydrophobicContact CG1-CE 4.29Å; V639-M642 CarbonylContact O-C 3.57Å; V639-M642 WeakPolarHBondContact O-CA 3.48Å; V639-M642 PolarHBondContact O-N 2.86Å; Y640-M642 PolarHBondContact O-N 3.31Å; M642-Y644 VanDerWaalsContact C-N 3.26Å; M642-Y644 PolarHBondContact O-N 3.1Å; M642-Y644 VanDerWaalsContact O-N 3.12Å; M642-V645 HydrophobicContact CB-CG2 4.07Å; M642-V645 WeakPolarHBondContact O-CG2 3.45Å; M642-Q657 HydrophobicContact CE-CB 4.46Å; M642-Q657 HydrophobicContact CE-CG 4.32Å; M642-Q657 HydrophobicContact SD-CG 4.4Å; M642-L661 HydrophobicContact CB-CD2 4.19Å; M642-L661 HydrophobicContact CE-CD1 4.24Å; M642-L661 HydrophobicContact CE-CD2 3.86Å; M642-L661 HydrophobicContact CE-CG 3.91Å; M642-L661 HydrophobicContact SD-CD1 4.14Å; M642-L661 HydrophobicContact SD-CD2 4.31Å; M642-L661 HydrophobicContact SD-CG 4.42Å; M642-D1302 HydrophobicContact CG-CB 4.41Å
643	K	92.5	Very high	89.6	Confident	19 Å²	19	32.6 Å²	32.6	8%	0.083	18%	0.183	C	C	.	.	S	Bend	trans	-54.6	-33.5	-172.8	-172.8	176	-172.7	166.4	0	115	P625 G629 M630 I633 V639 Y640 Y1305	P625-K643 HydrophobicContact CB-CG 4.02Å; P625-K643 VanDerWaalsContact CD-O 3.27Å; P625-K643 WeakPolarHBondContact CD-O 3.2Å; P625-K643 HydrophobicContact CG-CG 4.18Å; G629-K643 WeakPolarHBondContact O-CE 3.42Å; G629-K643 PolarHBondContact O-NZ 3.3Å; M630-K643 PolarHBondContact O-NZ 3.47Å; I633-K643 HydrophobicContact CB-CD 3.92Å; I633-K643 HydrophobicContact CB-CG 4.4Å; I633-K643 HydrophobicContact CD1-CG 4.23Å; I633-K643 HydrophobicContact CG2-CB 4.29Å; I633-K643 HydrophobicContact CG2-CD 3.79Å; I633-K643 HydrophobicContact CG2-CG 4.12Å; I633-K643 PolarHBondContact O-NZ 2.91Å; V639-K643 PolarHBondContact O-N 3.08Å; Y640-K643 WeakPolarHBondContact O-CB 3.2Å; Y640-K643 PolarHBondContact O-N 2.97Å; K643-Y1305 HydrophobicContact CB-CE2 4.5Å
644	Y	93.4	Very high	89.6	Confident	6 Å²	6	34 Å²	34	2%	0.024	19%	0.189	C	C	.	.	S	Bend	trans	-132.8	100.1	170.8	-66.9	-92.5	0	0	0	107.6	I623 P625 M642 Y1305 D1306 T1309 E1310 D1313	I623-Y644 WeakPolarHBondContact O-CA 3.46Å; P625-Y644 VanDerWaalsContact CD-CE1 3.41Å; P625-Y644 HydrophobicContact CG-CD1 4.04Å; P625-Y644 HydrophobicContact CG-CD2 4.32Å; P625-Y644 HydrophobicContact CG-CE1 3.49Å; P625-Y644 VanDerWaalsContact CG-CE1 3.49Å; P625-Y644 HydrophobicContact CG-CE2 3.82Å; P625-Y644 HydrophobicContact CG-CG 4.43Å; M642-Y644 VanDerWaalsContact C-N 3.26Å; M642-Y644 PolarHBondContact O-N 3.1Å; M642-Y644 VanDerWaalsContact O-N 3.12Å; Y644-Y1305 HydrophobicContact CD2-CE1 4.3Å; Y644-Y1305 CarbonylContact O-C 3.39Å; Y644-Y1305 WeakPolarHBondContact O-CA 3.47Å; Y644-Y1305 VanDerWaalsContact O-CD2 3.3Å; Y644-Y1305 WeakPolarHBondContact O-CD2 3.42Å; Y644-Y1305 VanDerWaalsContact O-CG 3.27Å; Y644-D1306 PolarHBondContact O-N 3.35Å; Y644-T1309 HydrophobicContact CD1-CG2 3.84Å; Y644-T1309 HydrophobicContact CE1-CG2 3.94Å; Y644-E1310 HydrophobicContact CD1-CB 4.32Å; Y644-E1310 HydrophobicContact CD2-CB 3.74Å; Y644-E1310 HydrophobicContact CD2-CG 3.97Å; Y644-E1310 HydrophobicContact CE1-CB 4.32Å; Y644-E1310 HydrophobicContact CE2-CB 3.74Å; Y644-E1310 HydrophobicContact CE2-CG 3.63Å; Y644-E1310 HydrophobicContact CG-CB 4.03Å; Y644-D1313 HydrophobicContact CE1-CB 4.49Å
645	V	93.6	Very high	89.8	Confident	3 Å²	3	30.6 Å²	30.6	2%	0.018	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	137	176.8	166.7	0	0	0	0	108.9	N622 I623 M642 K648 D1302 Y1304	N622-V645 CarbonylContact C-O 3.49Å; N622-V645 VanDerWaalsContact CA-O 3.31Å; N622-V645 WeakPolarHBondContact CA-O 3.45Å; I623-V645 HydrophobicContact CB-CB 4.09Å; I623-V645 HydrophobicContact CD1-CB 3.98Å; I623-V645 HydrophobicContact CD1-CG1 4.34Å; I623-V645 HydrophobicContact CD1-CG2 4.27Å; I623-V645 HydrophobicContact CG1-CB 4.36Å; I623-V645 PolarHBondContact N-O 3.13Å; I623-V645 PolarHBondContact O-N 2.97Å; M642-V645 HydrophobicContact CB-CG2 4.07Å; M642-V645 WeakPolarHBondContact O-CG2 3.45Å; V645-K648 HydrophobicContact CG1-CB 3.4Å; V645-K648 VanDerWaalsContact CG1-CB 3.4Å; V645-K648 HydrophobicContact CG1-CD 4.13Å; V645-K648 HydrophobicContact CG1-CG 4.37Å; V645-D1302 HydrophobicContact CG2-CB 4.03Å; V645-Y1304 WeakPolarHBondContact CA-O 3.49Å
646	A	92.8	Very high	90.4	Very high	31 Å²	31	29.8 Å²	29.8	26%	0.256	17%	0.168	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	129.3	178.1	0	0	0	0	0	111.3	N622 K648 Y1304 D1306	N622-A646 WeakPolarHBondContact OD1-CA 3.39Å; A646-K648 VanDerWaalsContact C-N 3.26Å; A646-K648 PolarHBondContact O-N 2.7Å; A646-Y1304 PolarHBondContact N-O 3.08Å; A646-D1306 HydrophobicContact CB-CB 3.89Å
647	K	91.7	Very high	91	Very high	120 Å²	120	28.9 Å²	28.9	52%	0.522	16%	0.162	S	C	.	.	E	Extended strand (participates in β ladder)	trans	57.6	29.8	175.2	-48.4	-155.1	172.7	-160.4	0	114.8	R620 I621 N622 L675	R620-K647 WeakPolarHBondContact CD-O 3.46Å; I621-K647 PolarHBondContact O-N 2.7Å; I621-K647 VanDerWaalsContact O-N 3.16Å; N622-K647 PolarHBondContact OD1-N 3.04Å; K647-L675 HydrophobicContact CD-CD1 4.33Å; K647-L675 HydrophobicContact CG-CD1 4.02Å
648	K	93.4	Very high	91.5	Very high	4 Å²	4	27.9 Å²	27.9	2%	0.017	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	124.7	174.8	173.1	167.6	-179.4	173	0	109.8	R620 I621 V645 A646 V650 D652 D1302 Y1304	R620-K648 CarbonylContact C-O 3.57Å; R620-K648 WeakPolarHBondContact CA-O 3.34Å; I621-K648 HydrophobicContact CG1-CB 4.25Å; I621-K648 PolarHBondContact N-O 2.78Å; I621-K648 PolarHBondContact O-N 3.5Å; I621-K648 VanDerWaalsContact O-N 3.07Å; V645-K648 HydrophobicContact CG1-CB 3.4Å; V645-K648 VanDerWaalsContact CG1-CB 3.4Å; V645-K648 HydrophobicContact CG1-CD 4.13Å; V645-K648 HydrophobicContact CG1-CG 4.37Å; A646-K648 VanDerWaalsContact C-N 3.26Å; A646-K648 PolarHBondContact O-N 2.7Å; K648-V650 PolarHBondContact O-N 3.36Å; K648-D652 WeakPolarHBondContact CE-O 3.45Å; K648-D652 HydrophobicContact CG-CB 4.37Å; K648-D652 PolarHBondContact NZ-O 3.19Å; K648-D1302 IonicContact NZ-OD2 3.2Å; K648-D1302 PolarHBondContact NZ-OD2 2.79Å; K648-Y1304 HydrophobicContact CB-CD2 3.86Å; K648-Y1304 HydrophobicContact CB-CG 3.83Å; K648-Y1304 HydrophobicContact CD-CD2 4.18Å; K648-Y1304 HydrophobicContact CG-CD2 3.72Å; K648-Y1304 HydrophobicContact CG-CE2 4.28Å; K648-Y1304 HydrophobicContact CG-CG 4.23Å
649	P	93.9	Very high	91.9	Very high	22 Å²	22	23.8 Å²	23.8	14%	0.143	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-56.2	136.6	170.6	-23.6	34.8	0	0	0	110.8	S651 D652 Y1304	P649-S651 PolarHBondContact O-N 2.98Å; P649-D652 WeakPolarHBondContact CD-OD2 3.4Å; P649-D652 WeakPolarHBondContact CG-OD2 3.5Å; P649-D652 PolarHBondContact O-N 3.08Å; P649-Y1304 HydrophobicContact CG-CE1 4.37Å
650	V	93.3	Very high	92	Very high	1 Å²	1	25.5 Å²	25.5	1%	0.006	13%	0.134	C	C	.	.	G	3₁₀ helix	trans	-57.8	-32.7	175.7	165.5	0	0	0	0	111.4	V327 A619 I621 K648 D652 L653 F674 L735 L739	V327-V650 HydrophobicContact CG1-CG1 3.84Å; A619-V650 HydrophobicContact CB-CB 4.29Å; A619-V650 HydrophobicContact CB-CG2 3.75Å; A619-V650 WeakPolarHBondContact O-CG2 3.49Å; A619-V650 PolarHBondContact O-N 3.38Å; I621-V650 HydrophobicContact CG2-CG2 3.77Å; K648-V650 PolarHBondContact O-N 3.36Å; V650-D652 PolarHBondContact O-N 3.27Å; V650-L653 HydrophobicContact CG1-CD1 4.4Å; V650-L653 VanDerWaalsContact O-CB 3.29Å; V650-L653 WeakPolarHBondContact O-CB 3.12Å; V650-L653 WeakPolarHBondContact O-CG 3.37Å; V650-L653 PolarHBondContact O-N 3.41Å; V650-L653 VanDerWaalsContact O-N 3.08Å; V650-F674 HydrophobicContact CG2-CD1 4.42Å; V650-F674 HydrophobicContact CG2-CE1 4.07Å; V650-L735 HydrophobicContact CG1-CD1 4.31Å; V650-L735 HydrophobicContact CG2-CD2 4.38Å; V650-L739 HydrophobicContact CG1-CD1 3.54Å; V650-L739 HydrophobicContact CG1-CD2 3.39Å; V650-L739 HydrophobicContact CG1-CG 4Å; V650-L739 HydrophobicContact CG2-CD1 4.38Å
651	S	91.4	Very high	92.3	Very high	57 Å²	57	24 Å²	24	40%	0.399	13%	0.129	S	C	.	.	G	3₁₀ helix	trans	-67.4	-13.9	175.8	44	0	0	0	0	115.6	V327 P649	V327-S651 WeakPolarHBondContact O-CA 3.42Å; V327-S651 WeakPolarHBondContact O-CB 3.35Å; P649-S651 PolarHBondContact O-N 2.98Å
652	D	91.5	Very high	92.6	Very high	70 Å²	70	23.6 Å²	23.6	37%	0.374	12%	0.124	S	C	.	.	G	3₁₀ helix	trans	-93.7	6.3	171.6	-69.4	-42.8	0	0	0	113	K648 P649 V650 Y1304	K648-D652 WeakPolarHBondContact CE-O 3.45Å; K648-D652 HydrophobicContact CG-CB 4.37Å; K648-D652 PolarHBondContact NZ-O 3.19Å; P649-D652 WeakPolarHBondContact CD-OD2 3.4Å; P649-D652 WeakPolarHBondContact CG-OD2 3.5Å; P649-D652 PolarHBondContact O-N 3.08Å; V650-D652 PolarHBondContact O-N 3.27Å; D652-Y1304 HydrophobicContact CB-CE2 4.28Å; D652-Y1304 VanDerWaalsContact OD2-CE2 3.3Å; D652-Y1304 WeakPolarHBondContact OD2-CE2 3.43Å; D652-Y1304 PolarHBondContact OD2-OH 3.04Å
653	L	91.8	Very high	92.7	Very high	3 Å²	3	25.1 Å²	25.1	2%	0.016	13%	0.131	C	C	.	.			trans	-74.6	136.2	163.8	-65.2	171.3	0	0	0	109.2	S328 E329 I621 V650 F658 L661 L739	S328-L653 WeakPolarHBondContact CB-O 3.41Å; E329-L653 PolarHBondContact N-O 2.73Å; I621-L653 HydrophobicContact CD1-CD1 4.45Å; I621-L653 HydrophobicContact CD1-CD2 4.05Å; V650-L653 HydrophobicContact CG1-CD1 4.4Å; V650-L653 VanDerWaalsContact O-CB 3.29Å; V650-L653 WeakPolarHBondContact O-CB 3.12Å; V650-L653 WeakPolarHBondContact O-CG 3.37Å; V650-L653 PolarHBondContact O-N 3.41Å; V650-L653 VanDerWaalsContact O-N 3.08Å; L653-F658 HydrophobicContact CD1-CD2 3.88Å; L653-L661 HydrophobicContact CD2-CD1 4.17Å; L653-L739 HydrophobicContact CD1-CD1 4.32Å; L653-L739 HydrophobicContact CD1-CD2 4.46Å
654	F	90.8	Very high	92.8	Very high	32 Å²	32	24.4 Å²	24.4	14%	0.14	13%	0.129	C	C	.	.	B	Isolated β-bridge	trans	-125.8	129.6	-176.6	178.8	-86.6	0	0	0	112.2	E329 D656 Q657	E329-F654 HydrophobicContact CB-CD2 4.09Å; E329-F654 HydrophobicContact CG-CD2 3.88Å; E329-F654 HydrophobicContact CG-CE2 4.35Å; E329-F654 WeakPolarHBondContact O-CA 3.24Å; E329-F654 WeakPolarHBondContact O-CD2 3.5Å; F654-D656 PolarHBondContact O-N 3.1Å; F654-Q657 VanDerWaalsContact N-OE1 3.13Å; F654-Q657 WeakPolarHBondContact O-CB 3.16Å; F654-Q657 WeakPolarHBondContact O-CG 3.48Å; F654-Q657 PolarHBondContact O-N 3.03Å
655	G	88.4	Confident	92.9	Very high	1 Å²	1	26.3 Å²	26.3	1%	0.01	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.1	-126.5	171.8	0	0	0	0	0	113.6	E329 Q330 Q657 A743	E329-G655 PolarHBondContact O-N 2.72Å; Q330-G655 PolarHBondContact NE2-O 2.85Å; Q330-G655 VanDerWaalsContact OE1-CA 3.28Å; G655-Q657 VanDerWaalsContact C-N 3.28Å; G655-Q657 PolarHBondContact O-N 3.35Å; G655-A743 WeakPolarHBondContact O-CB 3.27Å
656	D	90.2	Very high	93	Very high	7 Å²	7	30.7 Å²	30.7	4%	0.037	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.9	6.4	-177.6	75.7	-10.8	0	0	0	115.4	F654 F658 I659 K660 F746 V747 H947 L949	F654-D656 PolarHBondContact O-N 3.1Å; D656-F658 VanDerWaalsContact C-N 3.25Å; D656-F658 PolarHBondContact O-N 3.22Å; D656-I659 PolarHBondContact O-N 3.5Å; D656-K660 VanDerWaalsContact CG-CE 3.49Å; D656-K660 PolarHBondContact O-N 2.71Å; D656-K660 WeakPolarHBondContact OD1-CE 3.38Å; D656-K660 IonicContact OD1-NZ 3.11Å; D656-K660 PolarHBondContact OD1-NZ 2.87Å; D656-K660 WeakPolarHBondContact OD2-CE 3.39Å; D656-K660 IonicContact OD2-NZ 2.72Å; D656-K660 PolarHBondContact OD2-NZ 3.13Å; D656-F746 HydrophobicContact CB-CD1 4.14Å; D656-F746 HydrophobicContact CB-CE1 4.36Å; D656-V747 HydrophobicContact CB-CG2 4.22Å; D656-H947 IonicContact OD2-CE1 3.78Å; D656-H947 IonicContact OD2-NE2 3.52Å; D656-L949 HydrophobicContact CB-CD1 4Å
657	Q	92.3	Very high	93	Very high	47 Å²	47	34.3 Å²	34.3	22%	0.22	17%	0.17	C	C	.	.	H	α-helix	trans	-55.2	-38.7	179.7	-80.4	175.9	14	0	0	112.9	M642 F654 G655 K660 L661	M642-Q657 HydrophobicContact CE-CB 4.46Å; M642-Q657 HydrophobicContact CE-CG 4.32Å; M642-Q657 HydrophobicContact SD-CG 4.4Å; F654-Q657 VanDerWaalsContact N-OE1 3.13Å; F654-Q657 WeakPolarHBondContact O-CB 3.16Å; F654-Q657 WeakPolarHBondContact O-CG 3.48Å; F654-Q657 PolarHBondContact O-N 3.03Å; G655-Q657 VanDerWaalsContact C-N 3.28Å; G655-Q657 PolarHBondContact O-N 3.35Å; Q657-K660 PolarHBondContact O-N 2.98Å; Q657-L661 VanDerWaalsContact O-CG 3.3Å; Q657-L661 WeakPolarHBondContact O-CG 3.22Å; Q657-L661 PolarHBondContact O-N 3.21Å; Q657-L661 VanDerWaalsContact O-N 3.08Å
658	F	95	Very high	93.1	Very high	4 Å²	4	36 Å²	36	2%	0.018	18%	0.177	C	C	.	.	H	α-helix	trans	-71.2	-39.9	-175.6	-164.9	-113.8	0	0	0	112.4	L653 D656 K660 L661 M662 F674 R736 L739 H740 A743	L653-F658 HydrophobicContact CD1-CD2 3.88Å; D656-F658 VanDerWaalsContact C-N 3.25Å; D656-F658 PolarHBondContact O-N 3.22Å; F658-K660 PolarHBondContact O-N 3.2Å; F658-L661 PolarHBondContact O-N 3.49Å; F658-M662 HydrophobicContact CD1-CG 4.36Å; F658-M662 HydrophobicContact CD1-SD 3.72Å; F658-M662 HydrophobicContact CE1-CG 4.12Å; F658-M662 HydrophobicContact CE1-SD 3.41Å; F658-M662 WeakPolarHBondContact CE1-SD 3.22Å; F658-M662 HydrophobicContact CZ-CG 4.38Å; F658-M662 HydrophobicContact CZ-SD 4.17Å; F658-M662 WeakPolarHBondContact O-CG 3.42Å; F658-M662 PolarHBondContact O-N 2.86Å; F658-F674 AromaticContact CE2-CZ 3.91Å; F658-F674 HydrophobicContact CE2-CZ 3.91Å; F658-F674 HydrophobicContact CZ-CE2 4.36Å; F658-F674 AromaticContact CZ-CZ 3.88Å; F658-F674 HydrophobicContact CZ-CZ 3.88Å; F658-R736 HydrophobicContact CE1-CG 4.3Å; F658-R736 HydrophobicContact CZ-CG 4.12Å; F658-L739 HydrophobicContact CD1-CB 3.58Å; F658-L739 HydrophobicContact CD2-CB 4.39Å; F658-L739 HydrophobicContact CE1-CB 3.59Å; F658-L739 HydrophobicContact CE2-CB 4.42Å; F658-L739 HydrophobicContact CE2-CD1 4.2Å; F658-L739 HydrophobicContact CG-CB 4Å; F658-L739 HydrophobicContact CZ-CB 4.04Å; F658-L739 HydrophobicContact CZ-CD1 4.22Å; F658-H740 HydrophobicContact CD1-CB 4.4Å; F658-H740 HydrophobicContact CE1-CB 4.32Å; F658-A743 HydrophobicContact CB-CB 4.31Å
659	I	94.4	Very high	93.1	Very high	3 Å²	3	36.6 Å²	36.6	2%	0.015	18%	0.18	C	C	.	.	H	α-helix	trans	-61	-45	172.6	-66.3	167.4	0	0	0	110.2	D656 L661 M662 M663 A743 Q744 V747 L949 R952	D656-I659 PolarHBondContact O-N 3.5Å; I659-L661 PolarHBondContact O-N 2.9Å; I659-M662 PolarHBondContact O-N 2.92Å; I659-M663 HydrophobicContact CG2-CG 4.31Å; I659-M663 HydrophobicContact CG2-SD 4.05Å; I659-M663 VanDerWaalsContact O-CG 3.3Å; I659-M663 WeakPolarHBondContact O-CG 3.39Å; I659-M663 PolarHBondContact O-N 2.62Å; I659-A743 HydrophobicContact CD1-CB 3.8Å; I659-A743 HydrophobicContact CG1-CB 3.79Å; I659-Q744 HydrophobicContact CD1-CG 3.93Å; I659-V747 HydrophobicContact CD1-CG2 4.06Å; I659-L949 HydrophobicContact CB-CD1 4.35Å; I659-L949 HydrophobicContact CG2-CD1 3.95Å; I659-R952 HydrophobicContact CG2-CB 3.81Å; I659-R952 HydrophobicContact CG2-CG 4.08Å
660	K	93.6	Very high	93.2	Very high	39 Å²	39	35.7 Å²	35.7	17%	0.17	18%	0.175	C	C	.	.	H	α-helix	trans	-59.6	-33.8	176.8	-73.1	167.1	174.8	158.5	0	113.1	P638 V639 D656 Q657 F658 A664 L949	P638-K660 HydrophobicContact CB-CD 4.35Å; V639-K660 HydrophobicContact CG1-CB 4.2Å; V639-K660 WeakPolarHBondContact CG1-O 3.11Å; D656-K660 VanDerWaalsContact CG-CE 3.49Å; D656-K660 PolarHBondContact O-N 2.71Å; D656-K660 WeakPolarHBondContact OD1-CE 3.38Å; D656-K660 IonicContact OD1-NZ 3.11Å; D656-K660 PolarHBondContact OD1-NZ 2.87Å; D656-K660 WeakPolarHBondContact OD2-CE 3.39Å; D656-K660 IonicContact OD2-NZ 2.72Å; D656-K660 PolarHBondContact OD2-NZ 3.13Å; Q657-K660 PolarHBondContact O-N 2.98Å; F658-K660 PolarHBondContact O-N 3.2Å; K660-A664 PolarHBondContact O-N 2.83Å; K660-L949 HydrophobicContact CG-CD1 3.97Å
661	L	95.2	Very high	93.3	Very high	0 Å²	0	41 Å²	41	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-74.2	-43.8	175.1	-70.1	166.8	0	0	0	111.7	I621 I623 V639 M642 L653 Q657 F658 I659 A664 E665 L670 I672	I621-L661 HydrophobicContact CD1-CD1 4.4Å; I623-L661 HydrophobicContact CD1-CD1 3.71Å; I623-L661 HydrophobicContact CD1-CD2 3.56Å; I623-L661 HydrophobicContact CD1-CG 4.28Å; I623-L661 HydrophobicContact CG1-CD2 4.28Å; I623-L661 HydrophobicContact CG2-CD2 4.32Å; V639-L661 HydrophobicContact CG1-CD2 4.13Å; M642-L661 HydrophobicContact CB-CD2 4.19Å; M642-L661 HydrophobicContact CE-CD1 4.24Å; M642-L661 HydrophobicContact CE-CD2 3.86Å; M642-L661 HydrophobicContact CE-CG 3.91Å; M642-L661 HydrophobicContact SD-CD1 4.14Å; M642-L661 HydrophobicContact SD-CD2 4.31Å; M642-L661 HydrophobicContact SD-CG 4.42Å; L653-L661 HydrophobicContact CD2-CD1 4.17Å; Q657-L661 VanDerWaalsContact O-CG 3.3Å; Q657-L661 WeakPolarHBondContact O-CG 3.22Å; Q657-L661 PolarHBondContact O-N 3.21Å; Q657-L661 VanDerWaalsContact O-N 3.08Å; F658-L661 PolarHBondContact O-N 3.49Å; I659-L661 PolarHBondContact O-N 2.9Å; L661-A664 PolarHBondContact O-N 3.02Å; L661-E665 PolarHBondContact O-N 2.8Å; L661-L670 HydrophobicContact CD2-CD1 3.84Å; L661-I672 HydrophobicContact CB-CD1 3.78Å
662	M	94.1	Very high	93.5	Very high	21 Å²	21	39 Å²	39	10%	0.103	18%	0.184	C	C	.	.	H	α-helix	trans	-60.4	-45.1	175.5	-74.1	178.2	52.3	0	0	111.9	F658 I659 A664 E665 E666 H740	F658-M662 HydrophobicContact CD1-CG 4.36Å; F658-M662 HydrophobicContact CD1-SD 3.72Å; F658-M662 HydrophobicContact CE1-CG 4.12Å; F658-M662 HydrophobicContact CE1-SD 3.41Å; F658-M662 WeakPolarHBondContact CE1-SD 3.22Å; F658-M662 HydrophobicContact CZ-CG 4.38Å; F658-M662 HydrophobicContact CZ-SD 4.17Å; F658-M662 WeakPolarHBondContact O-CG 3.42Å; F658-M662 PolarHBondContact O-N 2.86Å; I659-M662 PolarHBondContact O-N 2.92Å; M662-A664 VanDerWaalsContact C-N 3.3Å; M662-A664 PolarHBondContact O-N 3.19Å; M662-E665 CarbonylContact O-C 3.45Å; M662-E665 WeakPolarHBondContact O-CA 3.41Å; M662-E665 WeakPolarHBondContact O-CB 3.23Å; M662-E665 PolarHBondContact O-N 3.48Å; M662-E666 WeakPolarHBondContact O-CG 3.36Å; M662-E666 PolarHBondContact O-N 3.25Å; M662-H740 VanDerWaalsContact CE-CD2 3.49Å; M662-H740 WeakPolarHBondContact CE-CD2 3.36Å; M662-H740 HydrophobicContact SD-CB 4.1Å; M662-H740 PolarHBondContact SD-CD2 3.37Å
663	M	94.1	Very high	93.7	Very high	38 Å²	38	38.4 Å²	38.4	19%	0.187	18%	0.183	C	C	.	.	H	α-helix	trans	-55.6	-44.4	173.5	-69.7	175.3	62.6	0	0	112.2	I659 E665 E666 E667 L949 R952	I659-M663 HydrophobicContact CG2-CG 4.31Å; I659-M663 HydrophobicContact CG2-SD 4.05Å; I659-M663 VanDerWaalsContact O-CG 3.3Å; I659-M663 WeakPolarHBondContact O-CG 3.39Å; I659-M663 PolarHBondContact O-N 2.62Å; M663-E665 PolarHBondContact O-N 3.4Å; M663-E666 PolarHBondContact O-N 2.82Å; M663-E667 WeakPolarHBondContact O-CB 3.41Å; M663-E667 VanDerWaalsContact O-CG 3.27Å; M663-E667 WeakPolarHBondContact O-CG 3.31Å; M663-E667 PolarHBondContact O-N 3.12Å; M663-L949 HydrophobicContact CE-CD2 4.23Å; M663-L949 HydrophobicContact SD-CD2 3.68Å; M663-R952 HydrophobicContact SD-CG 4.06Å
664	A	94.5	Very high	93.8	Very high	4 Å²	4	39 Å²	39	3%	0.033	19%	0.185	C	C	.	.	H	α-helix	trans	-70.8	-18.7	177.9	0	0	0	0	0	113.4	V639 K660 L661 M662 L669 L670	V639-A664 HydrophobicContact CG1-CB 4.2Å; V639-A664 HydrophobicContact CG2-CB 4.03Å; K660-A664 PolarHBondContact O-N 2.83Å; L661-A664 PolarHBondContact O-N 3.02Å; M662-A664 VanDerWaalsContact C-N 3.3Å; M662-A664 PolarHBondContact O-N 3.19Å; A664-L669 CarbonylContact O-C 3.59Å; A664-L669 WeakPolarHBondContact O-CA 3.3Å; A664-L669 WeakPolarHBondContact O-CB 3.42Å; A664-L669 PolarHBondContact O-N 2.86Å; A664-L670 HydrophobicContact CB-CB 4.25Å; A664-L670 HydrophobicContact CB-CD1 3.73Å; A664-L670 HydrophobicContact CB-CG 3.93Å; A664-L670 PolarHBondContact O-N 2.82Å
665	E	95.1	Very high	93.9	Very high	45 Å²	45	39 Å²	39	21%	0.21	19%	0.187	C	C	.	.	H	α-helix	trans	-82.9	-42	171.7	-175.5	170.1	-114.6	0	0	111.5	L661 M662 M663 E667 K668 I672 R736	L661-E665 PolarHBondContact O-N 2.8Å; M662-E665 CarbonylContact O-C 3.45Å; M662-E665 WeakPolarHBondContact O-CA 3.41Å; M662-E665 WeakPolarHBondContact O-CB 3.23Å; M662-E665 PolarHBondContact O-N 3.48Å; M663-E665 PolarHBondContact O-N 3.4Å; E665-E667 PolarHBondContact O-N 2.75Å; E665-K668 WeakPolarHBondContact O-CA 3.45Å; E665-K668 PolarHBondContact O-N 3.05Å; E665-I672 HydrophobicContact CB-CD1 4.29Å; E665-I672 HydrophobicContact CB-CG1 4.45Å; E665-I672 VanDerWaalsContact OE1-CB 3.32Å; E665-I672 WeakPolarHBondContact OE1-CB 3.46Å; E665-I672 WeakPolarHBondContact OE1-CG1 3.33Å; E665-I672 PolarHBondContact OE1-N 2.95Å; E665-R736 IonicContact OE2-CZ 2.75Å; E665-R736 IonicContact OE2-NH1 3.56Å; E665-R736 PolarHBondContact OE2-NH1 2.69Å; E665-R736 IonicContact OE2-NH2 2.75Å; E665-R736 PolarHBondContact OE2-NH2 2.92Å
666	E	94.4	Very high	93.9	Very high	95 Å²	95	43.3 Å²	43.3	44%	0.444	21%	0.207	S	C	.	.	H	α-helix	trans	-57.2	-46	170.2	-67	160.8	-155.7	0	0	111.8	M662 M663 K668 R952	M662-E666 WeakPolarHBondContact O-CG 3.36Å; M662-E666 PolarHBondContact O-N 3.25Å; M663-E666 PolarHBondContact O-N 2.82Å; E666-K668 PolarHBondContact O-N 3Å; E666-K668 VanDerWaalsContact O-N 3.12Å; E666-R952 VanDerWaalsContact CD-NH1 3.34Å; E666-R952 IonicContact OE1-NH1 3.89Å; E666-R952 PolarHBondContact OE1-NH1 2.93Å; E666-R952 IonicContact OE2-CZ 2.68Å; E666-R952 VanDerWaalsContact OE2-CZ 3.24Å; E666-R952 IonicContact OE2-NH1 2.77Å; E666-R952 PolarHBondContact OE2-NH1 3.34Å; E666-R952 IonicContact OE2-NH2 2.66Å; E666-R952 PolarHBondContact OE2-NH2 2.98Å
667	E	93.6	Very high	93.6	Very high	108 Å²	108	49.7 Å²	49.7	51%	0.505	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69	-0.3	173.2	-69.2	172.1	-161.5	0	0	113.1	M663 E665 L669	M663-E667 WeakPolarHBondContact O-CB 3.41Å; M663-E667 VanDerWaalsContact O-CG 3.27Å; M663-E667 WeakPolarHBondContact O-CG 3.31Å; M663-E667 PolarHBondContact O-N 3.12Å; E665-E667 PolarHBondContact O-N 2.75Å; E667-L669 HydrophobicContact CB-CD1 4.15Å; E667-L669 HydrophobicContact CB-CG 3.85Å; E667-L669 PolarHBondContact O-N 2.76Å; E667-L669 VanDerWaalsContact OE2-CD1 3.32Å; E667-L669 WeakPolarHBondContact OE2-CD1 3.47Å
668	K	94.4	Very high	93.2	Very high	154 Å²	154	48 Å²	48	67%	0.67	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.1	35.7	179.9	-59.6	169.5	-172.1	173	0	112.3	T626 E665 E666	T626-K668 WeakPolarHBondContact CB-O 3.17Å; T626-K668 VanDerWaalsContact CG2-O 3.29Å; T626-K668 WeakPolarHBondContact CG2-O 3.09Å; T626-K668 PolarHBondContact OG1-O 2.97Å; E665-K668 WeakPolarHBondContact O-CA 3.45Å; E665-K668 PolarHBondContact O-N 3.05Å; E666-K668 PolarHBondContact O-N 3Å; E666-K668 VanDerWaalsContact O-N 3.12Å
669	L	94	Very high	92.5	Very high	17 Å²	17	51.8 Å²	51.8	9%	0.089	25%	0.246	C	C	.	.	S	Bend	trans	-95.7	-36.3	175.1	-52.8	-177	0	0	0	112.1	P625 T626 N628 G629 L632 I633 A664 E667	P625-L669 WeakPolarHBondContact CA-O 3.38Å; T626-L669 PolarHBondContact N-O 2.82Å; T626-L669 PolarHBondContact OG1-O 2.84Å; N628-L669 HydrophobicContact CB-CD2 4.1Å; G629-L669 VanDerWaalsContact CA-O 3.28Å; G629-L669 WeakPolarHBondContact CA-O 3.42Å; L632-L669 HydrophobicContact CB-CD2 4.15Å; L632-L669 HydrophobicContact CD1-CD2 3.75Å; I633-L669 HydrophobicContact CD1-CB 4.02Å; I633-L669 HydrophobicContact CG1-CB 4.21Å; I633-L669 HydrophobicContact CG1-CD1 4.37Å; A664-L669 CarbonylContact O-C 3.59Å; A664-L669 WeakPolarHBondContact O-CA 3.3Å; A664-L669 WeakPolarHBondContact O-CB 3.42Å; A664-L669 PolarHBondContact O-N 2.86Å; E667-L669 HydrophobicContact CB-CD1 4.15Å; E667-L669 HydrophobicContact CB-CG 3.85Å; E667-L669 PolarHBondContact O-N 2.76Å; E667-L669 VanDerWaalsContact OE2-CD1 3.32Å; E667-L669 WeakPolarHBondContact OE2-CD1 3.47Å
670	L	94.8	Very high	91.5	Very high	4 Å²	4	51.9 Å²	51.9	2%	0.021	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	165.7	177.7	-65.3	-179.4	0	0	0	111.6	I623 R624 P625 I633 V639 L661 A664	I623-L670 HydrophobicContact CG2-CB 4.25Å; I623-L670 HydrophobicContact CG2-CD1 3.75Å; I623-L670 HydrophobicContact CG2-CD2 3.92Å; I623-L670 HydrophobicContact CG2-CG 4.19Å; R624-L670 CarbonylContact O-C 3.24Å; R624-L670 WeakPolarHBondContact O-CA 3.49Å; P625-L670 HydrophobicContact CB-CD2 4.16Å; I633-L670 HydrophobicContact CD1-CD1 4.45Å; I633-L670 HydrophobicContact CD1-CD2 3.38Å; I633-L670 HydrophobicContact CD1-CG 3.76Å; V639-L670 HydrophobicContact CB-CD1 3.91Å; V639-L670 HydrophobicContact CG1-CD1 4.28Å; V639-L670 HydrophobicContact CG2-CD1 3.86Å; L661-L670 HydrophobicContact CD2-CD1 3.84Å; A664-L670 HydrophobicContact CB-CB 4.25Å; A664-L670 HydrophobicContact CB-CD1 3.73Å; A664-L670 HydrophobicContact CB-CG 3.93Å; A664-L670 PolarHBondContact O-N 2.82Å
671	E	95.2	Very high	90.5	Very high	112 Å²	112	51.5 Å²	51.5	52%	0.523	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	124.5	171.3	-179.6	-175.3	176	0	0	107.3	I623 R624	I623-E671 WeakPolarHBondContact CA-O 3.3Å; R624-E671 PolarHBondContact N-O 2.92Å; R624-E671 PolarHBondContact O-N 2.78Å
672	I	95.4	Very high	88.9	Confident	14 Å²	14	54.8 Å²	54.8	7%	0.072	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	110.4	-177.7	-51	173	0	0	0	109.3	L661 E665 F674	L661-I672 HydrophobicContact CB-CD1 3.78Å; E665-I672 HydrophobicContact CB-CD1 4.29Å; E665-I672 HydrophobicContact CB-CG1 4.45Å; E665-I672 VanDerWaalsContact OE1-CB 3.32Å; E665-I672 WeakPolarHBondContact OE1-CB 3.46Å; E665-I672 WeakPolarHBondContact OE1-CG1 3.33Å; E665-I672 PolarHBondContact OE1-N 2.95Å; I672-F674 HydrophobicContact CG2-CE2 4.19Å
673	T	95.6	Very high	87	Confident	59 Å²	59	58 Å²	58	36%	0.362	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	114.8	177.2	-31.5	0	0	0	0	110.5	I621 N622	I621-T673 CarbonylContact C-O 3.6Å; I621-T673 WeakPolarHBondContact CA-O 3.05Å; N622-T673 PolarHBondContact N-O 3.18Å; N622-T673 PolarHBondContact O-N 3.24Å
674	F	95	Very high	85.1	Confident	14 Å²	14	60.9 Å²	60.9	6%	0.061	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	136.6	163.8	-70.5	-95.1	0	0	0	109.2	I621 V650 F658 I672 I732 L735 R736 L739	I621-F674 HydrophobicContact CG2-CD1 3.75Å; I621-F674 HydrophobicContact CG2-CE1 3.64Å; I621-F674 HydrophobicContact CG2-CG 4.35Å; I621-F674 HydrophobicContact CG2-CZ 4.16Å; V650-F674 HydrophobicContact CG2-CD1 4.42Å; V650-F674 HydrophobicContact CG2-CE1 4.07Å; F658-F674 AromaticContact CE2-CZ 3.91Å; F658-F674 HydrophobicContact CE2-CZ 3.91Å; F658-F674 HydrophobicContact CZ-CE2 4.36Å; F658-F674 AromaticContact CZ-CZ 3.88Å; F658-F674 HydrophobicContact CZ-CZ 3.88Å; I672-F674 HydrophobicContact CG2-CE2 4.19Å; F674-I732 HydrophobicContact CB-CD1 4.17Å; F674-I732 HydrophobicContact CB-CG1 4.06Å; F674-I732 HydrophobicContact CB-CG2 3.9Å; F674-I732 HydrophobicContact CD2-CG2 4.08Å; F674-I732 HydrophobicContact CG-CG2 4.09Å; F674-L735 HydrophobicContact CD1-CD2 3.81Å; F674-L735 HydrophobicContact CE1-CD2 3.81Å; F674-L735 HydrophobicContact CE1-CG 4.07Å; F674-R736 HydrophobicContact CE2-CB 4.42Å; F674-L739 HydrophobicContact CE1-CD1 3.81Å; F674-L739 HydrophobicContact CZ-CD1 3.92Å
675	L	92.4	Very high	83.1	Confident	32 Å²	32	69 Å²	69	17%	0.168	37%	0.371	C	S	.	.			trans	-81.6	124.7	-178.5	-67.5	-179.9	0	0	0	111.7	Y615 R620 K647	Y615-L675 VanDerWaalsContact CE2-O 3.32Å; Y615-L675 WeakPolarHBondContact CE2-O 3.45Å; Y615-L675 PolarHBondContact OH-O 2.82Å; R620-L675 HydrophobicContact CB-CD1 4Å; R620-L675 PolarHBondContact O-N 2.78Å; K647-L675 HydrophobicContact CD-CD1 4.33Å; K647-L675 HydrophobicContact CG-CD1 4.02Å
676	E	88.9	Confident	81.2	Confident	92 Å²	92	68.9 Å²	68.9	43%	0.43	38%	0.382	S	S	.	.	S	Bend	trans	-74.1	-33	171.3	-64.5	-178.3	-157.2	0	0	112.5	F678 I728 I732	E676-F678 WeakPolarHBondContact O-CD1 3.24Å; E676-I728 HydrophobicContact CB-CG2 4.07Å; E676-I728 HydrophobicContact CG-CG2 3.99Å; E676-I732 HydrophobicContact CG-CD1 4.03Å
677	E	82.7	Confident	79.5	Confident	141 Å²	141	70.6 Å²	70.6	66%	0.659	40%	0.399	S	S	*	.	S	Bend	trans	-83.3	123.1	171.3	-65.2	-179.7	174.1	0	0	110.1
678	F	85.2	Confident	77.9	Confident	12 Å²	12	67.8 Å²	67.8	5%	0.053	39%	0.39	C	S	.	.			trans	-138.2	157.5	-179.2	62.1	-85	0	0	0	112.6	M611 V614 Y615 R618 E676 G680 Y691 I728	M611-F678 HydrophobicContact CE-CE1 4.23Å; M611-F678 HydrophobicContact CE-CZ 3.8Å; V614-F678 HydrophobicContact CG1-CE2 3.92Å; Y615-F678 AromaticContact CD2-CD1 3.53Å; Y615-F678 HydrophobicContact CD2-CD1 3.53Å; Y615-F678 AromaticContact CD2-CE1 3.6Å; Y615-F678 HydrophobicContact CD2-CE1 3.6Å; Y615-F678 HydrophobicContact CD2-CG 4.03Å; Y615-F678 HydrophobicContact CD2-CZ 4.13Å; Y615-F678 AromaticContact CE2-CD1 3.76Å; Y615-F678 HydrophobicContact CE2-CD1 3.76Å; Y615-F678 HydrophobicContact CE2-CE1 4.16Å; Y615-F678 HydrophobicContact CE2-CG 4.34Å; R618-F678 HydrophobicContact CB-CD2 4.23Å; E676-F678 WeakPolarHBondContact O-CD1 3.24Å; F678-G680 PolarHBondContact O-N 2.96Å; F678-Y691 HydrophobicContact CD2-CG 4.31Å; F678-Y691 AromaticContact CE2-CD1 3.48Å; F678-Y691 HydrophobicContact CE2-CD1 3.48Å; F678-Y691 VanDerWaalsContact CE2-CD1 3.48Å; F678-Y691 HydrophobicContact CE2-CD2 4.4Å; F678-Y691 HydrophobicContact CE2-CE1 4.36Å; F678-Y691 AromaticContact CE2-CG 3.49Å; F678-Y691 HydrophobicContact CE2-CG 3.49Å; F678-Y691 VanDerWaalsContact CE2-CG 3.49Å; F678-Y691 AromaticContact CZ-CD1 3.44Å; F678-Y691 HydrophobicContact CZ-CD1 3.44Å; F678-Y691 VanDerWaalsContact CZ-CD1 3.44Å; F678-Y691 HydrophobicContact CZ-CE1 4.33Å; F678-Y691 AromaticContact CZ-CG 3.88Å; F678-Y691 HydrophobicContact CZ-CG 3.88Å; F678-Y691 PolarHBondContact O-N 2.89Å; F678-Y691 VanDerWaalsContact O-N 3.09Å; F678-I728 HydrophobicContact CE1-CD1 4.21Å
679	E	79.6	Confident	76.8	Confident	83 Å²	83	62.2 Å²	62.2	39%	0.388	38%	0.376	S	S	.	.	B	Isolated β-bridge	trans	-65.4	124.1	-168.8	-75.7	178	-179.7	0	0	112.4	R618 R620 P688	R618-E679 VanDerWaalsContact CD-O 3.25Å; R618-E679 WeakPolarHBondContact CD-O 3.25Å; R618-E679 PolarHBondContact NH1-O 2.75Å; R620-E679 IonicContact CZ-OE1 3.24Å; R620-E679 IonicContact CZ-OE2 2.7Å; R620-E679 IonicContact NH1-OE1 2.72Å; R620-E679 PolarHBondContact NH1-OE1 2.94Å; R620-E679 IonicContact NH1-OE2 3.68Å; R620-E679 IonicContact NH2-OE1 2.88Å; R620-E679 PolarHBondContact NH2-OE1 3.24Å; R620-E679 IonicContact NH2-OE2 2.81Å; R620-E679 PolarHBondContact NH2-OE2 3.26Å; E679-P688 HydrophobicContact CB-CB 3.91Å; E679-P688 HydrophobicContact CB-CG 4.41Å; E679-P688 HydrophobicContact CG-CB 4.09Å; E679-P688 HydrophobicContact CG-CG 4.4Å
680	G	74.4	Confident	76.4	Confident	5 Å²	5	63.2 Å²	63.2	5%	0.052	38%	0.381	C	S	.	.			trans	-67.8	178.3	174.9	0	0	0	0	0	114.1	R618 F678 A682 G689 E694	R618-G680 PolarHBondContact NH1-O 3.13Å; F678-G680 PolarHBondContact O-N 2.96Å; G680-A682 PolarHBondContact O-N 3.43Å; G680-G689 PolarHBondContact N-O 3.04Å; G680-E694 WeakPolarHBondContact CA-OE1 3.46Å
681	N	72.1	Confident	76.1	Confident	32 Å²	32	63.2 Å²	63.2	17%	0.171	38%	0.381	C	S	.	.			trans	-74.7	94.2	177.1	-78.9	-44.3	0	0	0	110.7	N558 R618 C683 E694	N558-N681 PolarHBondContact OD1-ND2 3.29Å; R618-N681 PolarHBondContact NH1-OD1 3.42Å; R618-N681 PolarHBondContact NH2-OD1 3.39Å; N681-C683 PolarHBondContact O-N 2.84Å; N681-E694 WeakPolarHBondContact CB-OE2 3.34Å; N681-E694 PolarHBondContact N-OE1 3.36Å; N681-E694 PolarHBondContact N-OE2 2.77Å
682	A	61.9	Low	75.8	Confident	69 Å²	69	57.9 Å²	57.9	57%	0.57	36%	0.357	S	S	*	.			trans	-31.8	104.9	180	0	0	0	0	0	114.2	G680 P688	G680-A682 PolarHBondContact O-N 3.43Å; A682-P688 HydrophobicContact CB-CG 4.39Å
683	C	53	Low	75.5	Confident	87 Å²	87	62.4 Å²	62.4	59%	0.588	38%	0.377	S	S	*	.			trans	-58.6	139.9	171.3	-77.6	0	0	0	0	109.3	N681 N685 G686	N681-C683 PolarHBondContact O-N 2.84Å; C683-N685 PolarHBondContact O-N 3.01Å; C683-G686 PolarHBondContact O-N 3.29Å
684	A	54.3	Low	75.1	Confident	100 Å²	100	61.4 Å²	61.4	83%	0.826	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-9.8	-162	0	0	0	0	0	117.4
685	N	52.4	Low	74.9	Confident	174 Å²	174	60.8 Å²	60.8	93%	0.93	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-142.9	26.9	171.2	-66.3	-78.6	0	0	0	112.6	C683	C683-N685 PolarHBondContact O-N 3.01Å
686	G	56.2	Low	74.9	Confident	42 Å²	42	59.8 Å²	59.8	43%	0.433	36%	0.36	S	S	.	.	S	Bend	trans	-129.2	162.5	-175.2	0	0	0	0	0	113.7	C683	C683-G686 PolarHBondContact O-N 3.29Å
687	T	57.6	Low	75	Confident	132 Å²	132	57.7 Å²	57.7	81%	0.81	36%	0.359	S	S	*	.			trans	-57.2	146.3	159.9	11.3	0	0	0	0	109.7
688	P	61.7	Low	75.4	Confident	49 Å²	49	51.8 Å²	51.8	32%	0.318	33%	0.332	S	S	.	.			trans	-53.1	140.9	167	-23.6	34.3	0	0	0	110.7	E679 A682	E679-P688 HydrophobicContact CB-CB 3.91Å; E679-P688 HydrophobicContact CB-CG 4.41Å; E679-P688 HydrophobicContact CG-CB 4.09Å; E679-P688 HydrophobicContact CG-CG 4.4Å; A682-P688 HydrophobicContact CB-CG 4.39Å
689	G	71.2	Confident	75.8	Confident	36 Å²	36	51.4 Å²	51.4	37%	0.371	33%	0.33	S	S	.	.			trans	-74.7	-171.8	167.3	0	0	0	0	0	111.3	G680 E694	G680-G689 PolarHBondContact N-O 3.04Å; G689-E694 PolarHBondContact N-OE1 2.66Å
690	D	84.8	Confident	76.3	Confident	38 Å²	38	50.9 Å²	50.9	20%	0.203	33%	0.327	C	S	.	.	B	Isolated β-bridge	trans	-80.8	137.7	153.1	159.4	56.8	0	0	0	108.9	V692 E693 E694	D690-V692 VanDerWaalsContact C-N 3.29Å; D690-V692 VanDerWaalsContact CG-N 3.34Å; D690-V692 PolarHBondContact O-N 2.76Å; D690-V692 PolarHBondContact OD1-N 3.47Å; D690-V692 WeakPolarHBondContact OD2-CA 3.02Å; D690-V692 WeakPolarHBondContact OD2-CB 3.39Å; D690-V692 PolarHBondContact OD2-N 3.49Å; D690-E693 HydrophobicContact CB-CG 4.38Å; D690-E693 PolarHBondContact O-N 3.04Å; D690-E693 PolarHBondContact OD2-N 2.93Å; D690-E694 PolarHBondContact O-N 2.91Å; D690-E694 VanDerWaalsContact O-N 3.12Å
691	Y	88.6	Confident	77.1	Confident	4 Å²	4	51.9 Å²	51.9	2%	0.016	33%	0.331	C	S	.	.	H	α-helix	trans	-68.3	-25.5	-179.9	-169.8	-98.9	0	0	0	113.1	L555 M611 V614 F678 E694 S695	L555-Y691 HydrophobicContact CD1-CE1 4.18Å; M611-Y691 HydrophobicContact CE-CD1 4.45Å; M611-Y691 HydrophobicContact CE-CE1 4.48Å; M611-Y691 HydrophobicContact SD-CD1 4.27Å; M611-Y691 HydrophobicContact SD-CE1 3.77Å; V614-Y691 HydrophobicContact CG1-CD2 4.29Å; V614-Y691 HydrophobicContact CG1-CE1 4.28Å; V614-Y691 HydrophobicContact CG1-CE2 4.03Å; F678-Y691 HydrophobicContact CD2-CG 4.31Å; F678-Y691 AromaticContact CE2-CD1 3.48Å; F678-Y691 HydrophobicContact CE2-CD1 3.48Å; F678-Y691 VanDerWaalsContact CE2-CD1 3.48Å; F678-Y691 HydrophobicContact CE2-CD2 4.4Å; F678-Y691 HydrophobicContact CE2-CE1 4.36Å; F678-Y691 AromaticContact CE2-CG 3.49Å; F678-Y691 HydrophobicContact CE2-CG 3.49Å; F678-Y691 VanDerWaalsContact CE2-CG 3.49Å; F678-Y691 AromaticContact CZ-CD1 3.44Å; F678-Y691 HydrophobicContact CZ-CD1 3.44Å; F678-Y691 VanDerWaalsContact CZ-CD1 3.44Å; F678-Y691 HydrophobicContact CZ-CE1 4.33Å; F678-Y691 AromaticContact CZ-CG 3.88Å; F678-Y691 HydrophobicContact CZ-CG 3.88Å; F678-Y691 PolarHBondContact O-N 2.89Å; F678-Y691 VanDerWaalsContact O-N 3.09Å; Y691-E694 PolarHBondContact O-N 2.82Å; Y691-S695 VanDerWaalsContact O-CB 3.31Å; Y691-S695 WeakPolarHBondContact O-CB 3.5Å; Y691-S695 PolarHBondContact O-N 3.16Å; Y691-S695 PolarHBondContact O-OG 2.88Å
692	V	89.5	Confident	77.9	Confident	1 Å²	1	57 Å²	57	1%	0.006	36%	0.359	C	S	.	.	H	α-helix	trans	-70.6	-39.6	175.4	-171.5	0	0	0	0	110.6	D690 S695 K696 L723 I728	D690-V692 VanDerWaalsContact C-N 3.29Å; D690-V692 VanDerWaalsContact CG-N 3.34Å; D690-V692 PolarHBondContact O-N 2.76Å; D690-V692 PolarHBondContact OD1-N 3.47Å; D690-V692 WeakPolarHBondContact OD2-CA 3.02Å; D690-V692 WeakPolarHBondContact OD2-CB 3.39Å; D690-V692 PolarHBondContact OD2-N 3.49Å; V692-S695 WeakPolarHBondContact O-CB 3.28Å; V692-S695 PolarHBondContact O-N 2.84Å; V692-K696 WeakPolarHBondContact O-CG 3.37Å; V692-K696 PolarHBondContact O-N 2.91Å; V692-L723 HydrophobicContact CG1-CB 4.28Å; V692-L723 HydrophobicContact CG1-CD1 4.07Å; V692-I728 HydrophobicContact CG2-CD1 3.77Å
693	E	88.1	Confident	79.2	Confident	109 Å²	109	58.5 Å²	58.5	51%	0.509	35%	0.354	S	S	.	.	H	α-helix	trans	-64.2	-42.8	170.1	-63.9	-56	160.7	0	0	113	D690 S695 K696 A697	D690-E693 HydrophobicContact CB-CG 4.38Å; D690-E693 PolarHBondContact O-N 3.04Å; D690-E693 PolarHBondContact OD2-N 2.93Å; E693-S695 VanDerWaalsContact C-N 3.29Å; E693-S695 PolarHBondContact O-N 2.9Å; E693-K696 PolarHBondContact O-N 3.49Å; E693-K696 IonicContact OE1-NZ 2.67Å; E693-K696 PolarHBondContact OE1-NZ 3.13Å; E693-K696 WeakPolarHBondContact OE2-CD 3.29Å; E693-K696 WeakPolarHBondContact OE2-CE 3.42Å; E693-K696 IonicContact OE2-NZ 2.67Å; E693-K696 PolarHBondContact OE2-NZ 3.46Å; E693-A697 PolarHBondContact O-N 3.26Å
694	E	87.5	Confident	80.9	Confident	38 Å²	38	62.5 Å²	62.5	18%	0.178	36%	0.362	C	S	.	.	H	α-helix	trans	-61.6	-39	174.6	-71.5	-179.2	-164.4	0	0	111.7	G680 N681 G689 D690 Y691 K696 A697	G680-E694 WeakPolarHBondContact CA-OE1 3.46Å; N681-E694 WeakPolarHBondContact CB-OE2 3.34Å; N681-E694 PolarHBondContact N-OE1 3.36Å; N681-E694 PolarHBondContact N-OE2 2.77Å; G689-E694 PolarHBondContact N-OE1 2.66Å; D690-E694 PolarHBondContact O-N 2.91Å; D690-E694 VanDerWaalsContact O-N 3.12Å; Y691-E694 PolarHBondContact O-N 2.82Å; E694-K696 PolarHBondContact O-N 2.83Å; E694-A697 WeakPolarHBondContact O-CB 3.49Å; E694-A697 PolarHBondContact O-N 3.28Å
695	S	91.1	Very high	82.6	Confident	1 Å²	1	59.6 Å²	59.6	1%	0.007	34%	0.337	C	S	.	.	H	α-helix	trans	-61.5	-42.4	174.8	-62.3	0	0	0	0	112.1	Y551 L555 Y691 V692 E693 A697 L698	Y551-S695 PolarHBondContact OH-O 2.81Å; L555-S695 WeakPolarHBondContact CD1-OG 3.1Å; Y691-S695 VanDerWaalsContact O-CB 3.31Å; Y691-S695 WeakPolarHBondContact O-CB 3.5Å; Y691-S695 PolarHBondContact O-N 3.16Å; Y691-S695 PolarHBondContact O-OG 2.88Å; V692-S695 WeakPolarHBondContact O-CB 3.28Å; V692-S695 PolarHBondContact O-N 2.84Å; E693-S695 VanDerWaalsContact C-N 3.29Å; E693-S695 PolarHBondContact O-N 2.9Å; S695-A697 PolarHBondContact O-N 3.35Å; S695-L698 WeakPolarHBondContact O-CB 3.5Å; S695-L698 PolarHBondContact O-N 2.72Å
696	K	92.5	Very high	84.4	Confident	11 Å²	11	58.1 Å²	58.1	5%	0.048	32%	0.323	C	S	.	.	H	α-helix	trans	-58.2	-33	177.1	-72.6	175.3	-127.5	177.5	0	112.6	V692 E693 E694 L698 Y699 Q700 A716 V719 Q720	V692-K696 WeakPolarHBondContact O-CG 3.37Å; V692-K696 PolarHBondContact O-N 2.91Å; E693-K696 PolarHBondContact O-N 3.49Å; E693-K696 IonicContact OE1-NZ 2.67Å; E693-K696 PolarHBondContact OE1-NZ 3.13Å; E693-K696 WeakPolarHBondContact OE2-CD 3.29Å; E693-K696 WeakPolarHBondContact OE2-CE 3.42Å; E693-K696 IonicContact OE2-NZ 2.67Å; E693-K696 PolarHBondContact OE2-NZ 3.46Å; E694-K696 PolarHBondContact O-N 2.83Å; K696-L698 PolarHBondContact O-N 3.13Å; K696-Y699 PolarHBondContact O-N 2.7Å; K696-Q700 WeakPolarHBondContact O-CG 3.08Å; K696-Q700 PolarHBondContact O-NE2 3.48Å; K696-A716 HydrophobicContact CB-CB 4.17Å; K696-A716 HydrophobicContact CD-CB 4.13Å; K696-A716 HydrophobicContact CG-CB 4.19Å; K696-V719 HydrophobicContact CG-CB 4.09Å; K696-V719 HydrophobicContact CG-CG1 3.91Å; K696-Q720 HydrophobicContact CD-CB 4.3Å
697	A	89.8	Confident	85.9	Confident	48 Å²	48	59.3 Å²	59.3	40%	0.397	32%	0.317	S	S	.	.	H	α-helix	trans	-67.6	-23.8	177.7	0	0	0	0	0	113	Q560 E693 E694 S695 Y699 Q700	Q560-A697 PolarHBondContact NE2-O 3.06Å; E693-A697 PolarHBondContact O-N 3.26Å; E694-A697 WeakPolarHBondContact O-CB 3.49Å; E694-A697 PolarHBondContact O-N 3.28Å; S695-A697 PolarHBondContact O-N 3.35Å; A697-Y699 PolarHBondContact O-N 3.36Å; A697-Q700 PolarHBondContact O-N 2.9Å
698	L	91.9	Very high	87.5	Confident	17 Å²	17	53 Å²	53	9%	0.089	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77	-5.4	178.3	-59.9	171.9	0	0	0	113.5	Y551 N554 L555 Q560 S695 K696	Y551-L698 HydrophobicContact CE2-CB 4.03Å; N554-L698 HydrophobicContact CB-CB 4.28Å; N554-L698 PolarHBondContact ND2-O 2.74Å; L555-L698 HydrophobicContact CD1-CD1 4.02Å; Q560-L698 HydrophobicContact CG-CD2 4.3Å; S695-L698 WeakPolarHBondContact O-CB 3.5Å; S695-L698 PolarHBondContact O-N 2.72Å; K696-L698 PolarHBondContact O-N 3.13Å
699	Y	94	Very high	89	Confident	4 Å²	4	55.5 Å²	55.5	2%	0.016	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-119.1	30.1	170.9	-148.6	160.2	0	0	0	112.6	F544 L546 Y551 I564 L601 K696 A697 R715 V719	F544-Y699 WeakPolarHBondContact CB-OH 3.22Å; L546-Y699 HydrophobicContact CB-CE2 3.79Å; L546-Y699 HydrophobicContact CD1-CD2 3.85Å; L546-Y699 HydrophobicContact CD1-CE2 3.96Å; L546-Y699 HydrophobicContact CD1-CG 4.49Å; L546-Y699 HydrophobicContact CG-CD2 4.33Å; L546-Y699 HydrophobicContact CG-CE2 3.96Å; L546-Y699 PolarHBondContact O-OH 3.33Å; L546-Y699 VanDerWaalsContact O-OH 3.13Å; Y551-Y699 AromaticContact CD2-CD1 3.75Å; Y551-Y699 HydrophobicContact CD2-CD1 3.75Å; Y551-Y699 AromaticContact CD2-CG 3.87Å; Y551-Y699 HydrophobicContact CD2-CG 3.87Å; Y551-Y699 HydrophobicContact CE2-CD1 4.22Å; Y551-Y699 HydrophobicContact CE2-CG 4.31Å; Y551-Y699 HydrophobicContact CG-CD1 4.1Å; I564-Y699 HydrophobicContact CD1-CD2 4.24Å; I564-Y699 HydrophobicContact CG1-CD2 4.3Å; L601-Y699 HydrophobicContact CD1-CE1 4.32Å; K696-Y699 PolarHBondContact O-N 2.7Å; A697-Y699 PolarHBondContact O-N 3.36Å; Y699-R715 HydrophobicContact CD1-CB 4.35Å; Y699-R715 HydrophobicContact CD2-CB 3.96Å; Y699-R715 HydrophobicContact CD2-CG 3.75Å; Y699-R715 HydrophobicContact CE2-CB 4.38Å; Y699-R715 HydrophobicContact CE2-CG 3.75Å; Y699-R715 HydrophobicContact CG-CB 3.93Å; Y699-R715 HydrophobicContact CG-CG 4.22Å; Y699-R715 VanDerWaalsContact O-CB 3.3Å; Y699-R715 WeakPolarHBondContact O-CB 3.31Å; Y699-R715 WeakPolarHBondContact O-CD 3.19Å; Y699-V719 HydrophobicContact CD1-CG2 3.82Å; Y699-V719 HydrophobicContact CG-CG2 4.41Å
700	Q	90.3	Very high	90	Very high	72 Å²	72	56.6 Å²	56.6	34%	0.336	28%	0.281	S	S	.	.			trans	-122	133.5	176.8	-70.6	176.2	37.3	0	0	112.4	Q560 K696 A697 N712	Q560-Q700 PolarHBondContact NE2-O 3.01Å; K696-Q700 WeakPolarHBondContact O-CG 3.08Å; K696-Q700 PolarHBondContact O-NE2 3.48Å; A697-Q700 PolarHBondContact O-N 2.9Å; Q700-N712 HydrophobicContact CG-CB 4.18Å
701	L	91.1	Very high	90.5	Very high	25 Å²	25	54.8 Å²	54.8	13%	0.131	27%	0.271	C	S	.	.			trans	-91.1	121.3	174.3	179.7	60.3	0	0	0	109.7	I564 Q566 Q703 V708 N712	I564-L701 HydrophobicContact CB-CB 4.34Å; I564-L701 HydrophobicContact CD1-CB 4Å; Q566-L701 HydrophobicContact CB-CD2 3.68Å; Q566-L701 HydrophobicContact CG-CD2 3.99Å; L701-Q703 VanDerWaalsContact C-N 3.27Å; L701-Q703 HydrophobicContact CD2-CG 4.45Å; L701-Q703 HydrophobicContact CG-CG 4.09Å; L701-Q703 PolarHBondContact O-N 2.72Å; L701-V708 HydrophobicContact CB-CG1 3.96Å; L701-V708 HydrophobicContact CD2-CG1 4.01Å; L701-V708 HydrophobicContact CG-CG1 4.17Å; L701-N712 PolarHBondContact N-ND2 3.44Å; L701-N712 PolarHBondContact N-OD1 2.97Å; L701-N712 PolarHBondContact O-ND2 2.89Å
702	D	88.7	Confident	90.7	Very high	140 Å²	140	55.5 Å²	55.5	75%	0.749	28%	0.275	S	S	*	.			trans	-73.7	74.7	-178	-172.5	21.2	0	0	0	112.4
703	Q	88.9	Confident	90.9	Very high	100 Å²	100	61.8 Å²	61.8	47%	0.467	30%	0.303	S	S	.	.			trans	-142.1	136.5	174.6	-62.7	-177.2	20	0	0	111.6	L701 A705 V708	L701-Q703 VanDerWaalsContact C-N 3.27Å; L701-Q703 HydrophobicContact CD2-CG 4.45Å; L701-Q703 HydrophobicContact CG-CG 4.09Å; L701-Q703 PolarHBondContact O-N 2.72Å; Q703-A705 VanDerWaalsContact C-N 3.28Å; Q703-A705 PolarHBondContact O-N 3.43Å; Q703-V708 HydrophobicContact CB-CB 4.48Å; Q703-V708 HydrophobicContact CB-CG1 4.21Å; Q703-V708 HydrophobicContact CB-CG2 4.44Å
704	F	88	Confident	91.2	Very high	172 Å²	172	57.4 Å²	57.4	75%	0.754	28%	0.282	S	S	*	.			trans	-85.2	14	-175.1	-58.2	-85.1	0	0	0	114.7
705	A	90.2	Very high	91.6	Very high	38 Å²	38	55.6 Å²	55.6	31%	0.314	27%	0.274	S	S	.	.			trans	-78.4	136.4	179	0	0	0	0	0	110.9	Q703 H707 V708 Q709	Q703-A705 VanDerWaalsContact C-N 3.28Å; Q703-A705 PolarHBondContact O-N 3.43Å; A705-H707 PolarHBondContact O-N 3.36Å; A705-V708 HydrophobicContact CB-CB 4.48Å; A705-V708 HydrophobicContact CB-CG2 3.96Å; A705-V708 WeakPolarHBondContact O-CA 3.42Å; A705-V708 WeakPolarHBondContact O-CB 3.18Å; A705-V708 PolarHBondContact O-N 2.89Å; A705-Q709 PolarHBondContact O-N 2.98Å
706	K	90	Very high	91.8	Very high	144 Å²	144	56.3 Å²	56.3	63%	0.626	28%	0.28	S	S	*	.	H	α-helix	trans	-53	-45.9	-171.3	-177.7	173.9	179.2	-73.1	0	113.8	V708 Q709 E710	K706-V708 VanDerWaalsContact C-N 3.33Å; K706-V708 PolarHBondContact O-N 2.94Å; K706-Q709 PolarHBondContact O-N 2.85Å; K706-E710 WeakPolarHBondContact CE-OE1 3.32Å; K706-E710 IonicContact NZ-OE1 3.38Å; K706-E710 PolarHBondContact NZ-OE1 3.26Å; K706-E710 WeakPolarHBondContact O-CG 3.48Å; K706-E710 PolarHBondContact O-N 3.45Å
707	H	88.9	Confident	91.9	Very high	67 Å²	67	58.3 Å²	58.3	31%	0.31	29%	0.29	S	S	.	.	H	α-helix	trans	-65.6	-35.2	177.8	58.5	-96.1	0	0	0	112.1	A705 E710 W711	A705-H707 PolarHBondContact O-N 3.36Å; H707-E710 PolarHBondContact O-N 3.47Å; H707-W711 WeakPolarHBondContact O-CB 3.3Å; H707-W711 PolarHBondContact O-N 3.42Å
708	V	91.6	Very high	92.2	Very high	0 Å²	0	56 Å²	56	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-68	-39.2	175.3	-171.6	0	0	0	0	110.8	Q566 L701 Q703 A705 K706 W711 N712	Q566-V708 HydrophobicContact CG-CG2 3.79Å; L701-V708 HydrophobicContact CB-CG1 3.96Å; L701-V708 HydrophobicContact CD2-CG1 4.01Å; L701-V708 HydrophobicContact CG-CG1 4.17Å; Q703-V708 HydrophobicContact CB-CB 4.48Å; Q703-V708 HydrophobicContact CB-CG1 4.21Å; Q703-V708 HydrophobicContact CB-CG2 4.44Å; A705-V708 HydrophobicContact CB-CB 4.48Å; A705-V708 HydrophobicContact CB-CG2 3.96Å; A705-V708 WeakPolarHBondContact O-CA 3.42Å; A705-V708 WeakPolarHBondContact O-CB 3.18Å; A705-V708 PolarHBondContact O-N 2.89Å; K706-V708 VanDerWaalsContact C-N 3.33Å; K706-V708 PolarHBondContact O-N 2.94Å; V708-W711 PolarHBondContact O-N 3.44Å; V708-N712 VanDerWaalsContact O-CB 3.24Å; V708-N712 WeakPolarHBondContact O-CB 3.45Å; V708-N712 PolarHBondContact O-N 3.32Å
709	Q	91.9	Very high	92.3	Very high	101 Å²	101	55.3 Å²	55.3	47%	0.472	27%	0.267	S	S	.	.	H	α-helix	trans	-65.1	-39.4	174.8	-67.6	177.7	-28.1	0	0	112	A705 K706 K713	A705-Q709 PolarHBondContact O-N 2.98Å; K706-Q709 PolarHBondContact O-N 2.85Å; Q709-K713 WeakPolarHBondContact O-CB 3.2Å; Q709-K713 PolarHBondContact O-N 2.95Å
710	E	92.7	Very high	92.3	Very high	59 Å²	59	58.3 Å²	58.3	28%	0.276	28%	0.281	S	S	.	.	H	α-helix	trans	-63.4	-45.9	173.2	-71.8	165.1	170.2	0	0	111.8	P571 K706 H707 K713 L714	P571-E710 HydrophobicContact CG-CB 3.82Å; K706-E710 WeakPolarHBondContact CE-OE1 3.32Å; K706-E710 IonicContact NZ-OE1 3.38Å; K706-E710 PolarHBondContact NZ-OE1 3.26Å; K706-E710 WeakPolarHBondContact O-CG 3.48Å; K706-E710 PolarHBondContact O-N 3.45Å; H707-E710 PolarHBondContact O-N 3.47Å; E710-K713 PolarHBondContact O-N 3.23Å; E710-L714 WeakPolarHBondContact O-CG 3.44Å; E710-L714 PolarHBondContact O-N 3.24Å
711	W	94.7	Very high	92.6	Very high	0 Å²	0	57.3 Å²	57.3	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-65.5	-42.6	174.9	-82.3	113	0	0	0	112.8	F540 H543 F544 E567 I569 P571 L574 H707 V708 K713 L714 R715	F540-W711 AromaticContact CE1-CH2 3.83Å; F540-W711 HydrophobicContact CE1-CH2 3.83Å; F540-W711 HydrophobicContact CE1-CZ3 4.13Å; F540-W711 AromaticContact CZ-CH2 3.83Å; F540-W711 HydrophobicContact CZ-CH2 3.83Å; F540-W711 HydrophobicContact CZ-CZ3 4.43Å; H543-W711 HydrophobicContact CB-CH2 3.88Å; H543-W711 HydrophobicContact CB-CZ2 4.16Å; F544-W711 HydrophobicContact CD1-CE3 4.49Å; F544-W711 HydrophobicContact CD1-CZ3 4.31Å; F544-W711 HydrophobicContact CD2-CH2 4.5Å; F544-W711 AromaticContact CD2-CZ3 3.73Å; F544-W711 HydrophobicContact CD2-CZ3 3.73Å; F544-W711 HydrophobicContact CE1-CZ3 4.42Å; F544-W711 AromaticContact CE2-CZ3 3.87Å; F544-W711 HydrophobicContact CE2-CZ3 3.87Å; F544-W711 HydrophobicContact CG-CE3 4.46Å; F544-W711 AromaticContact CG-CZ3 3.98Å; F544-W711 HydrophobicContact CG-CZ3 3.98Å; F544-W711 HydrophobicContact CZ-CZ3 4.22Å; E567-W711 HydrophobicContact CB-CZ2 4.18Å; E567-W711 HydrophobicContact CG-CZ2 4.19Å; I569-W711 PolarHBondContact O-NE1 3.38Å; P571-W711 HydrophobicContact CB-CD2 4.15Å; P571-W711 HydrophobicContact CB-CE3 4.34Å; P571-W711 HydrophobicContact CB-CH2 4.16Å; P571-W711 HydrophobicContact CB-CZ2 3.94Å; P571-W711 HydrophobicContact CB-CZ3 4.35Å; P571-W711 HydrophobicContact CG-CD2 4.39Å; L574-W711 HydrophobicContact CD2-CH2 3.92Å; L574-W711 HydrophobicContact CD2-CZ2 3.8Å; H707-W711 WeakPolarHBondContact O-CB 3.3Å; H707-W711 PolarHBondContact O-N 3.42Å; V708-W711 PolarHBondContact O-N 3.44Å; W711-K713 VanDerWaalsContact C-N 3.32Å; W711-K713 PolarHBondContact O-N 3.32Å; W711-L714 HydrophobicContact CE3-CD1 4.41Å; W711-L714 PolarHBondContact O-N 2.88Å; W711-R715 VanDerWaalsContact O-CG 3.27Å; W711-R715 WeakPolarHBondContact O-CG 3.34Å; W711-R715 PolarHBondContact O-N 3.31Å
712	N	93.7	Very high	92.8	Very high	18 Å²	18	56.1 Å²	56.1	10%	0.096	27%	0.272	C	S	.	.	H	α-helix	trans	-61.5	-38.6	176.4	-77.5	-6.8	0	0	0	112.1	Q700 L701 V708 R715 A716	Q700-N712 HydrophobicContact CG-CB 4.18Å; L701-N712 PolarHBondContact N-ND2 3.44Å; L701-N712 PolarHBondContact N-OD1 2.97Å; L701-N712 PolarHBondContact O-ND2 2.89Å; V708-N712 VanDerWaalsContact O-CB 3.24Å; V708-N712 WeakPolarHBondContact O-CB 3.45Å; V708-N712 PolarHBondContact O-N 3.32Å; N712-R715 PolarHBondContact O-N 2.95Å; N712-R715 PolarHBondContact OD1-NH1 2.76Å; N712-A716 WeakPolarHBondContact O-CB 3.32Å; N712-A716 PolarHBondContact O-N 3.4Å
713	K	93.7	Very high	93.1	Very high	134 Å²	134	49.5 Å²	49.5	58%	0.583	24%	0.236	S	C	*	.	H	α-helix	trans	-59	-49.6	172.2	177.8	176	171.4	178.2	0	110.8	Q709 E710 W711 R715 A716 E717	Q709-K713 WeakPolarHBondContact O-CB 3.2Å; Q709-K713 PolarHBondContact O-N 2.95Å; E710-K713 PolarHBondContact O-N 3.23Å; W711-K713 VanDerWaalsContact C-N 3.32Å; W711-K713 PolarHBondContact O-N 3.32Å; K713-R715 PolarHBondContact O-N 3.32Å; K713-A716 PolarHBondContact O-N 2.81Å; K713-E717 WeakPolarHBondContact CE-OE1 3.39Å; K713-E717 WeakPolarHBondContact CG-OE1 3.25Å; K713-E717 IonicContact NZ-OE1 2.92Å; K713-E717 WeakPolarHBondContact O-CG 3.31Å; K713-E717 PolarHBondContact O-N 2.84Å
714	L	94.2	Very high	93.3	Very high	16 Å²	16	47.9 Å²	47.9	8%	0.084	23%	0.229	C	C	.	.	H	α-helix	trans	-63.4	-38.8	178.3	-65.1	176.6	0	0	0	112.8	F544 P571 I590 K594 E710 W711 E717 C718	F544-L714 HydrophobicContact CE1-CB 3.97Å; F544-L714 HydrophobicContact CZ-CB 4.45Å; P571-L714 HydrophobicContact CB-CD1 3.41Å; P571-L714 VanDerWaalsContact CB-CD1 3.41Å; P571-L714 HydrophobicContact CG-CD1 3.63Å; I590-L714 HydrophobicContact CG2-CD1 4.2Å; I590-L714 HydrophobicContact CG2-CD2 3.61Å; K594-L714 HydrophobicContact CD-CD2 3.89Å; K594-L714 HydrophobicContact CG-CD2 4.24Å; E710-L714 WeakPolarHBondContact O-CG 3.44Å; E710-L714 PolarHBondContact O-N 3.24Å; W711-L714 HydrophobicContact CE3-CD1 4.41Å; W711-L714 PolarHBondContact O-N 2.88Å; L714-E717 PolarHBondContact O-N 2.61Å; L714-C718 PolarHBondContact O-N 3.43Å; L714-C718 PolarHBondContact O-SG 2.59Å
715	R	95.7	Very high	93.6	Very high	0 Å²	0	46 Å²	46	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-61.9	-48.2	175.1	-69.4	164.2	-174.7	141.9	-0.2	111.7	F544 I564 Q566 Y699 W711 N712 K713 E717 C718 V719	F544-R715 HydrophobicContact CD1-CG 4.06Å; F544-R715 VanDerWaalsContact O-CZ 3.27Å; F544-R715 PolarHBondContact O-NE 2.69Å; F544-R715 PolarHBondContact O-NH2 3.21Å; I564-R715 VanDerWaalsContact CG2-CZ 3.43Å; I564-R715 VanDerWaalsContact CG2-NH2 3.33Å; Q566-R715 VanDerWaalsContact OE1-CZ 3.31Å; Y699-R715 HydrophobicContact CD1-CB 4.35Å; Y699-R715 HydrophobicContact CD2-CB 3.96Å; Y699-R715 HydrophobicContact CD2-CG 3.75Å; Y699-R715 HydrophobicContact CE2-CB 4.38Å; Y699-R715 HydrophobicContact CE2-CG 3.75Å; Y699-R715 HydrophobicContact CG-CB 3.93Å; Y699-R715 HydrophobicContact CG-CG 4.22Å; Y699-R715 VanDerWaalsContact O-CB 3.3Å; Y699-R715 WeakPolarHBondContact O-CB 3.31Å; Y699-R715 WeakPolarHBondContact O-CD 3.19Å; W711-R715 VanDerWaalsContact O-CG 3.27Å; W711-R715 WeakPolarHBondContact O-CG 3.34Å; W711-R715 PolarHBondContact O-N 3.31Å; N712-R715 PolarHBondContact O-N 2.95Å; N712-R715 PolarHBondContact OD1-NH1 2.76Å; K713-R715 PolarHBondContact O-N 3.32Å; R715-E717 VanDerWaalsContact C-N 3.35Å; R715-E717 PolarHBondContact O-N 3.48Å; R715-C718 WeakPolarHBondContact O-CB 3.45Å; R715-C718 PolarHBondContact O-N 3.45Å; R715-C718 VanDerWaalsContact O-N 3.12Å; R715-V719 PolarHBondContact O-N 2.96Å
716	A	94.4	Very high	93.8	Very high	16 Å²	16	45.8 Å²	45.8	13%	0.132	21%	0.211	C	C	.	.	H	α-helix	trans	-61.3	-41.8	176.9	0	0	0	0	0	112	K696 N712 K713 C718 V719 Q720	K696-A716 HydrophobicContact CB-CB 4.17Å; K696-A716 HydrophobicContact CD-CB 4.13Å; K696-A716 HydrophobicContact CG-CB 4.19Å; N712-A716 WeakPolarHBondContact O-CB 3.32Å; N712-A716 PolarHBondContact O-N 3.4Å; K713-A716 PolarHBondContact O-N 2.81Å; A716-C718 VanDerWaalsContact C-N 3.32Å; A716-C718 PolarHBondContact O-N 2.76Å; A716-V719 PolarHBondContact O-N 3.43Å; A716-Q720 WeakPolarHBondContact O-CB 3.34Å; A716-Q720 PolarHBondContact O-N 2.85Å
717	E	94.8	Very high	94.1	Very high	54 Å²	54	38.9 Å²	38.9	25%	0.252	18%	0.182	S	C	.	.	H	α-helix	trans	-64.1	-33.7	173.7	-71.7	173.4	-173.7	0	0	112.7	K594 K713 L714 R715 L721	K594-E717 WeakPolarHBondContact CE-OE2 3.45Å; K594-E717 IonicContact NZ-OE2 3.98Å; K594-E717 PolarHBondContact NZ-OE2 2.79Å; K713-E717 WeakPolarHBondContact CE-OE1 3.39Å; K713-E717 WeakPolarHBondContact CG-OE1 3.25Å; K713-E717 IonicContact NZ-OE1 2.92Å; K713-E717 WeakPolarHBondContact O-CG 3.31Å; K713-E717 PolarHBondContact O-N 2.84Å; L714-E717 PolarHBondContact O-N 2.61Å; R715-E717 VanDerWaalsContact C-N 3.35Å; R715-E717 PolarHBondContact O-N 3.48Å; E717-L721 WeakPolarHBondContact O-CB 3.43Å; E717-L721 PolarHBondContact O-N 3.43Å
718	C	96	Very high	94.4	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-70.1	-42.2	174.6	-67.8	0	0	0	0	112.5	F544 V597 A598 L601 L714 R715 A716 A722	F544-C718 VanDerWaalsContact CE1-SG 3.52Å; V597-C718 HydrophobicContact CB-CB 4.49Å; V597-C718 HydrophobicContact CG1-CB 4.02Å; A598-C718 HydrophobicContact CB-CB 4.41Å; A598-C718 WeakPolarHBondContact CB-O 3.31Å; L601-C718 HydrophobicContact CD1-CB 4.31Å; L714-C718 PolarHBondContact O-N 3.43Å; L714-C718 PolarHBondContact O-SG 2.59Å; R715-C718 WeakPolarHBondContact O-CB 3.45Å; R715-C718 PolarHBondContact O-N 3.45Å; R715-C718 VanDerWaalsContact O-N 3.12Å; A716-C718 VanDerWaalsContact C-N 3.32Å; A716-C718 PolarHBondContact O-N 2.76Å; C718-A722 VanDerWaalsContact O-CB 3.24Å; C718-A722 WeakPolarHBondContact O-CB 3.32Å; C718-A722 PolarHBondContact O-N 3.33Å
719	V	95.1	Very high	94.6	Very high	1 Å²	1	38 Å²	38	1%	0.006	18%	0.182	C	C	.	.	H	α-helix	trans	-62.1	-47	174.7	170.6	0	0	0	0	110.5	Y551 L601 K696 Y699 R715 A716 A722 L723	Y551-V719 HydrophobicContact CE1-CG2 4.31Å; Y551-V719 HydrophobicContact CE2-CG2 3.92Å; Y551-V719 VanDerWaalsContact OH-CG1 3.28Å; Y551-V719 WeakPolarHBondContact OH-CG1 3.49Å; L601-V719 HydrophobicContact CD1-CG2 4.35Å; K696-V719 HydrophobicContact CG-CB 4.09Å; K696-V719 HydrophobicContact CG-CG1 3.91Å; Y699-V719 HydrophobicContact CD1-CG2 3.82Å; Y699-V719 HydrophobicContact CG-CG2 4.41Å; R715-V719 PolarHBondContact O-N 2.96Å; A716-V719 PolarHBondContact O-N 3.43Å; V719-A722 PolarHBondContact O-N 3.24Å; V719-L723 HydrophobicContact CG1-CD1 3.94Å; V719-L723 HydrophobicContact CG1-CG 4.46Å; V719-L723 WeakPolarHBondContact O-CG 3.33Å; V719-L723 PolarHBondContact O-N 2.93Å
720	Q	94.5	Very high	94.7	Very high	68 Å²	68	35.9 Å²	35.9	32%	0.318	17%	0.173	S	C	.	.	H	α-helix	trans	-60.9	-47.5	178.2	-174.4	169.6	-13.6	0	0	111.8	K696 A716 A722 L723 Q724	K696-Q720 HydrophobicContact CD-CB 4.3Å; A716-Q720 WeakPolarHBondContact O-CB 3.34Å; A716-Q720 PolarHBondContact O-N 2.85Å; Q720-A722 VanDerWaalsContact C-N 3.33Å; Q720-A722 PolarHBondContact O-N 2.96Å; Q720-L723 PolarHBondContact O-N 3.3Å; Q720-Q724 HydrophobicContact CG-CG 4.38Å; Q720-Q724 WeakPolarHBondContact O-CB 3.35Å; Q720-Q724 PolarHBondContact O-N 3Å
721	L	94.9	Very high	94.9	Very high	50 Å²	50	33 Å²	33	26%	0.262	16%	0.16	S	C	.	.	H	α-helix	trans	-62.5	-38.4	177	-177.3	62.9	0	0	0	112.2	A598 E717 K725 W726	A598-L721 HydrophobicContact CB-CB 3.92Å; A598-L721 HydrophobicContact CB-CD2 3.76Å; A598-L721 HydrophobicContact CB-CG 3.85Å; E717-L721 WeakPolarHBondContact O-CB 3.43Å; E717-L721 PolarHBondContact O-N 3.43Å; L721-K725 HydrophobicContact CD1-CB 4.02Å; L721-K725 HydrophobicContact CD1-CD 3.7Å; L721-K725 HydrophobicContact CD1-CG 4.48Å; L721-K725 WeakPolarHBondContact O-CB 3.43Å; L721-K725 PolarHBondContact O-N 2.89Å; L721-W726 HydrophobicContact CG-CH2 4.49Å; L721-W726 HydrophobicContact CG-CZ3 4.3Å
722	A	95.8	Very high	94.9	Very high	1 Å²	1	34.6 Å²	34.6	1%	0.008	17%	0.168	C	C	.	.	H	α-helix	trans	-64.2	-47.6	177.8	0	0	0	0	0	112.1	A598 L601 A602 C718 V719 Q720 V727	A598-A722 HydrophobicContact CB-CB 4.25Å; A598-A722 VanDerWaalsContact O-CB 3.28Å; A598-A722 WeakPolarHBondContact O-CB 3.44Å; L601-A722 HydrophobicContact CB-CB 3.72Å; L601-A722 HydrophobicContact CD1-CB 4.31Å; A602-A722 HydrophobicContact CB-CB 4.2Å; C718-A722 VanDerWaalsContact O-CB 3.24Å; C718-A722 WeakPolarHBondContact O-CB 3.32Å; C718-A722 PolarHBondContact O-N 3.33Å; V719-A722 PolarHBondContact O-N 3.24Å; Q720-A722 VanDerWaalsContact C-N 3.33Å; Q720-A722 PolarHBondContact O-N 2.96Å; A722-V727 PolarHBondContact O-N 3.44Å
723	L	94.9	Very high	95	Very high	1 Å²	1	39.8 Å²	39.8	1%	0.005	19%	0.19	C	C	.	.	I	π-helix	trans	-75.9	-52.6	-175	-64.6	-178.5	0	0	0	112	L607 M611 V692 V719 Q720 V727 I728	L607-L723 HydrophobicContact CD2-CD2 3.99Å; M611-L723 HydrophobicContact CE-CD1 4.4Å; M611-L723 HydrophobicContact CE-CD2 3.93Å; M611-L723 HydrophobicContact CG-CD2 3.83Å; M611-L723 HydrophobicContact SD-CD1 4.23Å; M611-L723 HydrophobicContact SD-CD2 3.74Å; V692-L723 HydrophobicContact CG1-CB 4.28Å; V692-L723 HydrophobicContact CG1-CD1 4.07Å; V719-L723 HydrophobicContact CG1-CD1 3.94Å; V719-L723 HydrophobicContact CG1-CG 4.46Å; V719-L723 WeakPolarHBondContact O-CG 3.33Å; V719-L723 PolarHBondContact O-N 2.93Å; Q720-L723 PolarHBondContact O-N 3.3Å; L723-V727 HydrophobicContact CD2-CB 4.13Å; L723-V727 HydrophobicContact CD2-CG1 4.38Å; L723-V727 HydrophobicContact CD2-CG2 4.33Å; L723-V727 PolarHBondContact O-N 3.09Å; L723-I728 HydrophobicContact CB-CD1 4.16Å; L723-I728 WeakPolarHBondContact O-CB 3.49Å; L723-I728 WeakPolarHBondContact O-CG1 3.28Å; L723-I728 PolarHBondContact O-N 2.77Å
724	Q	93.7	Very high	95.1	Very high	66 Å²	66	35.3 Å²	35.3	31%	0.308	17%	0.171	S	C	.	.	I	π-helix	trans	-73.3	-34.2	-174.8	-67.2	-177	-41.6	0	0	113.4	Q720 P729	Q720-Q724 HydrophobicContact CG-CG 4.38Å; Q720-Q724 WeakPolarHBondContact O-CB 3.35Å; Q720-Q724 PolarHBondContact O-N 3Å; Q724-P729 VanDerWaalsContact O-CD 3.24Å; Q724-P729 WeakPolarHBondContact O-CD 3.38Å; Q724-P729 VanDerWaalsContact O-CG 3.23Å; Q724-P729 WeakPolarHBondContact O-CG 3.45Å
725	K	94.2	Very high	95.2	Very high	133 Å²	133	34.5 Å²	34.5	58%	0.578	17%	0.167	S	C	*	.	I	π-helix	trans	-87.6	-18.4	-174.8	-165.6	161.4	-174.5	157	0	114.8	L721	L721-K725 HydrophobicContact CD1-CB 4.02Å; L721-K725 HydrophobicContact CD1-CD 3.7Å; L721-K725 HydrophobicContact CD1-CG 4.48Å; L721-K725 WeakPolarHBondContact O-CB 3.43Å; L721-K725 PolarHBondContact O-N 2.89Å
726	W	94.4	Very high	95.2	Very high	32 Å²	32	38.1 Å²	38.1	12%	0.121	18%	0.181	C	C	.	.	I	π-helix	trans	-137.9	-60.5	-174.4	-61.9	-54.9	0	0	0	112.9	Y595 A598 R599 A602 L721 D730	Y595-W726 HydrophobicContact CD2-CH2 4.09Å; Y595-W726 HydrophobicContact CD2-CZ2 4.39Å; Y595-W726 AromaticContact CE2-CH2 3.84Å; Y595-W726 HydrophobicContact CE2-CH2 3.84Å; Y595-W726 AromaticContact CE2-CZ2 3.71Å; Y595-W726 HydrophobicContact CE2-CZ2 3.71Å; Y595-W726 AromaticContact CZ-CZ2 3.89Å; A598-W726 HydrophobicContact CB-CZ3 3.85Å; R599-W726 HydrophobicContact CB-CH2 4.23Å; R599-W726 HydrophobicContact CB-CZ3 4.24Å; R599-W726 VanDerWaalsContact NH1-CD1 3.32Å; A602-W726 HydrophobicContact CB-CB 3.88Å; A602-W726 HydrophobicContact CB-CD2 4.23Å; A602-W726 HydrophobicContact CB-CE3 3.63Å; A602-W726 HydrophobicContact CB-CG 4.37Å; L721-W726 HydrophobicContact CG-CH2 4.49Å; L721-W726 HydrophobicContact CG-CZ3 4.3Å; W726-D730 VanDerWaalsContact O-CB 3.31Å; W726-D730 WeakPolarHBondContact O-CB 3.43Å; W726-D730 PolarHBondContact O-N 3.06Å
727	V	95.7	Very high	95.2	Very high	0 Å²	0	40 Å²	40	0%	0	19%	0.193	C	C	.	.	I	π-helix	trans	-67.2	-45.6	-168.6	-177.2	0	0	0	0	112.5	A602 L607 M611 A722 L723 L731	A602-V727 HydrophobicContact CB-CG2 3.82Å; L607-V727 HydrophobicContact CD2-CG1 4.26Å; L607-V727 HydrophobicContact CD2-CG2 3.87Å; M611-V727 HydrophobicContact CB-CG1 3.78Å; M611-V727 HydrophobicContact CG-CG1 3.98Å; A722-V727 PolarHBondContact O-N 3.44Å; L723-V727 HydrophobicContact CD2-CB 4.13Å; L723-V727 HydrophobicContact CD2-CG1 4.38Å; L723-V727 HydrophobicContact CD2-CG2 4.33Å; L723-V727 PolarHBondContact O-N 3.09Å; V727-L731 HydrophobicContact CG1-CD1 3.82Å; V727-L731 HydrophobicContact CG1-CG 4.41Å; V727-L731 WeakPolarHBondContact O-CB 3.39Å; V727-L731 WeakPolarHBondContact O-CG 3.39Å; V727-L731 PolarHBondContact O-N 3.25Å
728	I	95.2	Very high	95.2	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-69.1	-46.3	-179.9	-64.1	169.2	0	0	0	111.3	M611 Y615 E676 F678 V692 L723 D730 L731 I732	M611-I728 HydrophobicContact CE-CD1 4.4Å; M611-I728 HydrophobicContact CE-CG1 4.11Å; Y615-I728 HydrophobicContact CE2-CG2 4.46Å; E676-I728 HydrophobicContact CB-CG2 4.07Å; E676-I728 HydrophobicContact CG-CG2 3.99Å; F678-I728 HydrophobicContact CE1-CD1 4.21Å; V692-I728 HydrophobicContact CG2-CD1 3.77Å; L723-I728 HydrophobicContact CB-CD1 4.16Å; L723-I728 WeakPolarHBondContact O-CB 3.49Å; L723-I728 WeakPolarHBondContact O-CG1 3.28Å; L723-I728 PolarHBondContact O-N 2.77Å; I728-D730 PolarHBondContact O-N 2.84Å; I728-L731 PolarHBondContact O-N 2.76Å; I728-I732 HydrophobicContact CG2-CD1 3.88Å; I728-I732 HydrophobicContact CG2-CG1 4.41Å; I728-I732 WeakPolarHBondContact O-CG1 3.38Å; I728-I732 PolarHBondContact O-N 3.41Å
729	P	95.5	Very high	95.1	Very high	49 Å²	49	38.9 Å²	38.9	32%	0.318	19%	0.189	S	C	.	.	H	α-helix	trans	-57.8	-42.3	172.6	-28.7	36.2	0	0	0	114.5	Q724 L731 I732 K733	Q724-P729 VanDerWaalsContact O-CD 3.24Å; Q724-P729 WeakPolarHBondContact O-CD 3.38Å; Q724-P729 VanDerWaalsContact O-CG 3.23Å; Q724-P729 WeakPolarHBondContact O-CG 3.45Å; P729-L731 VanDerWaalsContact C-N 3.33Å; P729-L731 PolarHBondContact O-N 2.79Å; P729-I732 PolarHBondContact O-N 3.3Å; P729-K733 PolarHBondContact O-N 3.14Å; P729-K733 VanDerWaalsContact O-N 3.1Å
730	D	94.9	Very high	95.1	Very high	55 Å²	55	41.1 Å²	41.1	29%	0.294	20%	0.2	S	C	.	.	H	α-helix	trans	-59.6	-45	174.6	-71.7	-16.5	0	0	0	111	R608 W726 I728 I732 K733 E734	R608-D730 IonicContact CZ-OD2 3.84Å; R608-D730 VanDerWaalsContact CZ-OD2 3.23Å; R608-D730 IonicContact NH1-OD2 2.46Å; R608-D730 PolarHBondContact NH1-OD2 3.29Å; R608-D730 IonicContact NH2-OD2 3.58Å; R608-D730 PolarHBondContact NH2-OD2 3.07Å; W726-D730 VanDerWaalsContact O-CB 3.31Å; W726-D730 WeakPolarHBondContact O-CB 3.43Å; W726-D730 PolarHBondContact O-N 3.06Å; I728-D730 PolarHBondContact O-N 2.84Å; D730-I732 VanDerWaalsContact C-N 3.35Å; D730-K733 WeakPolarHBondContact O-CB 3.49Å; D730-K733 PolarHBondContact O-N 3.2Å; D730-E734 WeakPolarHBondContact O-CB 3.45Å; D730-E734 PolarHBondContact O-N 3.16Å
731	L	96.1	Very high	95	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-70.9	-27.2	179.7	-70.1	174.3	0	0	0	113	M611 R612 Y615 F616 V727 I728 P729 L735	M611-L731 HydrophobicContact CB-CD1 3.72Å; R612-L731 HydrophobicContact CB-CD1 4.47Å; R612-L731 HydrophobicContact CB-CD2 3.64Å; R612-L731 HydrophobicContact CG-CD2 3.93Å; Y615-L731 HydrophobicContact CD1-CB 4.17Å; F616-L731 HydrophobicContact CE1-CB 4.34Å; F616-L731 HydrophobicContact CE1-CD2 4.15Å; V727-L731 HydrophobicContact CG1-CD1 3.82Å; V727-L731 HydrophobicContact CG1-CG 4.41Å; V727-L731 WeakPolarHBondContact O-CB 3.39Å; V727-L731 WeakPolarHBondContact O-CG 3.39Å; V727-L731 PolarHBondContact O-N 3.25Å; I728-L731 PolarHBondContact O-N 2.76Å; P729-L731 VanDerWaalsContact C-N 3.33Å; P729-L731 PolarHBondContact O-N 2.79Å; L731-L735 WeakPolarHBondContact O-CB 3.25Å; L731-L735 PolarHBondContact O-N 3.24Å
732	I	96.3	Very high	95	Very high	32 Å²	32	40.9 Å²	40.9	16%	0.164	20%	0.197	C	C	.	.	H	α-helix	trans	-68.9	-42.3	171.1	-72	168.1	0	0	0	110.6	Y615 F674 E676 I728 P729 D730 R736	Y615-I732 HydrophobicContact CE1-CG1 3.8Å; Y615-I732 WeakPolarHBondContact OH-CG1 3.43Å; F674-I732 HydrophobicContact CB-CD1 4.17Å; F674-I732 HydrophobicContact CB-CG1 4.06Å; F674-I732 HydrophobicContact CB-CG2 3.9Å; F674-I732 HydrophobicContact CD2-CG2 4.08Å; F674-I732 HydrophobicContact CG-CG2 4.09Å; E676-I732 HydrophobicContact CG-CD1 4.03Å; I728-I732 HydrophobicContact CG2-CD1 3.88Å; I728-I732 HydrophobicContact CG2-CG1 4.41Å; I728-I732 WeakPolarHBondContact O-CG1 3.38Å; I728-I732 PolarHBondContact O-N 3.41Å; P729-I732 PolarHBondContact O-N 3.3Å; D730-I732 VanDerWaalsContact C-N 3.35Å; I732-R736 WeakPolarHBondContact O-CB 3.11Å; I732-R736 PolarHBondContact O-N 2.62Å
733	K	95.5	Very high	94.9	Very high	128 Å²	128	40.8 Å²	40.8	56%	0.557	20%	0.197	S	C	*	.	H	α-helix	trans	-58.6	-49.3	170.8	-83.9	-165.5	166.8	-167.3	0	111	E8 P729 D730 L735 R736 S737	E8-K733 IonicContact OE1-NZ 2.75Å; E8-K733 PolarHBondContact OE1-NZ 3.34Å; P729-K733 PolarHBondContact O-N 3.14Å; P729-K733 VanDerWaalsContact O-N 3.1Å; D730-K733 WeakPolarHBondContact O-CB 3.49Å; D730-K733 PolarHBondContact O-N 3.2Å; K733-L735 PolarHBondContact O-N 3.11Å; K733-R736 PolarHBondContact O-N 2.73Å; K733-S737 PolarHBondContact O-N 3.18Å; K733-S737 VanDerWaalsContact O-N 3.09Å
734	E	95.3	Very high	94.9	Very high	39 Å²	39	41.8 Å²	41.8	18%	0.182	20%	0.201	C	C	.	.	H	α-helix	trans	-62.3	-42.2	-178.8	-161.1	-169.2	103.4	0	0	112.6	E448 R612 F616 D730 S737 T738	E448-E734 HydrophobicContact CG-CG 4.3Å; R612-E734 VanDerWaalsContact CD-OE1 3.23Å; R612-E734 WeakPolarHBondContact CD-OE1 3.42Å; R612-E734 IonicContact CZ-OE1 2.66Å; R612-E734 IonicContact CZ-OE2 2.69Å; R612-E734 VanDerWaalsContact NE-CD 3.31Å; R612-E734 IonicContact NE-OE1 2.66Å; R612-E734 PolarHBondContact NE-OE1 3.08Å; R612-E734 IonicContact NE-OE2 3.8Å; R612-E734 PolarHBondContact NE-OE2 3.23Å; R612-E734 VanDerWaalsContact NE-OE2 3.13Å; R612-E734 IonicContact NH2-OE1 3.91Å; R612-E734 IonicContact NH2-OE2 3.18Å; R612-E734 PolarHBondContact NH2-OE2 3.35Å; F616-E734 HydrophobicContact CZ-CB 4.15Å; F616-E734 HydrophobicContact CZ-CG 4.15Å; F616-E734 WeakPolarHBondContact CZ-OE1 3.25Å; D730-E734 WeakPolarHBondContact O-CB 3.45Å; D730-E734 PolarHBondContact O-N 3.16Å; E734-S737 PolarHBondContact O-N 3.48Å; E734-T738 PolarHBondContact O-N 3.34Å; E734-T738 PolarHBondContact O-OG1 3.35Å
735	L	95.6	Very high	94.8	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-65.3	-41.7	175.9	-179.2	60.5	0	0	0	111.9	V327 Y615 F616 A619 V650 F674 L731 K733 T738 L739	V327-L735 HydrophobicContact CG1-CD1 3.95Å; Y615-L735 HydrophobicContact CD1-CD2 4.24Å; Y615-L735 HydrophobicContact CE1-CD2 3.77Å; F616-L735 HydrophobicContact CD1-CB 4.37Å; F616-L735 HydrophobicContact CD1-CD1 4.17Å; F616-L735 HydrophobicContact CD2-CD1 3.85Å; F616-L735 HydrophobicContact CE1-CB 3.82Å; F616-L735 HydrophobicContact CE1-CD1 4.31Å; F616-L735 HydrophobicContact CE2-CB 4.41Å; F616-L735 HydrophobicContact CE2-CD1 4.01Å; F616-L735 HydrophobicContact CG-CD1 3.93Å; F616-L735 HydrophobicContact CZ-CB 3.85Å; F616-L735 HydrophobicContact CZ-CD1 4.24Å; A619-L735 HydrophobicContact CB-CD2 3.49Å; A619-L735 VanDerWaalsContact CB-CD2 3.49Å; V650-L735 HydrophobicContact CG1-CD1 4.31Å; V650-L735 HydrophobicContact CG2-CD2 4.38Å; F674-L735 HydrophobicContact CD1-CD2 3.81Å; F674-L735 HydrophobicContact CE1-CD2 3.81Å; F674-L735 HydrophobicContact CE1-CG 4.07Å; L731-L735 WeakPolarHBondContact O-CB 3.25Å; L731-L735 PolarHBondContact O-N 3.24Å; K733-L735 PolarHBondContact O-N 3.11Å; L735-T738 PolarHBondContact O-N 2.91Å; L735-L739 HydrophobicContact CD1-CD1 4.08Å; L735-L739 HydrophobicContact CD1-CG 4.18Å; L735-L739 HydrophobicContact CG-CD1 3.97Å; L735-L739 HydrophobicContact CG-CG 4.49Å; L735-L739 VanDerWaalsContact O-CG 3.28Å; L735-L739 WeakPolarHBondContact O-CG 3.41Å; L735-L739 PolarHBondContact O-N 3.19Å
736	R	95.9	Very high	94.7	Very high	76 Å²	76	37.4 Å²	37.4	29%	0.287	18%	0.183	S	C	.	.	H	α-helix	trans	-62.5	-41.3	176.9	-179.2	166.7	179.9	126.4	0.6	111.8	F658 E665 F674 I732 K733 H740	F658-R736 HydrophobicContact CE1-CG 4.3Å; F658-R736 HydrophobicContact CZ-CG 4.12Å; E665-R736 IonicContact OE2-CZ 2.75Å; E665-R736 IonicContact OE2-NH1 3.56Å; E665-R736 PolarHBondContact OE2-NH1 2.69Å; E665-R736 IonicContact OE2-NH2 2.75Å; E665-R736 PolarHBondContact OE2-NH2 2.92Å; F674-R736 HydrophobicContact CE2-CB 4.42Å; I732-R736 WeakPolarHBondContact O-CB 3.11Å; I732-R736 PolarHBondContact O-N 2.62Å; K733-R736 PolarHBondContact O-N 2.73Å; R736-H740 WeakPolarHBondContact O-CB 3.5Å; R736-H740 PolarHBondContact O-N 2.91Å; R736-H740 VanDerWaalsContact O-N 3.11Å
737	S	94.6	Very high	94.6	Very high	55 Å²	55	35.9 Å²	35.9	39%	0.385	18%	0.177	S	C	.	.	H	α-helix	trans	-61.7	-50.7	172.6	-157.9	0	0	0	0	110.9	K733 E734 L739 H740 E741	K733-S737 PolarHBondContact O-N 3.18Å; K733-S737 VanDerWaalsContact O-N 3.09Å; E734-S737 PolarHBondContact O-N 3.48Å; S737-L739 VanDerWaalsContact C-N 3.31Å; S737-L739 PolarHBondContact O-N 3.33Å; S737-H740 WeakPolarHBondContact O-CB 3.28Å; S737-H740 PolarHBondContact O-N 2.88Å; S737-E741 WeakPolarHBondContact CB-OE1 3.42Å; S737-E741 WeakPolarHBondContact O-CG 3.16Å; S737-E741 PolarHBondContact O-N 3.18Å; S737-E741 PolarHBondContact OG-OE1 2.8Å
738	T	94.3	Very high	94.5	Very high	29 Å²	29	36 Å²	36	18%	0.178	18%	0.177	C	C	.	.	H	α-helix	trans	-54.6	-44.2	-179.7	-55.2	0	0	0	0	112.3	V327 E734 L735 E742	V327-T738 HydrophobicContact CG2-CG2 3.74Å; E734-T738 PolarHBondContact O-N 3.34Å; E734-T738 PolarHBondContact O-OG1 3.35Å; L735-T738 PolarHBondContact O-N 2.91Å; T738-E742 WeakPolarHBondContact O-CB 3.41Å; T738-E742 VanDerWaalsContact O-CG 3.28Å; T738-E742 WeakPolarHBondContact O-CG 3.35Å; T738-E742 PolarHBondContact O-N 3.13Å
739	L	95.3	Very high	94.3	Very high	1 Å²	1	40.9 Å²	40.9	1%	0.005	20%	0.196	C	C	.	.	H	α-helix	trans	-72.6	-31.6	179.7	-66.5	168.5	0	0	0	113.5	V327 V650 L653 F658 F674 L735 S737 A743	V327-L739 HydrophobicContact CB-CD2 4.29Å; V650-L739 HydrophobicContact CG1-CD1 3.54Å; V650-L739 HydrophobicContact CG1-CD2 3.39Å; V650-L739 HydrophobicContact CG1-CG 4Å; V650-L739 HydrophobicContact CG2-CD1 4.38Å; L653-L739 HydrophobicContact CD1-CD1 4.32Å; L653-L739 HydrophobicContact CD1-CD2 4.46Å; F658-L739 HydrophobicContact CD1-CB 3.58Å; F658-L739 HydrophobicContact CD2-CB 4.39Å; F658-L739 HydrophobicContact CE1-CB 3.59Å; F658-L739 HydrophobicContact CE2-CB 4.42Å; F658-L739 HydrophobicContact CE2-CD1 4.2Å; F658-L739 HydrophobicContact CG-CB 4Å; F658-L739 HydrophobicContact CZ-CB 4.04Å; F658-L739 HydrophobicContact CZ-CD1 4.22Å; F674-L739 HydrophobicContact CE1-CD1 3.81Å; F674-L739 HydrophobicContact CZ-CD1 3.92Å; L735-L739 HydrophobicContact CD1-CD1 4.08Å; L735-L739 HydrophobicContact CD1-CG 4.18Å; L735-L739 HydrophobicContact CG-CD1 3.97Å; L735-L739 HydrophobicContact CG-CG 4.49Å; L735-L739 VanDerWaalsContact O-CG 3.28Å; L735-L739 WeakPolarHBondContact O-CG 3.41Å; L735-L739 PolarHBondContact O-N 3.19Å; S737-L739 VanDerWaalsContact C-N 3.31Å; S737-L739 PolarHBondContact O-N 3.33Å; L739-A743 WeakPolarHBondContact O-CB 3.15Å; L739-A743 PolarHBondContact O-N 2.88Å; L739-A743 VanDerWaalsContact O-N 3.16Å
740	H	94.8	Very high	94.1	Very high	48 Å²	48	39.9 Å²	39.9	22%	0.222	19%	0.19	C	C	.	.	H	α-helix	trans	-68.2	-49.3	173.8	-173.8	-124	0	0	0	110.5	F658 M662 R736 S737 E742 A743 Q744	F658-H740 HydrophobicContact CD1-CB 4.4Å; F658-H740 HydrophobicContact CE1-CB 4.32Å; M662-H740 VanDerWaalsContact CE-CD2 3.49Å; M662-H740 WeakPolarHBondContact CE-CD2 3.36Å; M662-H740 HydrophobicContact SD-CB 4.1Å; M662-H740 PolarHBondContact SD-CD2 3.37Å; R736-H740 WeakPolarHBondContact O-CB 3.5Å; R736-H740 PolarHBondContact O-N 2.91Å; R736-H740 VanDerWaalsContact O-N 3.11Å; S737-H740 WeakPolarHBondContact O-CB 3.28Å; S737-H740 PolarHBondContact O-N 2.88Å; H740-E742 PolarHBondContact O-N 2.84Å; H740-A743 PolarHBondContact O-N 2.84Å; H740-Q744 VanDerWaalsContact CE1-CD 3.48Å; H740-Q744 PolarHBondContact CE1-NE2 2.85Å; H740-Q744 WeakPolarHBondContact O-CG 3.34Å; H740-Q744 PolarHBondContact O-N 3.4Å
741	E	93.1	Very high	94.1	Very high	90 Å²	90	37.3 Å²	37.3	42%	0.421	18%	0.176	S	C	.	.	H	α-helix	trans	-58.7	-46.3	175.6	-68.9	164.2	-128.5	0	0	111.6	S737 A743 Q744 Q745	S737-E741 WeakPolarHBondContact CB-OE1 3.42Å; S737-E741 WeakPolarHBondContact O-CG 3.16Å; S737-E741 PolarHBondContact O-N 3.18Å; S737-E741 PolarHBondContact OG-OE1 2.8Å; E741-A743 VanDerWaalsContact C-N 3.33Å; E741-A743 PolarHBondContact O-N 3.17Å; E741-Q744 PolarHBondContact O-N 3.16Å; E741-Q745 VanDerWaalsContact O-CG 3.3Å; E741-Q745 WeakPolarHBondContact O-CG 3.48Å; E741-Q745 PolarHBondContact O-N 2.83Å
742	E	93.7	Very high	93.9	Very high	23 Å²	23	38 Å²	38	11%	0.107	18%	0.18	C	C	.	.	H	α-helix	trans	-58.2	-41.9	176.1	-81.7	-178.9	-177.7	0	0	112.8	T326 V327 S328 Q330 T738 H740 F746	T326-E742 WeakPolarHBondContact CA-OE1 3.34Å; T326-E742 VanDerWaalsContact CB-CD 3.47Å; T326-E742 VanDerWaalsContact CB-OE1 3.28Å; T326-E742 WeakPolarHBondContact CB-OE1 3.17Å; T326-E742 HydrophobicContact CG2-CG 3.98Å; V327-E742 PolarHBondContact N-OE1 2.85Å; V327-E742 PolarHBondContact N-OE2 3.42Å; S328-E742 WeakPolarHBondContact CB-OE2 3.22Å; S328-E742 PolarHBondContact N-OE2 2.82Å; S328-E742 PolarHBondContact OG-OE2 2.7Å; Q330-E742 HydrophobicContact CG-CB 3.97Å; Q330-E742 HydrophobicContact CG-CG 4.49Å; Q330-E742 PolarHBondContact OE1-O 3.11Å; T738-E742 WeakPolarHBondContact O-CB 3.41Å; T738-E742 VanDerWaalsContact O-CG 3.28Å; T738-E742 WeakPolarHBondContact O-CG 3.35Å; T738-E742 PolarHBondContact O-N 3.13Å; H740-E742 PolarHBondContact O-N 2.84Å; E742-F746 PolarHBondContact O-N 2.81Å
743	A	93.9	Very high	93.8	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-71.7	-37.2	176.8	0	0	0	0	0	112.6	G655 F658 I659 L739 H740 E741 Q745 F746 V747	G655-A743 WeakPolarHBondContact O-CB 3.27Å; F658-A743 HydrophobicContact CB-CB 4.31Å; I659-A743 HydrophobicContact CD1-CB 3.8Å; I659-A743 HydrophobicContact CG1-CB 3.79Å; L739-A743 WeakPolarHBondContact O-CB 3.15Å; L739-A743 PolarHBondContact O-N 2.88Å; L739-A743 VanDerWaalsContact O-N 3.16Å; H740-A743 PolarHBondContact O-N 2.84Å; E741-A743 VanDerWaalsContact C-N 3.33Å; E741-A743 PolarHBondContact O-N 3.17Å; A743-Q745 VanDerWaalsContact C-N 3.35Å; A743-F746 WeakPolarHBondContact O-CB 3.38Å; A743-F746 PolarHBondContact O-N 3.06Å; A743-F746 VanDerWaalsContact O-N 3.16Å; A743-V747 PolarHBondContact O-N 2.87Å; A743-V747 VanDerWaalsContact O-N 3.1Å
744	Q	94	Very high	93.6	Very high	22 Å²	22	34.2 Å²	34.2	10%	0.103	17%	0.169	C	C	.	.	H	α-helix	trans	-63.6	-40.2	173.6	-73.5	-178.8	-38.6	0	0	111.3	I659 H740 E741 F746 V747 L748 R952 V953	I659-Q744 HydrophobicContact CD1-CG 3.93Å; H740-Q744 VanDerWaalsContact CE1-CD 3.48Å; H740-Q744 PolarHBondContact CE1-NE2 2.85Å; H740-Q744 WeakPolarHBondContact O-CG 3.34Å; H740-Q744 PolarHBondContact O-N 3.4Å; E741-Q744 PolarHBondContact O-N 3.16Å; Q744-F746 VanDerWaalsContact C-N 3.25Å; Q744-F746 PolarHBondContact O-N 3.45Å; Q744-V747 PolarHBondContact O-N 2.91Å; Q744-V747 VanDerWaalsContact O-N 3.12Å; Q744-L748 WeakPolarHBondContact O-CG 3.43Å; Q744-L748 PolarHBondContact O-N 3.38Å; Q744-R952 PolarHBondContact NE2-O 2.72Å; Q744-V953 HydrophobicContact CB-CG2 4.28Å; Q744-V953 HydrophobicContact CG-CG2 4.28Å
745	Q	91.9	Very high	93.6	Very high	67 Å²	67	32.4 Å²	32.4	31%	0.313	16%	0.161	S	C	.	.	H	α-helix	trans	-64.7	-25.2	173.6	-68.6	-60.5	-30.4	0	0	113.4	E741 A743 R749	E741-Q745 VanDerWaalsContact O-CG 3.3Å; E741-Q745 WeakPolarHBondContact O-CG 3.48Å; E741-Q745 PolarHBondContact O-N 2.83Å; A743-Q745 VanDerWaalsContact C-N 3.35Å; Q745-R749 WeakPolarHBondContact O-CB 3.28Å; Q745-R749 VanDerWaalsContact O-CG 3.22Å; Q745-R749 WeakPolarHBondContact O-CG 3.03Å; Q745-R749 PolarHBondContact O-N 2.61Å; Q745-R749 PolarHBondContact O-NE 2.89Å; Q745-R749 VanDerWaalsContact O-NE 3.1Å
746	F	92.7	Very high	93.6	Very high	40 Å²	40	36 Å²	36	18%	0.175	18%	0.175	C	C	.	.	H	α-helix	trans	-74.6	-40.4	169.6	175.8	-86	0	0	0	112.5	D656 E742 A743 Q744 S750	D656-F746 HydrophobicContact CB-CD1 4.14Å; D656-F746 HydrophobicContact CB-CE1 4.36Å; E742-F746 PolarHBondContact O-N 2.81Å; A743-F746 WeakPolarHBondContact O-CB 3.38Å; A743-F746 PolarHBondContact O-N 3.06Å; A743-F746 VanDerWaalsContact O-N 3.16Å; Q744-F746 VanDerWaalsContact C-N 3.25Å; Q744-F746 PolarHBondContact O-N 3.45Å; F746-S750 WeakPolarHBondContact O-CB 3.11Å; F746-S750 PolarHBondContact O-N 2.91Å; F746-S750 PolarHBondContact O-OG 3.33Å
747	V	93.1	Very high	93.4	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-63.2	-46.9	174.3	175.2	0	0	0	0	110.7	D656 I659 A743 Q744 R749 S750 C751 H947 L949 V953	D656-V747 HydrophobicContact CB-CG2 4.22Å; I659-V747 HydrophobicContact CD1-CG2 4.06Å; A743-V747 PolarHBondContact O-N 2.87Å; A743-V747 VanDerWaalsContact O-N 3.1Å; Q744-V747 PolarHBondContact O-N 2.91Å; Q744-V747 VanDerWaalsContact O-N 3.12Å; V747-R749 PolarHBondContact O-N 3.15Å; V747-S750 WeakPolarHBondContact O-CA 3.37Å; V747-S750 WeakPolarHBondContact O-CB 3.47Å; V747-S750 PolarHBondContact O-N 2.82Å; V747-S750 VanDerWaalsContact O-N 3.08Å; V747-C751 PolarHBondContact O-N 3.01Å; V747-C751 PolarHBondContact O-SG 3.01Å; V747-H947 HydrophobicContact CG1-CB 4.28Å; V747-L949 HydrophobicContact CG2-CB 4.38Å; V747-V953 HydrophobicContact CB-CG2 3.83Å; V747-V953 HydrophobicContact CG1-CG2 3.61Å
748	L	93.5	Very high	93.4	Very high	2 Å²	2	35.4 Å²	35.4	1%	0.01	17%	0.166	C	C	.	.	H	α-helix	trans	-55.6	-49	176	-77.8	165.8	0	0	0	112.7	Q744 S750 C751 T752 V953 Q957 L958 Q961	Q744-L748 WeakPolarHBondContact O-CG 3.43Å; Q744-L748 PolarHBondContact O-N 3.38Å; L748-S750 VanDerWaalsContact C-N 3.26Å; L748-S750 PolarHBondContact O-N 3.23Å; L748-C751 PolarHBondContact O-N 2.84Å; L748-T752 PolarHBondContact O-N 2.88Å; L748-T752 PolarHBondContact O-OG1 3.26Å; L748-V953 HydrophobicContact CD1-CG1 4.05Å; L748-V953 HydrophobicContact CD2-CG1 3.6Å; L748-V953 HydrophobicContact CG-CG1 3.68Å; L748-Q957 HydrophobicContact CD1-CG 3.76Å; L748-Q957 HydrophobicContact CD2-CG 4.4Å; L748-L958 HydrophobicContact CD2-CB 4.3Å; L748-L958 HydrophobicContact CD2-CD1 4.1Å; L748-Q961 HydrophobicContact CD2-CB 4.17Å; L748-Q961 HydrophobicContact CD2-CG 4.13Å
749	R	91.2	Very high	93.5	Very high	102 Å²	102	34 Å²	34	39%	0.385	16%	0.158	S	C	.	.	H	α-helix	trans	-64.8	-29.6	177.1	-70.7	-177	-62.3	160.7	4	112.7	Q330 E331 Q745 V747 T752 G753	Q330-R749 PolarHBondContact O-NH2 3.27Å; E331-R749 IonicContact OE1-CZ 2.8Å; E331-R749 IonicContact OE1-NH1 3.31Å; E331-R749 PolarHBondContact OE1-NH1 2.81Å; Q745-R749 WeakPolarHBondContact O-CB 3.28Å; Q745-R749 VanDerWaalsContact O-CG 3.22Å; Q745-R749 WeakPolarHBondContact O-CG 3.03Å; Q745-R749 PolarHBondContact O-N 2.61Å; Q745-R749 PolarHBondContact O-NE 2.89Å; Q745-R749 VanDerWaalsContact O-NE 3.1Å; V747-R749 PolarHBondContact O-N 3.15Å; R749-T752 WeakPolarHBondContact CA-OG1 3.21Å; R749-T752 PolarHBondContact O-OG1 3.21Å; R749-G753 PolarHBondContact O-N 3.35Å
750	S	91.1	Very high	93.4	Very high	29 Å²	29	35.7 Å²	35.7	20%	0.203	17%	0.165	C	C	.	.	H	α-helix	trans	-71.5	-41	172.7	-58.4	0	0	0	0	111.8	F746 V747 L748 K754	F746-S750 WeakPolarHBondContact O-CB 3.11Å; F746-S750 PolarHBondContact O-N 2.91Å; F746-S750 PolarHBondContact O-OG 3.33Å; V747-S750 WeakPolarHBondContact O-CA 3.37Å; V747-S750 WeakPolarHBondContact O-CB 3.47Å; V747-S750 PolarHBondContact O-N 2.82Å; V747-S750 VanDerWaalsContact O-N 3.08Å; L748-S750 VanDerWaalsContact C-N 3.26Å; L748-S750 PolarHBondContact O-N 3.23Å; S750-K754 PolarHBondContact O-N 3.49Å; S750-K754 VanDerWaalsContact O-N 3.13Å
751	C	94.2	Very high	93.4	Very high	0 Å²	0	35 Å²	35	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-65.2	-52.8	176.6	-66.8	0	0	0	0	112.2	V747 L748 G753 K754 L755 Y946 H947 L958	V747-C751 PolarHBondContact O-N 3.01Å; V747-C751 PolarHBondContact O-SG 3.01Å; L748-C751 PolarHBondContact O-N 2.84Å; C751-G753 VanDerWaalsContact C-N 3.32Å; C751-G753 PolarHBondContact O-N 2.85Å; C751-K754 PolarHBondContact O-N 3.44Å; C751-K754 VanDerWaalsContact O-N 3.08Å; C751-L755 PolarHBondContact O-N 3.36Å; C751-Y946 HydrophobicContact CB-CG 4.32Å; C751-H947 VanDerWaalsContact SG-CB 3.54Å; C751-L958 HydrophobicContact CB-CD1 3.88Å
752	T	92.8	Very high	93.5	Very high	14 Å²	14	31.1 Å²	31.1	9%	0.086	15%	0.147	C	C	.	.	H	α-helix	trans	-63.6	-37.7	178.2	53.3	0	0	0	0	112	L748 R749 K754 L755 Y756 Q961 Q965	L748-T752 PolarHBondContact O-N 2.88Å; L748-T752 PolarHBondContact O-OG1 3.26Å; R749-T752 WeakPolarHBondContact CA-OG1 3.21Å; R749-T752 PolarHBondContact O-OG1 3.21Å; T752-K754 VanDerWaalsContact C-N 3.26Å; T752-K754 PolarHBondContact O-N 3.3Å; T752-L755 PolarHBondContact O-N 2.71Å; T752-Y756 VanDerWaalsContact O-CB 3.27Å; T752-Y756 WeakPolarHBondContact O-CB 3.31Å; T752-Y756 PolarHBondContact O-N 2.77Å; T752-Q961 HydrophobicContact CG2-CB 3.74Å; T752-Q961 WeakPolarHBondContact CG2-O 3.47Å; T752-Q965 HydrophobicContact CG2-CG 4.22Å
753	G	92.5	Very high	93.4	Very high	23 Å²	23	31.6 Å²	31.6	24%	0.237	15%	0.152	C	C	.	.	H	α-helix	trans	-61.4	-31	172.7	0	0	0	0	0	113.8	R749 C751 K757	R749-G753 PolarHBondContact O-N 3.35Å; C751-G753 VanDerWaalsContact C-N 3.32Å; C751-G753 PolarHBondContact O-N 2.85Å; G753-K757 PolarHBondContact O-N 3.2Å
754	K	93	Very high	93.5	Very high	59 Å²	59	33.1 Å²	33.1	26%	0.257	16%	0.158	S	C	.	.	H	α-helix	trans	-79.5	-41.7	174	-169.6	175.1	169.3	-172.5	0	112.3	S750 C751 T752 Y756 K757 W758 R945 Y946	S750-K754 PolarHBondContact O-N 3.49Å; S750-K754 VanDerWaalsContact O-N 3.13Å; C751-K754 PolarHBondContact O-N 3.44Å; C751-K754 VanDerWaalsContact O-N 3.08Å; T752-K754 VanDerWaalsContact C-N 3.26Å; T752-K754 PolarHBondContact O-N 3.3Å; K754-Y756 PolarHBondContact O-N 3.44Å; K754-K757 WeakPolarHBondContact O-CB 3.43Å; K754-K757 PolarHBondContact O-N 3.44Å; K754-W758 HydrophobicContact CD-CZ2 4.32Å; K754-W758 HydrophobicContact CG-CZ2 4.25Å; K754-W758 PolarHBondContact O-N 3.08Å; K754-R945 PolarHBondContact NZ-O 3.43Å; K754-Y946 WeakPolarHBondContact CD-O 3.42Å
755	L	94.9	Very high	93.3	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-61.1	-44.2	172.4	179.8	60.6	0	0	0	111.3	C751 T752 K757 W758 L759 Y946 L962 Q965 F966	C751-L755 PolarHBondContact O-N 3.36Å; T752-L755 PolarHBondContact O-N 2.71Å; L755-K757 VanDerWaalsContact C-N 3.31Å; L755-K757 PolarHBondContact O-N 2.87Å; L755-W758 HydrophobicContact CD1-CE3 4.25Å; L755-W758 WeakPolarHBondContact O-CA 3.44Å; L755-W758 WeakPolarHBondContact O-CB 3.36Å; L755-W758 PolarHBondContact O-N 3.33Å; L755-L759 HydrophobicContact CD1-CD1 3.89Å; L755-L759 HydrophobicContact CD1-CD2 4.03Å; L755-L759 HydrophobicContact CD1-CG 3.73Å; L755-L759 HydrophobicContact CD2-CD1 4.17Å; L755-L759 HydrophobicContact CG-CD1 3.79Å; L755-L759 HydrophobicContact CG-CG 4Å; L755-L759 WeakPolarHBondContact O-CG 3.46Å; L755-L759 PolarHBondContact O-N 3.4Å; L755-Y946 HydrophobicContact CB-CD1 4.35Å; L755-Y946 HydrophobicContact CB-CE1 3.94Å; L755-Y946 HydrophobicContact CD1-CE1 4.23Å; L755-L962 HydrophobicContact CB-CD2 3.96Å; L755-L962 HydrophobicContact CD2-CB 3.88Å; L755-L962 HydrophobicContact CD2-CD2 3.6Å; L755-L962 HydrophobicContact CD2-CG 4.31Å; L755-L962 HydrophobicContact CG-CD2 4.39Å; L755-Q965 HydrophobicContact CD2-CB 4.04Å; L755-Q965 HydrophobicContact CG-CB 4.41Å; L755-F966 HydrophobicContact CD1-CE2 4.29Å; L755-F966 HydrophobicContact CD1-CZ 4.38Å; L755-F966 HydrophobicContact CD2-CD2 4.04Å; L755-F966 HydrophobicContact CD2-CE2 3.79Å
756	Y	94.6	Very high	93.1	Very high	77 Å²	77	37.3 Å²	37.3	30%	0.302	18%	0.177	S	C	.	.	H	α-helix	trans	-56.1	-42	175.7	168.7	-109.1	0	0	0	112.4	T752 K754 W758 L759 K760	T752-Y756 VanDerWaalsContact O-CB 3.27Å; T752-Y756 WeakPolarHBondContact O-CB 3.31Å; T752-Y756 PolarHBondContact O-N 2.77Å; K754-Y756 PolarHBondContact O-N 3.44Å; Y756-W758 PolarHBondContact O-N 2.95Å; Y756-L759 PolarHBondContact O-N 3.36Å; Y756-K760 HydrophobicContact CD1-CD 4.34Å; Y756-K760 HydrophobicContact CD2-CB 4.38Å; Y756-K760 HydrophobicContact CE1-CD 3.72Å; Y756-K760 HydrophobicContact CE2-CB 3.94Å; Y756-K760 HydrophobicContact CE2-CD 4.33Å; Y756-K760 WeakPolarHBondContact O-CB 3.28Å; Y756-K760 VanDerWaalsContact O-CG 3.3Å; Y756-K760 WeakPolarHBondContact O-CG 3.01Å; Y756-K760 PolarHBondContact O-N 3.39Å
757	K	93	Very high	92.7	Very high	70 Å²	70	44.2 Å²	44.2	30%	0.304	21%	0.21	S	C	.	.	H	α-helix	trans	-57.7	-35.8	173.6	-81.9	175.9	166.9	-176.1	0	113.2	G753 K754 L755 W1722	G753-K757 PolarHBondContact O-N 3.2Å; K754-K757 WeakPolarHBondContact O-CB 3.43Å; K754-K757 PolarHBondContact O-N 3.44Å; L755-K757 VanDerWaalsContact C-N 3.31Å; L755-K757 PolarHBondContact O-N 2.87Å; K757-W1722 VanDerWaalsContact CE-CD1 3.44Å; K757-W1722 VanDerWaalsContact CE-CD2 3.5Å; K757-W1722 VanDerWaalsContact CE-CE2 3.42Å; K757-W1722 VanDerWaalsContact CE-CG 3.47Å; K757-W1722 VanDerWaalsContact NZ-CE2 3.29Å; K757-W1722 VanDerWaalsContact NZ-CG 3.31Å
758	W	94.3	Very high	92	Very high	48 Å²	48	46 Å²	46	18%	0.182	22%	0.22	C	C	.	.	H	α-helix	trans	-77.6	-48.6	-179.9	-64.9	-25.9	0	0	0	111.6	K754 L755 Y756 K760 V761 Y931 L944 Y946	K754-W758 HydrophobicContact CD-CZ2 4.32Å; K754-W758 HydrophobicContact CG-CZ2 4.25Å; K754-W758 PolarHBondContact O-N 3.08Å; L755-W758 HydrophobicContact CD1-CE3 4.25Å; L755-W758 WeakPolarHBondContact O-CA 3.44Å; L755-W758 WeakPolarHBondContact O-CB 3.36Å; L755-W758 PolarHBondContact O-N 3.33Å; Y756-W758 PolarHBondContact O-N 2.95Å; W758-K760 VanDerWaalsContact C-N 3.34Å; W758-K760 PolarHBondContact O-N 2.86Å; W758-V761 PolarHBondContact O-N 2.73Å; W758-Y931 HydrophobicContact CB-CD2 4.29Å; W758-Y931 HydrophobicContact CB-CE2 3.69Å; W758-Y931 HydrophobicContact CD2-CE1 4.1Å; W758-Y931 HydrophobicContact CD2-CE2 4.47Å; W758-Y931 AromaticContact CD2-CZ 3.75Å; W758-Y931 HydrophobicContact CE3-CD1 4.35Å; W758-Y931 AromaticContact CE3-CE1 3.53Å; W758-Y931 HydrophobicContact CE3-CE1 3.53Å; W758-Y931 AromaticContact CE3-CZ 3.69Å; W758-Y931 HydrophobicContact CG-CE2 4.17Å; W758-Y931 AromaticContact CG-CZ 3.89Å; W758-Y931 AromaticContact CZ3-CE1 3.88Å; W758-Y931 HydrophobicContact CZ3-CE1 3.88Å; W758-L944 HydrophobicContact CH2-CD2 4.31Å; W758-L944 HydrophobicContact CZ3-CB 4.32Å; W758-L944 HydrophobicContact CZ3-CD1 4.16Å; W758-L944 HydrophobicContact CZ3-CD2 4.3Å; W758-Y946 HydrophobicContact CE3-CE1 4.11Å; W758-Y946 HydrophobicContact CH2-CE1 4.48Å; W758-Y946 AromaticContact CZ3-CD1 3.92Å; W758-Y946 HydrophobicContact CZ3-CD1 3.92Å; W758-Y946 AromaticContact CZ3-CE1 3.54Å; W758-Y946 HydrophobicContact CZ3-CE1 3.54Å
759	L	95.1	Very high	91.3	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-72	-23.5	-178	-56.9	-175.1	0	0	0	113.5	L755 Y756 V761 L928 Y931 F966 R969 R1140	L755-L759 HydrophobicContact CD1-CD1 3.89Å; L755-L759 HydrophobicContact CD1-CD2 4.03Å; L755-L759 HydrophobicContact CD1-CG 3.73Å; L755-L759 HydrophobicContact CD2-CD1 4.17Å; L755-L759 HydrophobicContact CG-CD1 3.79Å; L755-L759 HydrophobicContact CG-CG 4Å; L755-L759 WeakPolarHBondContact O-CG 3.46Å; L755-L759 PolarHBondContact O-N 3.4Å; Y756-L759 PolarHBondContact O-N 3.36Å; L759-V761 PolarHBondContact O-N 3.03Å; L759-L928 HydrophobicContact CB-CD1 4.41Å; L759-L928 HydrophobicContact CD1-CD1 4.19Å; L759-L928 HydrophobicContact CD2-CD1 3.94Å; L759-L928 HydrophobicContact CG-CD1 4.4Å; L759-Y931 HydrophobicContact CD2-CD2 4.13Å; L759-Y931 HydrophobicContact CD2-CG 4.13Å; L759-F966 HydrophobicContact CD1-CD1 3.84Å; L759-F966 HydrophobicContact CD1-CD2 4.32Å; L759-F966 HydrophobicContact CD1-CE1 3.94Å; L759-F966 HydrophobicContact CD1-CE2 4.4Å; L759-F966 HydrophobicContact CD1-CG 4.04Å; L759-F966 HydrophobicContact CD1-CZ 4.23Å; L759-F966 HydrophobicContact CD2-CD1 4.46Å; L759-F966 HydrophobicContact CD2-CE1 3.85Å; L759-F966 HydrophobicContact CD2-CZ 4.19Å; L759-R969 HydrophobicContact CB-CB 4.32Å; L759-R969 HydrophobicContact CB-CG 3.75Å; L759-R969 HydrophobicContact CD1-CG 4.37Å; L759-R1140 WeakPolarHBondContact O-CD 3.29Å
760	K	94.3	Very high	90.4	Very high	35 Å²	35	48.2 Å²	48.2	15%	0.152	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.3	0.4	177.3	80.4	174.5	-167	166.4	0	114.7	Y756 W758 R1140 T1141	Y756-K760 HydrophobicContact CD1-CD 4.34Å; Y756-K760 HydrophobicContact CD2-CB 4.38Å; Y756-K760 HydrophobicContact CE1-CD 3.72Å; Y756-K760 HydrophobicContact CE2-CB 3.94Å; Y756-K760 HydrophobicContact CE2-CD 4.33Å; Y756-K760 WeakPolarHBondContact O-CB 3.28Å; Y756-K760 VanDerWaalsContact O-CG 3.3Å; Y756-K760 WeakPolarHBondContact O-CG 3.01Å; Y756-K760 PolarHBondContact O-N 3.39Å; W758-K760 VanDerWaalsContact C-N 3.34Å; W758-K760 PolarHBondContact O-N 2.86Å; K760-R1140 WeakPolarHBondContact O-CB 3.14Å; K760-T1141 WeakPolarHBondContact O-CB 3.27Å; K760-T1141 PolarHBondContact O-N 2.92Å
761	V	94.5	Very high	89.5	Confident	35 Å²	35	54 Å²	54	21%	0.212	28%	0.276	C	S	.	.	B	Isolated β-bridge	trans	-88.3	129.5	179.4	178.4	0	0	0	0	109.7	W758 L759 P927 T1141 Y1143	W758-V761 PolarHBondContact O-N 2.73Å; L759-V761 PolarHBondContact O-N 3.03Å; V761-P927 HydrophobicContact CB-CG 4.1Å; V761-P927 HydrophobicContact CG1-CG 4.12Å; V761-T1141 WeakPolarHBondContact CA-O 3.43Å; V761-Y1143 HydrophobicContact CG1-CD2 4.29Å
762	A	94.4	Very high	88.4	Confident	7 Å²	7	56.9 Å²	56.9	6%	0.058	29%	0.288	C	S	.	.			trans	-80.6	155.8	177.9	0	0	0	0	0	111.7	R1140 T1141	A762-R1140 HydrophobicContact CB-CB 3.76Å; A762-T1141 PolarHBondContact N-O 3.46Å
763	P	93.6	Very high	86.8	Confident	33 Å²	33	57.8 Å²	57.8	21%	0.214	30%	0.301	C	S	.	.			trans	-38.3	137.8	163.3	-35.8	37.1	0	0	0	114.1	K765 Q925 D926	P763-K765 PolarHBondContact O-N 2.83Å; P763-Q925 VanDerWaalsContact CA-O 3.28Å; P763-Q925 WeakPolarHBondContact CA-O 3.43Å; P763-Q925 WeakPolarHBondContact CB-O 3.35Å; P763-Q925 VanDerWaalsContact CG-O 3.29Å; P763-Q925 WeakPolarHBondContact CG-O 3.5Å; P763-D926 HydrophobicContact CG-CB 4.2Å; P763-D926 WeakPolarHBondContact CG-OD2 3.38Å
764	Y	94.2	Very high	85.2	Confident	33 Å²	33	66.6 Å²	66.6	13%	0.129	33%	0.328	C	S	.	.			trans	-63.8	136.1	176.6	-179.7	-108.1	0	0	0	111.4	P766 I783 I851 M924 Y1143	Y764-P766 HydrophobicContact CD1-CB 4.49Å; Y764-P766 HydrophobicContact CE1-CB 3.73Å; Y764-P766 HydrophobicContact CE1-CG 4.44Å; Y764-I783 HydrophobicContact CD1-CD1 3.93Å; Y764-I783 HydrophobicContact CG-CD1 4.43Å; Y764-I851 HydrophobicContact CD1-CB 4.09Å; Y764-I851 HydrophobicContact CD1-CD1 3.82Å; Y764-I851 HydrophobicContact CD1-CG2 3.79Å; Y764-I851 HydrophobicContact CD2-CD1 4.27Å; Y764-I851 HydrophobicContact CE1-CB 3.76Å; Y764-I851 HydrophobicContact CE1-CD1 3.59Å; Y764-I851 HydrophobicContact CE1-CG1 4.21Å; Y764-I851 HydrophobicContact CE1-CG2 4Å; Y764-I851 HydrophobicContact CE2-CD1 4.09Å; Y764-I851 HydrophobicContact CG-CD1 4.15Å; Y764-M924 HydrophobicContact CG-CG 4.47Å; Y764-M924 HydrophobicContact CG-SD 4.29Å; Y764-M924 PolarHBondContact N-O 2.64Å; Y764-Y1143 AromaticContact CD2-CD1 3.78Å; Y764-Y1143 HydrophobicContact CD2-CD1 3.78Å; Y764-Y1143 HydrophobicContact CD2-CG 4.33Å; Y764-Y1143 HydrophobicContact CE2-CD1 4.15Å
765	K	90.6	Very high	84.2	Confident	154 Å²	154	72.1 Å²	72.1	67%	0.67	36%	0.355	S	S	*	.			trans	-122.3	102.7	177.4	-65.1	-173.4	-179.1	-176.8	0	108.6	P763	P763-K765 PolarHBondContact O-N 2.83Å
766	P	87.7	Confident	83.3	Confident	22 Å²	22	77 Å²	77	14%	0.143	38%	0.378	C	S	.	.			trans	-67	142.4	-177.9	28.5	-36	0	0	0	111	Y764 L768 T779 I783 H850	Y764-P766 HydrophobicContact CD1-CB 4.49Å; Y764-P766 HydrophobicContact CE1-CB 3.73Å; Y764-P766 HydrophobicContact CE1-CG 4.44Å; P766-L768 VanDerWaalsContact C-N 3.32Å; P766-L768 HydrophobicContact CB-CG 4.35Å; P766-L768 HydrophobicContact CG-CG 4.36Å; P766-L768 PolarHBondContact O-N 3.23Å; P766-L768 VanDerWaalsContact O-N 3.13Å; P766-T779 HydrophobicContact CG-CG2 3.71Å; P766-I783 HydrophobicContact CG-CG2 4.13Å; P766-H850 HydrophobicContact CG-CB 4.24Å
767	Q	83.6	Confident	82.8	Confident	186 Å²	186	74 Å²	74	87%	0.869	37%	0.366	S	S	*	.			trans	-88.7	70.5	178.6	-62.7	-177.8	32.5	0	0	110.2
768	L	79.2	Confident	82.3	Confident	38 Å²	38	72.4 Å²	72.4	20%	0.199	36%	0.363	C	S	.	.			trans	-70.6	137.8	177.4	-63.5	175.2	0	0	0	111	P766 W777 T779 P882	P766-L768 VanDerWaalsContact C-N 3.32Å; P766-L768 HydrophobicContact CB-CG 4.35Å; P766-L768 HydrophobicContact CG-CG 4.36Å; P766-L768 PolarHBondContact O-N 3.23Å; P766-L768 VanDerWaalsContact O-N 3.13Å; L768-W777 HydrophobicContact CD1-CB 4.1Å; L768-W777 WeakPolarHBondContact CD1-O 3.44Å; L768-T779 HydrophobicContact CD1-CG2 3.77Å; L768-P882 HydrophobicContact CD2-CB 3.87Å; L768-P882 HydrophobicContact CD2-CG 4.06Å
769	P	79.2	Confident	81.8	Confident	41 Å²	41	72.7 Å²	72.7	27%	0.266	37%	0.37	S	S	.	.			trans	-61.7	147.5	170.2	-18.8	30.4	0	0	0	111.1	D771 F772 P883	P769-D771 PolarHBondContact O-N 3.29Å; P769-F772 HydrophobicContact CB-CD2 3.94Å; P769-F772 HydrophobicContact CB-CE2 4.23Å; P769-F772 HydrophobicContact CG-CD2 3.97Å; P769-F772 HydrophobicContact CG-CE2 4.06Å; P769-F772 PolarHBondContact O-N 2.9Å; P769-F772 VanDerWaalsContact O-N 3.1Å; P769-P883 HydrophobicContact CG-CG 4.32Å
770	P	71.5	Confident	80.9	Confident	108 Å²	108	80.3 Å²	80.3	70%	0.701	41%	0.41	S	S	*	.	G	3₁₀ helix	trans	-54.1	-34.5	-172.7	-28.4	35.7	0	0	0	114.7	F772 G773	P770-F772 PolarHBondContact O-N 3.28Å; P770-F772 VanDerWaalsContact O-N 3.12Å; P770-G773 PolarHBondContact O-N 3.28Å
771	D	73.1	Confident	80.1	Confident	151 Å²	151	88.9 Å²	88.9	81%	0.807	44%	0.442	S	S	*	.	G	3₁₀ helix	trans	-62.9	-18.4	-176.5	-53.7	-34.6	0	0	0	113.7	P769	P769-D771 PolarHBondContact O-N 3.29Å
772	F	71	Confident	79.7	Confident	60 Å²	60	88.6 Å²	88.6	26%	0.263	45%	0.446	S	S	.	.	G	3₁₀ helix	trans	-95.5	-8.5	-179.9	-65.8	-84.4	0	0	0	114.4	P769 P770 Y774 W777 Q880 P882	P769-F772 HydrophobicContact CB-CD2 3.94Å; P769-F772 HydrophobicContact CB-CE2 4.23Å; P769-F772 HydrophobicContact CG-CD2 3.97Å; P769-F772 HydrophobicContact CG-CE2 4.06Å; P769-F772 PolarHBondContact O-N 2.9Å; P769-F772 VanDerWaalsContact O-N 3.1Å; P770-F772 PolarHBondContact O-N 3.28Å; P770-F772 VanDerWaalsContact O-N 3.12Å; F772-Y774 VanDerWaalsContact C-N 3.34Å; F772-Y774 PolarHBondContact O-N 3.49Å; F772-W777 HydrophobicContact CB-CB 4.49Å; F772-Q880 WeakPolarHBondContact CE1-O 3.29Å; F772-P882 HydrophobicContact CD1-CB 4.12Å; F772-P882 HydrophobicContact CD1-CG 4.43Å; F772-P882 HydrophobicContact CD2-CB 4.15Å; F772-P882 HydrophobicContact CE1-CB 4.22Å; F772-P882 HydrophobicContact CE2-CB 4.25Å; F772-P882 HydrophobicContact CG-CB 4.08Å; F772-P882 HydrophobicContact CZ-CB 4.28Å
773	G	59.5	Low	79.6	Confident	34 Å²	34	88.8 Å²	88.8	35%	0.351	45%	0.446	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73	-11.4	-160.9	0	0	0	0	0	117.6	P770	P770-G773 PolarHBondContact O-N 3.28Å
774	Y	58.6	Low	79.7	Confident	208 Å²	208	90 Å²	90	82%	0.816	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.1	-28.4	-158	-78.8	-77.4	0	0	0	117.3	F772	F772-Y774 VanDerWaalsContact C-N 3.34Å; F772-Y774 PolarHBondContact O-N 3.49Å
775	E	70.6	Confident	79.8	Confident	174 Å²	174	88.4 Å²	88.4	81%	0.813	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-137.9	-85.4	-179.3	-65.4	-174.1	168	0	0	112.8	W777 S778	E775-W777 VanDerWaalsContact C-N 3.35Å; E775-W777 PolarHBondContact O-N 2.76Å; E775-S778 VanDerWaalsContact O-CB 3.32Å; E775-S778 WeakPolarHBondContact O-CB 3.23Å; E775-S778 PolarHBondContact O-N 3.09Å
776	E	77.1	Confident	80.2	Confident	103 Å²	103	81 Å²	81	48%	0.481	41%	0.408	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-29.5	-165.7	-170.4	176.9	-127.2	0	0	115.5	R784 K848	E776-R784 PolarHBondContact O-NH1 3.38Å; E776-R784 PolarHBondContact O-NH2 2.91Å; E776-R784 VanDerWaalsContact O-NH2 3.09Å; E776-K848 HydrophobicContact CG-CD 4.17Å; E776-K848 IonicContact OE1-NZ 2.64Å; E776-K848 PolarHBondContact OE1-NZ 3.49Å; E776-K848 IonicContact OE2-NZ 2.79Å; E776-K848 PolarHBondContact OE2-NZ 2.95Å
777	W	84.5	Confident	80.6	Confident	15 Å²	15	80 Å²	80	6%	0.057	40%	0.401	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.3	18.8	179.8	-58.7	93.8	0	0	0	112.4	L768 F772 E775 T779 K848 H850 F881 P882 I884	L768-W777 HydrophobicContact CD1-CB 4.1Å; L768-W777 WeakPolarHBondContact CD1-O 3.44Å; F772-W777 HydrophobicContact CB-CB 4.49Å; E775-W777 VanDerWaalsContact C-N 3.35Å; E775-W777 PolarHBondContact O-N 2.76Å; W777-T779 PolarHBondContact O-N 3.33Å; W777-K848 HydrophobicContact CH2-CB 3.55Å; W777-K848 HydrophobicContact CH2-CD 4.35Å; W777-K848 HydrophobicContact CH2-CG 3.94Å; W777-K848 HydrophobicContact CZ2-CB 3.94Å; W777-K848 HydrophobicContact CZ2-CD 3.86Å; W777-K848 HydrophobicContact CZ2-CG 3.95Å; W777-K848 HydrophobicContact CZ3-CB 3.98Å; W777-H850 AromaticContact CE3-CD2 3.96Å; W777-F881 AromaticContact CH2-CD1 3.7Å; W777-F881 HydrophobicContact CH2-CD1 3.7Å; W777-F881 AromaticContact CH2-CE1 3.75Å; W777-F881 HydrophobicContact CH2-CE1 3.75Å; W777-F881 HydrophobicContact CH2-CG 4.47Å; W777-F881 AromaticContact CZ2-CD1 3.84Å; W777-F881 HydrophobicContact CZ2-CD1 3.84Å; W777-F881 AromaticContact CZ2-CE1 3.9Å; W777-F881 HydrophobicContact CZ2-CE1 3.9Å; W777-F881 HydrophobicContact CZ2-CG 4.22Å; W777-F881 HydrophobicContact CZ2-CZ 4.33Å; W777-P882 HydrophobicContact CD2-CG 3.71Å; W777-P882 HydrophobicContact CE3-CG 3.84Å; W777-P882 HydrophobicContact CG-CG 4.21Å; W777-P882 HydrophobicContact CH2-CG 4.2Å; W777-P882 HydrophobicContact CZ2-CG 4.1Å; W777-P882 HydrophobicContact CZ3-CG 4.08Å; W777-I884 HydrophobicContact CH2-CD1 3.85Å; W777-I884 HydrophobicContact CZ3-CD1 3.98Å; W777-I884 HydrophobicContact CZ3-CG1 4.48Å
778	S	81.7	Confident	81.3	Confident	35 Å²	35	71.1 Å²	71.1	25%	0.245	36%	0.36	C	S	.	.			trans	-65.4	124.7	178.8	-174.9	0	0	0	0	111.6	E775	E775-S778 VanDerWaalsContact O-CB 3.32Å; E775-S778 WeakPolarHBondContact O-CB 3.23Å; E775-S778 PolarHBondContact O-N 3.09Å
779	T	83	Confident	82.2	Confident	54 Å²	54	69.4 Å²	69.4	33%	0.331	35%	0.351	S	S	.	.			trans	-99.1	6.3	-178.8	60.5	0	0	0	0	113.3	P766 L768 W777 R781 G782 I783	P766-T779 HydrophobicContact CG-CG2 3.71Å; L768-T779 HydrophobicContact CD1-CG2 3.77Å; W777-T779 PolarHBondContact O-N 3.33Å; T779-R781 PolarHBondContact O-N 3.02Å; T779-G782 WeakPolarHBondContact CA-O 2.99Å; T779-G782 PolarHBondContact O-N 3.19Å; T779-G782 VanDerWaalsContact O-N 3.08Å; T779-I783 HydrophobicContact CG2-CG2 4.1Å
780	L	76.6	Confident	83	Confident	160 Å²	160	67.6 Å²	67.6	84%	0.838	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-27.4	-174.2	-66.6	173.3	0	0	0	113.1
781	R	78.1	Confident	84.1	Confident	215 Å²	215	65.3 Å²	65.3	81%	0.811	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.1	7.9	177.8	-64.8	-173	175.7	-162.3	-2.6	114.2	T779 V805	T779-R781 PolarHBondContact O-N 3.02Å; R781-V805 HydrophobicContact CB-CG2 4.2Å
782	G	85.9	Confident	85	Confident	30 Å²	30	60.8 Å²	60.8	31%	0.309	30%	0.3	S	S	.	.			trans	108.2	-163.6	-171.3	0	0	0	0	0	112.9	T779	T779-G782 WeakPolarHBondContact CA-O 2.99Å; T779-G782 PolarHBondContact O-N 3.19Å; T779-G782 VanDerWaalsContact O-N 3.08Å
783	I	92.6	Very high	86	Confident	11 Å²	11	61.7 Å²	61.7	6%	0.056	31%	0.307	C	S	.	.			trans	-133.7	132.5	-170.6	51.8	164.5	0	0	0	113.7	Y764 P766 T779 V785 H850 I851 Q925	Y764-I783 HydrophobicContact CD1-CD1 3.93Å; Y764-I783 HydrophobicContact CG-CD1 4.43Å; P766-I783 HydrophobicContact CG-CG2 4.13Å; T779-I783 HydrophobicContact CG2-CG2 4.1Å; I783-V785 HydrophobicContact CD1-CG2 3.75Å; I783-V785 HydrophobicContact CG1-CG2 4.04Å; I783-H850 HydrophobicContact CB-CB 4.41Å; I783-H850 HydrophobicContact CG2-CB 4.26Å; I783-I851 HydrophobicContact CD1-CG2 4.28Å; I783-Q925 HydrophobicContact CG1-CG 4.45Å; I783-Q925 PolarHBondContact O-NE2 3.33Å
784	R	94.9	Very high	87.4	Confident	57 Å²	57	65.2 Å²	65.2	22%	0.215	31%	0.314	C	S	.	.			trans	-69.4	127.5	160.4	-54.8	177.4	-61.8	-99.6	5.5	109.7	E776 T803 V805 K848 H850	E776-R784 PolarHBondContact O-NH1 3.38Å; E776-R784 PolarHBondContact O-NH2 2.91Å; E776-R784 VanDerWaalsContact O-NH2 3.09Å; R784-T803 WeakPolarHBondContact CA-O 3.2Å; R784-T803 WeakPolarHBondContact CB-O 3.34Å; R784-V805 HydrophobicContact CG-CG1 4.05Å; R784-K848 VanDerWaalsContact CZ-O 3.29Å; R784-K848 PolarHBondContact NE-O 3.27Å; R784-K848 PolarHBondContact NH2-O 2.81Å; R784-H850 PolarHBondContact N-CE1 2.66Å; R784-H850 PolarHBondContact N-ND1 2.73Å; R784-H850 PolarHBondContact NH2-NE2 2.73Å; R784-H850 PolarHBondContact O-N 3.49Å; R784-H850 PolarHBondContact O-ND1 3.04Å; R784-H850 VanDerWaalsContact O-ND1 3.14Å
785	V	96.9	Very high	88.9	Confident	0 Å²	0	60 Å²	60	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	136.7	-179.1	179	0	0	0	0	110.3	I783 V802 T803 I851 V853 A921 M924 Q925	I783-V785 HydrophobicContact CD1-CG2 3.75Å; I783-V785 HydrophobicContact CG1-CG2 4.04Å; V785-V802 CarbonylContact O-C 3.3Å; V785-V802 VanDerWaalsContact O-CA 3.31Å; V785-V802 WeakPolarHBondContact O-CA 3.27Å; V785-T803 PolarHBondContact N-OG1 3.45Å; V785-T803 PolarHBondContact O-N 2.96Å; V785-T803 PolarHBondContact O-OG1 2.85Å; V785-I851 HydrophobicContact CB-CG2 4.39Å; V785-I851 HydrophobicContact CG1-CG2 4.11Å; V785-I851 HydrophobicContact CG2-CG2 3.84Å; V785-V853 HydrophobicContact CG1-CB 4.39Å; V785-V853 HydrophobicContact CG1-CG2 3.69Å; V785-A921 HydrophobicContact CB-CB 4.06Å; V785-A921 HydrophobicContact CG1-CB 3.84Å; V785-M924 HydrophobicContact CG1-CB 4.28Å; V785-Q925 HydrophobicContact CG2-CG 3.84Å
786	L	98	Very high	90	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	105.5	170	172.2	63.2	0	0	0	109.7	C800 A801 V802 L840 F843 I844 P849 I851 V852 V853	L786-C800 HydrophobicContact CD1-CB 3.78Å; L786-A801 WeakPolarHBondContact CA-O 3.46Å; L786-V802 HydrophobicContact CB-CG2 4.15Å; L786-V802 HydrophobicContact CD1-CG2 3.58Å; L786-V802 HydrophobicContact CG-CG2 4.41Å; L786-L840 HydrophobicContact CD2-CD1 4.25Å; L786-F843 HydrophobicContact CD1-CD1 4.25Å; L786-F843 HydrophobicContact CD1-CE1 3.81Å; L786-I844 HydrophobicContact CD2-CD1 4.09Å; L786-I844 HydrophobicContact CD2-CG1 3.62Å; L786-P849 HydrophobicContact CB-CB 3.7Å; L786-P849 HydrophobicContact CB-CG 3.83Å; L786-P849 HydrophobicContact CD2-CG 4.32Å; L786-I851 PolarHBondContact N-O 3.04Å; L786-I851 VanDerWaalsContact N-O 3.08Å; L786-V852 HydrophobicContact CB-CG1 4.34Å; L786-V852 HydrophobicContact CB-CG2 4.29Å; L786-V852 HydrophobicContact CD2-CG1 3.88Å; L786-V852 HydrophobicContact CD2-CG2 3.99Å; L786-V852 HydrophobicContact CG-CG1 4.04Å; L786-V852 CarbonylContact O-C 3.5Å; L786-V852 WeakPolarHBondContact O-CA 3.39Å; L786-V853 PolarHBondContact O-N 3.16Å
787	G	97.8	Very high	90.8	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	140.9	171.7	0	0	0	0	0	111.6	C800 A801 V853	G787-C800 CarbonylContact O-C 3.54Å; G787-C800 WeakPolarHBondContact O-CA 3.28Å; G787-C800 WeakPolarHBondContact O-CB 3.37Å; G787-A801 PolarHBondContact N-O 2.8Å; G787-A801 PolarHBondContact O-N 2.83Å; G787-V853 CarbonylContact C-O 3.4Å; G787-V853 WeakPolarHBondContact CA-O 3.46Å
788	L	98	Very high	91.4	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	123.7	176.6	-172.4	159	0	0	0	110.3	Y790 F799 C800 L815 V853 I854 G855 I864 I868	L788-Y790 HydrophobicContact CD2-CD1 4.05Å; L788-F799 WeakPolarHBondContact CA-O 3.46Å; L788-C800 HydrophobicContact CB-CB 3.92Å; L788-C800 HydrophobicContact CD1-CB 4.32Å; L788-C800 HydrophobicContact CG-CB 4.03Å; L788-L815 HydrophobicContact CD1-CD1 4.33Å; L788-V853 PolarHBondContact N-O 3.33Å; L788-I854 HydrophobicContact CD2-CG2 4.5Å; L788-G855 PolarHBondContact O-N 3.27Å; L788-I864 HydrophobicContact CD1-CG2 4.05Å; L788-I864 HydrophobicContact CD2-CD1 4.34Å; L788-I864 HydrophobicContact CD2-CG2 4.31Å; L788-I868 HydrophobicContact CD1-CD1 4.01Å
789	A	97.7	Very high	92.2	Very high	1 Å²	1	48.6 Å²	48.6	1%	0.008	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	146.1	173.2	0	0	0	0	0	110.9	A798 F799 L913 Q916 A917 L920	A789-A798 WeakPolarHBondContact O-CA 3.22Å; A789-A798 WeakPolarHBondContact O-CB 3.47Å; A789-F799 PolarHBondContact N-O 2.77Å; A789-F799 PolarHBondContact O-N 2.7Å; A789-F799 VanDerWaalsContact O-O 3.09Å; A789-L913 HydrophobicContact CB-CD2 4.27Å; A789-L913 WeakPolarHBondContact CB-O 3.44Å; A789-Q916 HydrophobicContact CB-CB 3.72Å; A789-A917 HydrophobicContact CB-CB 4.1Å; A789-L920 HydrophobicContact CB-CD1 4.06Å
790	Y	96.6	Very high	92.8	Very high	4 Å²	4	46 Å²	46	2%	0.016	24%	0.241	C	C	.	.			trans	-149.7	161.8	178.6	71.1	-82.9	0	0	0	109.4	L788 L819 I854 G855 E857 S858 D860 A861 I864	L788-Y790 HydrophobicContact CD2-CD1 4.05Å; Y790-L819 HydrophobicContact CD2-CD1 4.38Å; Y790-L819 HydrophobicContact CD2-CD2 3.7Å; Y790-L819 HydrophobicContact CE2-CD2 4.11Å; Y790-L819 HydrophobicContact CG-CD2 4.35Å; Y790-I854 HydrophobicContact CE1-CG2 4.09Å; Y790-G855 VanDerWaalsContact CE1-O 3.3Å; Y790-G855 WeakPolarHBondContact CE1-O 3.48Å; Y790-E857 HydrophobicContact CE1-CB 4.37Å; Y790-E857 HydrophobicContact CE2-CB 4.13Å; Y790-S858 PolarHBondContact OH-N 3.41Å; Y790-S858 PolarHBondContact OH-O 3.46Å; Y790-D860 HydrophobicContact CE2-CB 4.35Å; Y790-A861 HydrophobicContact CE1-CB 4.17Å; Y790-A861 WeakPolarHBondContact OH-CB 3.41Å; Y790-A861 PolarHBondContact OH-N 3.22Å; Y790-I864 HydrophobicContact CD1-CD1 3.63Å; Y790-I864 HydrophobicContact CD2-CD1 4.37Å; Y790-I864 HydrophobicContact CE1-CD1 3.82Å; Y790-I864 HydrophobicContact CG-CD1 3.95Å
791	D	94.5	Very high	93.8	Very high	60 Å²	60	38.4 Å²	38.4	32%	0.321	20%	0.201	S	C	.	.			trans	-109	149.2	171.7	-174.4	-78.2	0	0	0	108.9	D793 V796 L819 L913	D791-D793 PolarHBondContact O-N 3.49Å; D791-D793 WeakPolarHBondContact OD1-CB 3.4Å; D791-D793 PolarHBondContact OD1-N 3.5Å; D791-V796 HydrophobicContact CB-CB 4.02Å; D791-V796 HydrophobicContact CB-CG1 3.92Å; D791-V796 HydrophobicContact CB-CG2 4.41Å; D791-L819 WeakPolarHBondContact O-CD1 3.39Å; D791-L913 HydrophobicContact CB-CD1 4.3Å
792	P	91.2	Very high	94.7	Very high	56 Å²	56	28.2 Å²	28.2	36%	0.364	16%	0.163	S	C	.	.	S	Bend	trans	-65.1	-18.6	179.4	-21.4	35.7	0	0	0	114.4	H794 E857	P792-H794 PolarHBondContact O-N 2.56Å; P792-E857 HydrophobicContact CG-CG 3.81Å
793	D	92.6	Very high	95.1	Very high	78 Å²	78	26.8 Å²	26.8	42%	0.417	15%	0.148	S	C	.	.			trans	-72.3	120.8	173.5	-179.2	16.7	0	0	0	112	D791 S795 V796	D791-D793 PolarHBondContact O-N 3.49Å; D791-D793 WeakPolarHBondContact OD1-CB 3.4Å; D791-D793 PolarHBondContact OD1-N 3.5Å; D793-S795 PolarHBondContact O-N 2.97Å; D793-S795 VanDerWaalsContact O-N 3.11Å; D793-S795 PolarHBondContact OD1-N 3.37Å; D793-S795 VanDerWaalsContact OD2-CB 3.25Å; D793-S795 WeakPolarHBondContact OD2-CB 3.43Å; D793-S795 PolarHBondContact OD2-OG 2.88Å; D793-V796 HydrophobicContact CB-CG2 4.11Å; D793-V796 PolarHBondContact O-N 2.84Å
794	H	88.3	Confident	95.1	Very high	108 Å²	108	27.9 Å²	27.9	50%	0.5	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-10.8	174.8	-70.1	-160.5	0	0	0	114.3	P792	P792-H794 PolarHBondContact O-N 2.56Å
795	S	90.5	Very high	94.9	Very high	100 Å²	100	27 Å²	27	70%	0.699	16%	0.156	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.9	-26.8	171.2	95.9	0	0	0	0	112.9	D793	D793-S795 PolarHBondContact O-N 2.97Å; D793-S795 VanDerWaalsContact O-N 3.11Å; D793-S795 PolarHBondContact OD1-N 3.37Å; D793-S795 VanDerWaalsContact OD2-CB 3.25Å; D793-S795 WeakPolarHBondContact OD2-CB 3.43Å; D793-S795 PolarHBondContact OD2-OG 2.88Å
796	V	93.7	Very high	94.4	Very high	52 Å²	52	31.5 Å²	31.5	32%	0.315	18%	0.177	S	C	.	.	S	Bend	trans	-86.4	137.1	-176	-177.1	0	0	0	0	110.1	D791 D793 L913	D791-V796 HydrophobicContact CB-CB 4.02Å; D791-V796 HydrophobicContact CB-CG1 3.92Å; D791-V796 HydrophobicContact CB-CG2 4.41Å; D793-V796 HydrophobicContact CB-CG2 4.11Å; D793-V796 PolarHBondContact O-N 2.84Å; V796-L913 HydrophobicContact CG1-CD1 3.49Å; V796-L913 VanDerWaalsContact CG1-CD1 3.49Å
797	A	94.5	Very high	93.9	Very high	8 Å²	8	31.5 Å²	31.5	7%	0.066	18%	0.177	C	C	.	.	P	Polyproline II helix	trans	-83.6	128.2	178.2	0	0	0	0	0	111	F799 R814 P816 L913	A797-F799 HydrophobicContact CB-CE2 4.31Å; A797-F799 WeakPolarHBondContact O-CD2 3.46Å; A797-F799 VanDerWaalsContact O-CE2 3.27Å; A797-F799 WeakPolarHBondContact O-CE2 3.07Å; A797-R814 HydrophobicContact CB-CG 3.85Å; A797-P816 HydrophobicContact CB-CB 3.94Å; A797-L913 WeakPolarHBondContact O-CD1 3.37Å
798	A	96.6	Very high	93.6	Very high	2 Å²	2	35.3 Å²	35.3	2%	0.017	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	154.5	167.7	0	0	0	0	0	111.2	A789 L815 I818	A789-A798 WeakPolarHBondContact O-CA 3.22Å; A789-A798 WeakPolarHBondContact O-CB 3.47Å; A798-L815 HydrophobicContact CB-CB 4.35Å; A798-L815 PolarHBondContact N-O 3.32Å; A798-L815 PolarHBondContact O-N 3.25Å; A798-I818 HydrophobicContact CB-CG2 3.43Å; A798-I818 VanDerWaalsContact CB-CG2 3.43Å
799	F	97.4	Very high	93.4	Very high	25 Å²	25	36.8 Å²	36.8	11%	0.11	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	146.4	176.6	-72.6	-97.1	0	0	0	110.1	L788 A789 A797 L813 R814 P911 L913 L914	L788-F799 WeakPolarHBondContact CA-O 3.46Å; A789-F799 PolarHBondContact N-O 2.77Å; A789-F799 PolarHBondContact O-N 2.7Å; A789-F799 VanDerWaalsContact O-O 3.09Å; A797-F799 HydrophobicContact CB-CE2 4.31Å; A797-F799 WeakPolarHBondContact O-CD2 3.46Å; A797-F799 VanDerWaalsContact O-CE2 3.27Å; A797-F799 WeakPolarHBondContact O-CE2 3.07Å; F799-L813 WeakPolarHBondContact CA-O 3.41Å; F799-R814 HydrophobicContact CD1-CB 4.1Å; F799-R814 HydrophobicContact CD1-CG 4.29Å; F799-R814 HydrophobicContact CE1-CB 3.79Å; F799-R814 HydrophobicContact CE1-CG 3.73Å; F799-R814 HydrophobicContact CE2-CG 4.34Å; F799-R814 HydrophobicContact CZ-CB 4.35Å; F799-R814 HydrophobicContact CZ-CG 3.76Å; F799-P911 HydrophobicContact CD1-CG 4.47Å; F799-P911 HydrophobicContact CE1-CG 3.85Å; F799-P911 HydrophobicContact CE2-CG 4.02Å; F799-P911 HydrophobicContact CZ-CG 3.6Å; F799-L913 HydrophobicContact CD2-CB 3.79Å; F799-L913 HydrophobicContact CD2-CD1 4.46Å; F799-L913 HydrophobicContact CE2-CB 4.5Å; F799-L914 HydrophobicContact CB-CB 4.19Å; F799-L914 HydrophobicContact CB-CD1 4.26Å; F799-L914 HydrophobicContact CD1-CB 4.02Å; F799-L914 HydrophobicContact CD1-CD1 4.4Å; F799-L914 HydrophobicContact CD1-CD2 4.47Å; F799-L914 HydrophobicContact CG-CB 4.13Å
800	C	96.7	Very high	93.2	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	150.8	166.2	62.9	0	0	0	0	111.6	L786 G787 L788 Y812 L813	L786-C800 HydrophobicContact CD1-CB 3.78Å; G787-C800 CarbonylContact O-C 3.54Å; G787-C800 WeakPolarHBondContact O-CA 3.28Å; G787-C800 WeakPolarHBondContact O-CB 3.37Å; L788-C800 HydrophobicContact CB-CB 3.92Å; L788-C800 HydrophobicContact CD1-CB 4.32Å; L788-C800 HydrophobicContact CG-CB 4.03Å; C800-Y812 CarbonylContact O-C 3.5Å; C800-Y812 WeakPolarHBondContact O-CA 3.3Å; C800-Y812 WeakPolarHBondContact O-CB 3.49Å; C800-L813 PolarHBondContact N-O 3.42Å; C800-L813 PolarHBondContact O-N 3.1Å
801	A	96.9	Very high	93.1	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	142	-175	0	0	0	0	0	110.1	L786 G787 I809 D811 L914 A917	L786-A801 WeakPolarHBondContact CA-O 3.46Å; G787-A801 PolarHBondContact N-O 2.8Å; G787-A801 PolarHBondContact O-N 2.83Å; A801-I809 HydrophobicContact CB-CD1 4.42Å; A801-I809 HydrophobicContact CB-CG2 4.15Å; A801-D811 WeakPolarHBondContact CA-O 3.4Å; A801-L914 HydrophobicContact CB-CD1 3.96Å; A801-A917 HydrophobicContact CB-CB 4.23Å
802	V	97.2	Very high	93.2	Very high	1 Å²	1	43.7 Å²	43.7	1%	0.006	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	123.1	176.4	-177.6	0	0	0	0	110.8	V785 L786 S810 D811 F843 K847	V785-V802 CarbonylContact O-C 3.3Å; V785-V802 VanDerWaalsContact O-CA 3.31Å; V785-V802 WeakPolarHBondContact O-CA 3.27Å; L786-V802 HydrophobicContact CB-CG2 4.15Å; L786-V802 HydrophobicContact CD1-CG2 3.58Å; L786-V802 HydrophobicContact CG-CG2 4.41Å; V802-S810 WeakPolarHBondContact O-CB 3.39Å; V802-S810 PolarHBondContact O-N 2.94Å; V802-S810 PolarHBondContact O-OG 3.45Å; V802-D811 PolarHBondContact N-O 3.19Å; V802-F843 HydrophobicContact CG2-CD1 4.43Å; V802-F843 HydrophobicContact CG2-CE1 3.68Å; V802-F843 HydrophobicContact CG2-CZ 4.04Å; V802-K847 HydrophobicContact CB-CB 4.29Å; V802-K847 HydrophobicContact CG1-CB 4.09Å; V802-K847 HydrophobicContact CG2-CB 3.95Å; V802-K847 HydrophobicContact CG2-CG 4.35Å
803	T	95.3	Very high	93.4	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	147.3	172.6	56.6	0	0	0	0	112.8	R784 V785 D808 I809 A921 R922 Q925	R784-T803 WeakPolarHBondContact CA-O 3.2Å; R784-T803 WeakPolarHBondContact CB-O 3.34Å; V785-T803 PolarHBondContact N-OG1 3.45Å; V785-T803 PolarHBondContact O-N 2.96Å; V785-T803 PolarHBondContact O-OG1 2.85Å; T803-D808 CarbonylContact C-O 3.46Å; T803-D808 VanDerWaalsContact CA-O 3.22Å; T803-D808 WeakPolarHBondContact CA-O 3.35Å; T803-I809 HydrophobicContact CG2-CD1 4Å; T803-A921 HydrophobicContact CG2-CB 3.61Å; T803-R922 HydrophobicContact CG2-CG 4.2Å; T803-Q925 PolarHBondContact OG1-NE2 3.05Å
804	T	92.9	Very high	93.6	Very high	34 Å²	34	46 Å²	46	21%	0.209	24%	0.236	C	C	.	.			trans	-67.4	174.6	157.6	66.8	0	0	0	0	110.3	E806 G807 D808 Q925	T804-E806 WeakPolarHBondContact CB-OE2 3.35Å; T804-E806 PolarHBondContact O-N 3.34Å; T804-E806 PolarHBondContact OG1-N 3.32Å; T804-E806 PolarHBondContact OG1-OE2 2.89Å; T804-E806 VanDerWaalsContact OG1-OE2 3.14Å; T804-G807 PolarHBondContact O-N 2.74Å; T804-G807 VanDerWaalsContact O-N 3.16Å; T804-G807 PolarHBondContact OG1-N 3.07Å; T804-G807 VanDerWaalsContact OG1-N 3.12Å; T804-D808 HydrophobicContact CG2-CB 4.31Å; T804-D808 PolarHBondContact N-O 2.91Å; T804-D808 PolarHBondContact OG1-N 3.47Å; T804-D808 VanDerWaalsContact OG1-N 3.07Å; T804-Q925 PolarHBondContact O-NE2 3.09Å
805	V	90	Very high	94	Very high	37 Å²	37	40.9 Å²	40.9	22%	0.224	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-25.5	174.9	-58.9	0	0	0	0	111.5	R781 R784 G807	R781-V805 HydrophobicContact CB-CG2 4.2Å; R784-V805 HydrophobicContact CG-CG1 4.05Å; V805-G807 VanDerWaalsContact C-N 3.3Å
806	E	86.1	Confident	94.2	Very high	96 Å²	96	38.6 Å²	38.6	45%	0.449	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.9	-12.6	173.3	-54.8	76.8	-170.2	0	0	113.2	T804 N983 R985	T804-E806 WeakPolarHBondContact CB-OE2 3.35Å; T804-E806 PolarHBondContact O-N 3.34Å; T804-E806 PolarHBondContact OG1-N 3.32Å; T804-E806 PolarHBondContact OG1-OE2 2.89Å; T804-E806 VanDerWaalsContact OG1-OE2 3.14Å; E806-N983 PolarHBondContact O-ND2 2.85Å; E806-R985 PolarHBondContact O-NH2 3.11Å
807	G	88.3	Confident	94.2	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	19%	0.186	C	C	.	.	S	Bend	trans	88.9	14.9	173.8	0	0	0	0	0	116.6	T804 V805 R922	T804-G807 PolarHBondContact O-N 2.74Å; T804-G807 VanDerWaalsContact O-N 3.16Å; T804-G807 PolarHBondContact OG1-N 3.07Å; T804-G807 VanDerWaalsContact OG1-N 3.12Å; V805-G807 VanDerWaalsContact C-N 3.3Å; G807-R922 PolarHBondContact O-NE 2.82Å
808	D	91.3	Very high	94.1	Very high	80 Å²	80	37.1 Å²	37.1	43%	0.428	18%	0.184	S	C	.	.			trans	-82.2	155.9	171.6	-56.2	-53.4	0	0	0	110.7	T803 T804 S810	T803-D808 CarbonylContact C-O 3.46Å; T803-D808 VanDerWaalsContact CA-O 3.22Å; T803-D808 WeakPolarHBondContact CA-O 3.35Å; T804-D808 HydrophobicContact CG2-CB 4.31Å; T804-D808 PolarHBondContact N-O 2.91Å; T804-D808 PolarHBondContact OG1-N 3.47Å; T804-D808 VanDerWaalsContact OG1-N 3.07Å; D808-S810 PolarHBondContact O-N 3.35Å
809	I	93.5	Very high	93.9	Very high	31 Å²	31	37.9 Å²	37.9	16%	0.159	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	105.8	-176.6	-55.2	-54.4	0	0	0	110	A801 T803 F907 Y910 A918	A801-I809 HydrophobicContact CB-CD1 4.42Å; A801-I809 HydrophobicContact CB-CG2 4.15Å; T803-I809 HydrophobicContact CG2-CD1 4Å; I809-F907 HydrophobicContact CG1-CE1 3.82Å; I809-F907 HydrophobicContact CG1-CZ 3.62Å; I809-Y910 HydrophobicContact CG2-CE2 4.49Å; I809-A918 HydrophobicContact CD1-CB 3.6Å; I809-A918 HydrophobicContact CG1-CB 4.09Å
810	S	92.4	Very high	93.6	Very high	43 Å²	43	39.1 Å²	39.1	30%	0.301	19%	0.193	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	-19.1	-176.9	71.5	0	0	0	0	114.3	V802 D808 K847	V802-S810 WeakPolarHBondContact O-CB 3.39Å; V802-S810 PolarHBondContact O-N 2.94Å; V802-S810 PolarHBondContact O-OG 3.45Å; D808-S810 PolarHBondContact O-N 3.35Å; S810-K847 PolarHBondContact O-NZ 2.94Å
811	D	95.3	Very high	93.2	Very high	56 Å²	56	48.1 Å²	48.1	30%	0.299	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-178.2	167.1	175.6	-136	-49.6	0	0	0	111.3	A801 V802 F843 K847	A801-D811 WeakPolarHBondContact CA-O 3.4Å; V802-D811 PolarHBondContact N-O 3.19Å; D811-F843 HydrophobicContact CB-CE2 3.65Å; D811-F843 HydrophobicContact CB-CZ 3.84Å; D811-K847 HydrophobicContact CB-CD 4.05Å; D811-K847 VanDerWaalsContact CB-CE 3.47Å; D811-K847 HydrophobicContact CB-CG 4.41Å; D811-K847 WeakPolarHBondContact OD2-CE 3.44Å; D811-K847 IonicContact OD2-NZ 3.17Å; D811-K847 PolarHBondContact OD2-NZ 2.95Å
812	Y	96	Very high	92.7	Very high	111 Å²	111	50.4 Å²	50.4	44%	0.435	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	156.9	170.7	64.2	-93.1	0	0	0	113.3	C800 Y910 L914	C800-Y812 CarbonylContact O-C 3.5Å; C800-Y812 WeakPolarHBondContact O-CA 3.3Å; C800-Y812 WeakPolarHBondContact O-CB 3.49Å; Y812-Y910 HydrophobicContact CE1-CE1 4.11Å; Y812-L914 HydrophobicContact CD1-CD2 4.02Å; Y812-L914 HydrophobicContact CD2-CD1 4.37Å; Y812-L914 HydrophobicContact CD2-CD2 3.73Å; Y812-L914 HydrophobicContact CE1-CD2 4.33Å; Y812-L914 HydrophobicContact CE2-CD2 4.06Å; Y812-L914 HydrophobicContact CG-CD1 3.98Å; Y812-L914 HydrophobicContact CG-CD2 3.71Å
813	L	96.1	Very high	92.2	Very high	32 Å²	32	56.4 Å²	56.4	17%	0.168	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	130.4	-179	177.1	64.7	0	0	0	111.4	F799 C800 L815 K839 F843	F799-L813 WeakPolarHBondContact CA-O 3.41Å; C800-L813 PolarHBondContact N-O 3.42Å; C800-L813 PolarHBondContact O-N 3.1Å; L813-L815 HydrophobicContact CD2-CD2 3.74Å; L813-L815 HydrophobicContact CD2-CG 4.38Å; L813-L815 HydrophobicContact CG-CD2 3.86Å; L813-L815 HydrophobicContact CG-CG 4.18Å; L813-K839 HydrophobicContact CD1-CB 4.32Å; L813-K839 HydrophobicContact CD1-CD 4.45Å; L813-K839 HydrophobicContact CD2-CB 3.95Å; L813-F843 HydrophobicContact CB-CD1 4.17Å; L813-F843 HydrophobicContact CB-CD2 4.15Å; L813-F843 HydrophobicContact CB-CE1 4.05Å; L813-F843 HydrophobicContact CB-CE2 4.04Å; L813-F843 HydrophobicContact CB-CG 4.22Å; L813-F843 HydrophobicContact CB-CZ 3.99Å; L813-F843 HydrophobicContact CD2-CB 3.82Å; L813-F843 HydrophobicContact CD2-CD1 4.19Å; L813-F843 HydrophobicContact CD2-CD2 4.42Å; L813-F843 HydrophobicContact CD2-CG 3.94Å
814	R	96.6	Very high	91.7	Very high	151 Å²	151	57.4 Å²	57.4	57%	0.57	28%	0.276	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.1	126.9	175.3	-174.5	-177.3	174.2	-157.7	-1	110.7	A797 F799 P816	A797-R814 HydrophobicContact CB-CG 3.85Å; F799-R814 HydrophobicContact CD1-CB 4.1Å; F799-R814 HydrophobicContact CD1-CG 4.29Å; F799-R814 HydrophobicContact CE1-CB 3.79Å; F799-R814 HydrophobicContact CE1-CG 3.73Å; F799-R814 HydrophobicContact CE2-CG 4.34Å; F799-R814 HydrophobicContact CZ-CB 4.35Å; F799-R814 HydrophobicContact CZ-CG 3.76Å; R814-P816 WeakPolarHBondContact O-CD 3.16Å
815	L	96.1	Very high	91.4	Very high	0 Å²	0	66.7 Å²	66.7	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	74.1	-172.3	-61.8	172.6	0	0	0	111.4	L788 A798 L813 N817 I818 D836 L840	L788-L815 HydrophobicContact CD1-CD1 4.33Å; A798-L815 HydrophobicContact CB-CB 4.35Å; A798-L815 PolarHBondContact N-O 3.32Å; A798-L815 PolarHBondContact O-N 3.25Å; L813-L815 HydrophobicContact CD2-CD2 3.74Å; L813-L815 HydrophobicContact CD2-CG 4.38Å; L813-L815 HydrophobicContact CG-CD2 3.86Å; L813-L815 HydrophobicContact CG-CG 4.18Å; L815-N817 PolarHBondContact O-N 3.16Å; L815-N817 VanDerWaalsContact O-N 3.08Å; L815-I818 HydrophobicContact CB-CB 4.12Å; L815-I818 HydrophobicContact CD1-CD1 4.38Å; L815-I818 PolarHBondContact O-N 3.23Å; L815-D836 HydrophobicContact CD2-CB 4.01Å; L815-L840 HydrophobicContact CD1-CD1 4.32Å; L815-L840 HydrophobicContact CD1-CD2 4.2Å; L815-L840 HydrophobicContact CD2-CB 4.47Å
816	P	94.7	Very high	91.3	Very high	51 Å²	51	68.1 Å²	68.1	33%	0.331	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-5.6	-173.5	26.5	-32.9	0	0	0	115.8	A797 R814 D836	A797-P816 HydrophobicContact CB-CB 3.94Å; R814-P816 WeakPolarHBondContact O-CD 3.16Å; P816-D836 VanDerWaalsContact CD-OD2 3.28Å; P816-D836 WeakPolarHBondContact CD-OD2 3.43Å
817	N	94	Very high	91.5	Very high	25 Å²	25	70.4 Å²	70.4	13%	0.134	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-125.4	11.5	-177.1	-54.3	-82.4	0	0	0	113.6	L815 L819 K820 Q832 D836	L815-N817 PolarHBondContact O-N 3.16Å; L815-N817 VanDerWaalsContact O-N 3.08Å; N817-L819 PolarHBondContact O-N 3.16Å; N817-K820 HydrophobicContact CB-CD 4.04Å; N817-K820 WeakPolarHBondContact O-CB 3.42Å; N817-K820 PolarHBondContact O-N 3.38Å; N817-K820 VanDerWaalsContact O-N 3.08Å; N817-K820 PolarHBondContact OD1-NZ 2.9Å; N817-Q832 HydrophobicContact CB-CB 4.02Å; N817-D836 WeakPolarHBondContact CA-OD2 3.43Å; N817-D836 WeakPolarHBondContact CB-OD2 3.28Å; N817-D836 PolarHBondContact N-OD2 2.86Å; N817-D836 PolarHBondContact ND2-OD2 2.86Å
818	I	93.7	Very high	91.6	Very high	4 Å²	4	76.2 Å²	76.2	2%	0.021	36%	0.357	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-24.1	-172.5	-155.1	65.5	0	0	0	113.5	A798 L815 K833 L837 L840 I864	A798-I818 HydrophobicContact CB-CG2 3.43Å; A798-I818 VanDerWaalsContact CB-CG2 3.43Å; L815-I818 HydrophobicContact CB-CB 4.12Å; L815-I818 HydrophobicContact CD1-CD1 4.38Å; L815-I818 PolarHBondContact O-N 3.23Å; I818-K833 WeakPolarHBondContact O-CE 3.47Å; I818-K833 PolarHBondContact O-NZ 3.01Å; I818-L837 HydrophobicContact CD1-CD2 3.77Å; I818-L840 HydrophobicContact CD1-CD2 4.41Å; I818-I864 HydrophobicContact CG1-CG1 4.34Å; I818-I864 HydrophobicContact CG2-CD1 4.3Å
819	L	92.5	Very high	91.5	Very high	19 Å²	19	75.5 Å²	75.5	10%	0.099	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-13.6	178.3	-58.8	170.6	0	0	0	113.4	Y790 D791 N817 D860 I864	Y790-L819 HydrophobicContact CD2-CD1 4.38Å; Y790-L819 HydrophobicContact CD2-CD2 3.7Å; Y790-L819 HydrophobicContact CE2-CD2 4.11Å; Y790-L819 HydrophobicContact CG-CD2 4.35Å; D791-L819 WeakPolarHBondContact O-CD1 3.39Å; N817-L819 PolarHBondContact O-N 3.16Å; L819-D860 HydrophobicContact CD2-CB 4.02Å; L819-I864 HydrophobicContact CD2-CD1 4.04Å
820	K	91	Very high	91.4	Very high	51 Å²	51	77.1 Å²	77.1	22%	0.222	36%	0.357	C	S	.	.	S	Bend	trans	-70.1	145.5	176.4	-70.2	172.8	-179.9	167.6	0	110.2	N817 E829 K833	N817-K820 HydrophobicContact CB-CD 4.04Å; N817-K820 WeakPolarHBondContact O-CB 3.42Å; N817-K820 PolarHBondContact O-N 3.38Å; N817-K820 VanDerWaalsContact O-N 3.08Å; N817-K820 PolarHBondContact OD1-NZ 2.9Å; K820-E829 HydrophobicContact CB-CB 4.43Å; K820-E829 HydrophobicContact CD-CB 4.17Å; K820-E829 HydrophobicContact CD-CG 4.06Å; K820-E829 HydrophobicContact CG-CG 4.43Å; K820-K833 HydrophobicContact CB-CB 4.12Å; K820-K833 WeakPolarHBondContact O-CD 3.13Å; K820-K833 VanDerWaalsContact O-CE 3.25Å; K820-K833 WeakPolarHBondContact O-CE 3.42Å; K820-K833 WeakPolarHBondContact O-CG 3.41Å
821	R	87.1	Confident	91.4	Very high	188 Å²	188	77.9 Å²	77.9	71%	0.709	37%	0.366	S	S	*	.			trans	-78.4	127.1	-173.2	-65.8	-179	178.8	179.6	0.2	111.5	N823 S824	R821-N823 PolarHBondContact O-N 3.47Å; R821-S824 WeakPolarHBondContact O-CB 3.36Å; R821-S824 PolarHBondContact O-N 2.61Å
822	K	86.8	Confident	91.3	Very high	49 Å²	49	77.6 Å²	77.6	21%	0.213	36%	0.363	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.1	-24.8	171.7	-176.7	168.9	175.8	175	0	113.4	K830 K833 L834 L837 D867 E870	K822-K830 VanDerWaalsContact O-CD 3.26Å; K822-K830 WeakPolarHBondContact O-CD 3.42Å; K822-K830 WeakPolarHBondContact O-CE 3.29Å; K822-K830 WeakPolarHBondContact O-CG 3.2Å; K822-K830 PolarHBondContact O-NZ 3.22Å; K822-K830 VanDerWaalsContact O-NZ 3.15Å; K822-K833 HydrophobicContact CB-CG 4.34Å; K822-L834 HydrophobicContact CG-CD2 4.19Å; K822-L837 HydrophobicContact CD-CD1 4.08Å; K822-D867 VanDerWaalsContact CD-OD1 3.25Å; K822-D867 WeakPolarHBondContact CD-OD1 3.49Å; K822-E870 IonicContact NZ-OE1 2.69Å; K822-E870 PolarHBondContact NZ-OE1 3.02Å; K822-E870 IonicContact NZ-OE2 3.77Å; K822-E870 PolarHBondContact NZ-OE2 2.79Å
823	N	86.9	Confident	91.2	Very high	126 Å²	126	72.5 Å²	72.5	67%	0.674	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.9	36.9	173.2	-68.7	-39.5	0	0	0	113.1	R821 K830	R821-N823 PolarHBondContact O-N 3.47Å; N823-K830 PolarHBondContact OD1-NZ 3.23Å; N823-K830 VanDerWaalsContact OD1-NZ 3.15Å
824	S	85.3	Confident	91.1	Very high	21 Å²	21	73.4 Å²	73.4	15%	0.147	35%	0.347	C	S	.	.			trans	-61.6	146.3	167.2	-168.7	0	0	0	0	111	R821 N826 E829	R821-S824 WeakPolarHBondContact O-CB 3.36Å; R821-S824 PolarHBondContact O-N 2.61Å; S824-N826 PolarHBondContact OG-N 3.17Å; S824-E829 WeakPolarHBondContact CB-OE2 3.46Å; S824-E829 PolarHBondContact OG-OE2 2.9Å
825	Y	85.4	Confident	91	Very high	229 Å²	229	68.2 Å²	68.2	90%	0.898	34%	0.336	S	S	*	.	S	Bend	trans	-70.3	-25.3	171.1	-44.5	-76.4	0	0	0	111.3	L827	Y825-L827 PolarHBondContact O-N 3.49Å
826	N	89	Confident	91	Very high	67 Å²	67	68.2 Å²	68.2	36%	0.358	34%	0.337	S	S	.	.	S	Bend	trans	-76.3	116.1	172.2	-176.3	-2.8	0	0	0	109.5	S824 E828 E829 K830	S824-N826 PolarHBondContact OG-N 3.17Å; N826-E828 PolarHBondContact O-N 2.81Å; N826-E828 WeakPolarHBondContact OD1-CB 3.44Å; N826-E828 PolarHBondContact OD1-N 3.12Å; N826-E829 HydrophobicContact CB-CB 4.16Å; N826-E829 HydrophobicContact CB-CG 4.08Å; N826-E829 VanDerWaalsContact CB-OE1 3.29Å; N826-E829 WeakPolarHBondContact CB-OE1 3.21Å; N826-E829 WeakPolarHBondContact ND2-CG 3.42Å; N826-E829 PolarHBondContact ND2-OE1 3.49Å; N826-K830 WeakPolarHBondContact O-CB 3.45Å; N826-K830 PolarHBondContact O-N 2.94Å; N826-K830 VanDerWaalsContact O-N 3.13Å
827	L	89.4	Confident	91.1	Very high	144 Å²	144	66.3 Å²	66.3	75%	0.754	32%	0.323	S	S	*	.	H	α-helix	trans	-62.7	-30.1	179.6	-66.9	174.1	0	0	0	112.4	Y825 A831	Y825-L827 PolarHBondContact O-N 3.49Å; L827-A831 WeakPolarHBondContact O-CB 3.15Å; L827-A831 PolarHBondContact O-N 3.49Å
828	E	90.7	Very high	91.1	Very high	123 Å²	123	73.4 Å²	73.4	58%	0.575	35%	0.348	S	S	*	.	H	α-helix	trans	-72.3	-51.3	-179.4	-162.2	-166.8	136.1	0	0	111.4	N826 K830 A831 Q832	N826-E828 PolarHBondContact O-N 2.81Å; N826-E828 WeakPolarHBondContact OD1-CB 3.44Å; N826-E828 PolarHBondContact OD1-N 3.12Å; E828-K830 PolarHBondContact O-N 3.3Å; E828-A831 PolarHBondContact O-N 3.4Å; E828-A831 VanDerWaalsContact O-N 3.12Å; E828-Q832 WeakPolarHBondContact O-CB 3.43Å; E828-Q832 VanDerWaalsContact O-CG 3.27Å; E828-Q832 WeakPolarHBondContact O-CG 3.46Å; E828-Q832 PolarHBondContact O-N 3.1Å; E828-Q832 PolarHBondContact OE1-NE2 3.04Å
829	E	89.5	Confident	91.3	Very high	64 Å²	64	77.4 Å²	77.4	30%	0.299	37%	0.366	S	S	.	.	H	α-helix	trans	-54.9	-42.7	173.3	-74.9	162.1	-138.3	0	0	111.8	K820 S824 N826 Q832 K833	K820-E829 HydrophobicContact CB-CB 4.43Å; K820-E829 HydrophobicContact CD-CB 4.17Å; K820-E829 HydrophobicContact CD-CG 4.06Å; K820-E829 HydrophobicContact CG-CG 4.43Å; S824-E829 WeakPolarHBondContact CB-OE2 3.46Å; S824-E829 PolarHBondContact OG-OE2 2.9Å; N826-E829 HydrophobicContact CB-CB 4.16Å; N826-E829 HydrophobicContact CB-CG 4.08Å; N826-E829 VanDerWaalsContact CB-OE1 3.29Å; N826-E829 WeakPolarHBondContact CB-OE1 3.21Å; N826-E829 WeakPolarHBondContact ND2-CG 3.42Å; N826-E829 PolarHBondContact ND2-OE1 3.49Å; E829-Q832 PolarHBondContact O-N 2.88Å; E829-K833 WeakPolarHBondContact O-CB 3.37Å; E829-K833 PolarHBondContact O-N 3.16Å
830	K	91	Very high	91.4	Very high	65 Å²	65	76.5 Å²	76.5	28%	0.283	36%	0.361	S	S	.	.	H	α-helix	trans	-63.4	-44.6	177.6	176.6	161.5	-178	149.5	0	111.5	K822 N823 N826 E828 L834	K822-K830 VanDerWaalsContact O-CD 3.26Å; K822-K830 WeakPolarHBondContact O-CD 3.42Å; K822-K830 WeakPolarHBondContact O-CE 3.29Å; K822-K830 WeakPolarHBondContact O-CG 3.2Å; K822-K830 PolarHBondContact O-NZ 3.22Å; K822-K830 VanDerWaalsContact O-NZ 3.15Å; N823-K830 PolarHBondContact OD1-NZ 3.23Å; N823-K830 VanDerWaalsContact OD1-NZ 3.15Å; N826-K830 WeakPolarHBondContact O-CB 3.45Å; N826-K830 PolarHBondContact O-N 2.94Å; N826-K830 VanDerWaalsContact O-N 3.13Å; E828-K830 PolarHBondContact O-N 3.3Å; K830-L834 HydrophobicContact CG-CD1 3.89Å; K830-L834 WeakPolarHBondContact O-CB 3.4Å; K830-L834 WeakPolarHBondContact O-CD1 3.37Å; K830-L834 WeakPolarHBondContact O-CG 3.25Å; K830-L834 PolarHBondContact O-N 3.26Å
831	A	92.8	Very high	91.7	Very high	59 Å²	59	75.2 Å²	75.2	49%	0.488	36%	0.358	S	S	.	.	H	α-helix	trans	-63.9	-41.1	176	0	0	0	0	0	111.9	L827 E828 L834 A835	L827-A831 WeakPolarHBondContact O-CB 3.15Å; L827-A831 PolarHBondContact O-N 3.49Å; E828-A831 PolarHBondContact O-N 3.4Å; E828-A831 VanDerWaalsContact O-N 3.12Å; A831-L834 PolarHBondContact O-N 3.46Å; A831-A835 WeakPolarHBondContact O-CB 3.15Å; A831-A835 PolarHBondContact O-N 2.74Å
832	Q	93	Very high	92	Very high	51 Å²	51	71.4 Å²	71.4	24%	0.238	35%	0.352	C	S	.	.	H	α-helix	trans	-64.5	-47.5	178	-74.2	166.5	-5.5	0	0	112.4	N817 E828 E829 L834 A835 D836	N817-Q832 HydrophobicContact CB-CB 4.02Å; E828-Q832 WeakPolarHBondContact O-CB 3.43Å; E828-Q832 VanDerWaalsContact O-CG 3.27Å; E828-Q832 WeakPolarHBondContact O-CG 3.46Å; E828-Q832 PolarHBondContact O-N 3.1Å; E828-Q832 PolarHBondContact OE1-NE2 3.04Å; E829-Q832 PolarHBondContact O-N 2.88Å; Q832-L834 PolarHBondContact O-N 3.28Å; Q832-A835 PolarHBondContact O-N 2.79Å; Q832-D836 PolarHBondContact O-N 3.2Å; Q832-D836 VanDerWaalsContact O-N 3.13Å
833	K	93.9	Very high	92.5	Very high	3 Å²	3	69.6 Å²	69.6	1%	0.013	34%	0.344	C	S	.	.	H	α-helix	trans	-58.8	-46.1	172.9	171.8	61.5	164.3	176.2	0	111.6	I818 K820 K822 E829 A835 D836 L837 D867	I818-K833 WeakPolarHBondContact O-CE 3.47Å; I818-K833 PolarHBondContact O-NZ 3.01Å; K820-K833 HydrophobicContact CB-CB 4.12Å; K820-K833 WeakPolarHBondContact O-CD 3.13Å; K820-K833 VanDerWaalsContact O-CE 3.25Å; K820-K833 WeakPolarHBondContact O-CE 3.42Å; K820-K833 WeakPolarHBondContact O-CG 3.41Å; K822-K833 HydrophobicContact CB-CG 4.34Å; E829-K833 WeakPolarHBondContact O-CB 3.37Å; E829-K833 PolarHBondContact O-N 3.16Å; K833-A835 VanDerWaalsContact C-N 3.3Å; K833-A835 PolarHBondContact O-N 2.72Å; K833-D836 PolarHBondContact O-N 2.85Å; K833-L837 HydrophobicContact CD-CD1 4.19Å; K833-L837 HydrophobicContact CD-CG 4.08Å; K833-L837 HydrophobicContact CG-CD1 4.23Å; K833-L837 HydrophobicContact CG-CG 4.49Å; K833-L837 WeakPolarHBondContact O-CG 3.34Å; K833-L837 PolarHBondContact O-N 2.82Å; K833-D867 WeakPolarHBondContact CE-OD2 3.35Å; K833-D867 IonicContact NZ-OD2 3.85Å; K833-D867 PolarHBondContact NZ-OD2 3.29Å
834	L	94	Very high	92.9	Very high	52 Å²	52	63.7 Å²	63.7	27%	0.272	31%	0.312	S	S	.	.	H	α-helix	trans	-66.4	-29.8	178.8	-72.2	169.9	0	0	0	112.8	K822 K830 A831 Q832 R838	K822-L834 HydrophobicContact CG-CD2 4.19Å; K830-L834 HydrophobicContact CG-CD1 3.89Å; K830-L834 WeakPolarHBondContact O-CB 3.4Å; K830-L834 WeakPolarHBondContact O-CD1 3.37Å; K830-L834 WeakPolarHBondContact O-CG 3.25Å; K830-L834 PolarHBondContact O-N 3.26Å; A831-L834 PolarHBondContact O-N 3.46Å; Q832-L834 PolarHBondContact O-N 3.28Å; L834-R838 VanDerWaalsContact O-CG 3.3Å; L834-R838 WeakPolarHBondContact O-CG 3.49Å; L834-R838 PolarHBondContact O-N 2.65Å; L834-R838 VanDerWaalsContact O-N 3.16Å
835	A	95.1	Very high	93.3	Very high	41 Å²	41	66.3 Å²	66.3	34%	0.339	32%	0.321	S	S	.	.	H	α-helix	trans	-68	-43.5	173.1	0	0	0	0	0	111.7	A831 Q832 K833 R838 K839	A831-A835 WeakPolarHBondContact O-CB 3.15Å; A831-A835 PolarHBondContact O-N 2.74Å; Q832-A835 PolarHBondContact O-N 2.79Å; K833-A835 VanDerWaalsContact C-N 3.3Å; K833-A835 PolarHBondContact O-N 2.72Å; A835-R838 PolarHBondContact O-N 3.24Å; A835-K839 WeakPolarHBondContact O-CG 3.28Å; A835-K839 PolarHBondContact O-N 3.06Å; A835-K839 VanDerWaalsContact O-N 3.16Å
836	D	95.8	Very high	93.7	Very high	1 Å²	1	61.1 Å²	61.1	1%	0.005	31%	0.307	C	S	.	.	H	α-helix	trans	-72	-34	178.3	-76.4	-4.9	0	0	0	112.5	L815 P816 N817 Q832 K833 R838 K839 L840	L815-D836 HydrophobicContact CD2-CB 4.01Å; P816-D836 VanDerWaalsContact CD-OD2 3.28Å; P816-D836 WeakPolarHBondContact CD-OD2 3.43Å; N817-D836 WeakPolarHBondContact CA-OD2 3.43Å; N817-D836 WeakPolarHBondContact CB-OD2 3.28Å; N817-D836 PolarHBondContact N-OD2 2.86Å; N817-D836 PolarHBondContact ND2-OD2 2.86Å; Q832-D836 PolarHBondContact O-N 3.2Å; Q832-D836 VanDerWaalsContact O-N 3.13Å; K833-D836 PolarHBondContact O-N 2.85Å; D836-R838 VanDerWaalsContact C-N 3.34Å; D836-R838 PolarHBondContact O-N 3.04Å; D836-K839 PolarHBondContact O-N 3.19Å; D836-K839 WeakPolarHBondContact OD1-CE 3.27Å; D836-K839 IonicContact OD1-NZ 3.99Å; D836-K839 PolarHBondContact OD1-NZ 3.25Å; D836-L840 WeakPolarHBondContact O-CB 3.31Å; D836-L840 PolarHBondContact O-N 3.22Å
837	L	95.6	Very high	93.9	Very high	10 Å²	10	60.3 Å²	60.3	5%	0.052	30%	0.3	C	S	.	.	H	α-helix	trans	-63	-36.5	170.5	-71.9	-180	0	0	0	112.8	I818 K822 K833 L840 S841 D867 I871	I818-L837 HydrophobicContact CD1-CD2 3.77Å; K822-L837 HydrophobicContact CD-CD1 4.08Å; K833-L837 HydrophobicContact CD-CD1 4.19Å; K833-L837 HydrophobicContact CD-CG 4.08Å; K833-L837 HydrophobicContact CG-CD1 4.23Å; K833-L837 HydrophobicContact CG-CG 4.49Å; K833-L837 WeakPolarHBondContact O-CG 3.34Å; K833-L837 PolarHBondContact O-N 2.82Å; L837-L840 PolarHBondContact O-N 2.7Å; L837-S841 PolarHBondContact O-N 2.88Å; L837-D867 HydrophobicContact CD1-CB 4.37Å; L837-D867 HydrophobicContact CD2-CB 3.77Å; L837-I871 HydrophobicContact CB-CD1 4.19Å; L837-I871 HydrophobicContact CD2-CD1 3.93Å; L837-I871 WeakPolarHBondContact O-CD1 3.3Å
838	R	95.4	Very high	94.1	Very high	174 Å²	174	55.7 Å²	55.7	66%	0.657	27%	0.274	S	S	*	.	H	α-helix	trans	-64.7	-49.9	174	-74.8	168.9	-174.6	169.2	2	111.7	L834 A835 D836 L840 S841 D842	L834-R838 VanDerWaalsContact O-CG 3.3Å; L834-R838 WeakPolarHBondContact O-CG 3.49Å; L834-R838 PolarHBondContact O-N 2.65Å; L834-R838 VanDerWaalsContact O-N 3.16Å; A835-R838 PolarHBondContact O-N 3.24Å; D836-R838 VanDerWaalsContact C-N 3.34Å; D836-R838 PolarHBondContact O-N 3.04Å; R838-L840 PolarHBondContact O-N 3.06Å; R838-S841 WeakPolarHBondContact O-CA 3.28Å; R838-S841 WeakPolarHBondContact O-CB 3.34Å; R838-S841 PolarHBondContact O-N 3.05Å; R838-D842 PolarHBondContact O-N 3.28Å
839	K	96.1	Very high	94.3	Very high	89 Å²	89	49.9 Å²	49.9	39%	0.387	25%	0.247	S	C	.	.	H	α-helix	trans	-53.5	-42.6	175.1	-63.5	170.9	-169	164.7	0	111.6	L813 A835 D836 D842 F843	L813-K839 HydrophobicContact CD1-CB 4.32Å; L813-K839 HydrophobicContact CD1-CD 4.45Å; L813-K839 HydrophobicContact CD2-CB 3.95Å; A835-K839 WeakPolarHBondContact O-CG 3.28Å; A835-K839 PolarHBondContact O-N 3.06Å; A835-K839 VanDerWaalsContact O-N 3.16Å; D836-K839 PolarHBondContact O-N 3.19Å; D836-K839 WeakPolarHBondContact OD1-CE 3.27Å; D836-K839 IonicContact OD1-NZ 3.99Å; D836-K839 PolarHBondContact OD1-NZ 3.25Å; K839-D842 PolarHBondContact O-N 3.19Å; K839-F843 WeakPolarHBondContact O-CB 3.46Å; K839-F843 PolarHBondContact O-N 2.97Å
840	L	95.9	Very high	94.5	Very high	0 Å²	0	47 Å²	47	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-66.6	-39.5	178.5	-176.6	56.2	0	0	0	112.2	L786 L815 I818 D836 L837 R838 F843 I844 I868	L786-L840 HydrophobicContact CD2-CD1 4.25Å; L815-L840 HydrophobicContact CD1-CD1 4.32Å; L815-L840 HydrophobicContact CD1-CD2 4.2Å; L815-L840 HydrophobicContact CD2-CB 4.47Å; I818-L840 HydrophobicContact CD1-CD2 4.41Å; D836-L840 WeakPolarHBondContact O-CB 3.31Å; D836-L840 PolarHBondContact O-N 3.22Å; L837-L840 PolarHBondContact O-N 2.7Å; R838-L840 PolarHBondContact O-N 3.06Å; L840-F843 PolarHBondContact O-N 2.97Å; L840-I844 HydrophobicContact CD1-CD1 4.12Å; L840-I844 HydrophobicContact CD1-CG1 4.32Å; L840-I844 HydrophobicContact CG-CD1 4.03Å; L840-I844 WeakPolarHBondContact O-CB 3.37Å; L840-I844 VanDerWaalsContact O-CG1 3.25Å; L840-I844 WeakPolarHBondContact O-CG1 3.18Å; L840-I844 PolarHBondContact O-N 2.55Å; L840-I868 HydrophobicContact CD2-CD1 3.9Å; L840-I868 HydrophobicContact CD2-CG1 3.8Å
841	S	95.8	Very high	94.7	Very high	23 Å²	23	43.9 Å²	43.9	16%	0.161	22%	0.22	C	C	.	.	H	α-helix	trans	-62.5	-47.9	172.3	-173.2	0	0	0	0	112.1	L837 R838 F843 I844 K845	L837-S841 PolarHBondContact O-N 2.88Å; R838-S841 WeakPolarHBondContact O-CA 3.28Å; R838-S841 WeakPolarHBondContact O-CB 3.34Å; R838-S841 PolarHBondContact O-N 3.05Å; S841-F843 VanDerWaalsContact C-N 3.29Å; S841-F843 PolarHBondContact O-N 3.06Å; S841-I844 PolarHBondContact O-N 3.44Å; S841-K845 VanDerWaalsContact O-CB 3.29Å; S841-K845 WeakPolarHBondContact O-CB 3.44Å; S841-K845 PolarHBondContact O-N 3.38Å
842	D	95.5	Very high	94.9	Very high	108 Å²	108	41.1 Å²	41.1	58%	0.578	20%	0.196	S	C	*	.	H	α-helix	trans	-60.9	-38.7	176.8	-64	-40.3	0	0	0	111.6	R838 K839 K845 M846	R838-D842 PolarHBondContact O-N 3.28Å; K839-D842 PolarHBondContact O-N 3.19Å; D842-K845 PolarHBondContact O-N 3.1Å; D842-M846 VanDerWaalsContact O-CB 3.3Å; D842-M846 WeakPolarHBondContact O-CB 3.38Å; D842-M846 PolarHBondContact O-N 3.22Å
843	F	95.9	Very high	95.1	Very high	12 Å²	12	38.7 Å²	38.7	5%	0.053	19%	0.185	C	C	.	.	H	α-helix	trans	-70.2	-44.3	178.6	-171.7	-111.5	0	0	0	112.9	L786 V802 D811 L813 K839 L840 S841 K845 M846 K847	L786-F843 HydrophobicContact CD1-CD1 4.25Å; L786-F843 HydrophobicContact CD1-CE1 3.81Å; V802-F843 HydrophobicContact CG2-CD1 4.43Å; V802-F843 HydrophobicContact CG2-CE1 3.68Å; V802-F843 HydrophobicContact CG2-CZ 4.04Å; D811-F843 HydrophobicContact CB-CE2 3.65Å; D811-F843 HydrophobicContact CB-CZ 3.84Å; L813-F843 HydrophobicContact CB-CD1 4.17Å; L813-F843 HydrophobicContact CB-CD2 4.15Å; L813-F843 HydrophobicContact CB-CE1 4.05Å; L813-F843 HydrophobicContact CB-CE2 4.04Å; L813-F843 HydrophobicContact CB-CG 4.22Å; L813-F843 HydrophobicContact CB-CZ 3.99Å; L813-F843 HydrophobicContact CD2-CB 3.82Å; L813-F843 HydrophobicContact CD2-CD1 4.19Å; L813-F843 HydrophobicContact CD2-CD2 4.42Å; L813-F843 HydrophobicContact CD2-CG 3.94Å; K839-F843 WeakPolarHBondContact O-CB 3.46Å; K839-F843 PolarHBondContact O-N 2.97Å; L840-F843 PolarHBondContact O-N 2.97Å; S841-F843 VanDerWaalsContact C-N 3.29Å; S841-F843 PolarHBondContact O-N 3.06Å; F843-K845 VanDerWaalsContact C-N 3.32Å; F843-K845 PolarHBondContact O-N 2.88Å; F843-M846 HydrophobicContact CD2-CE 4.01Å; F843-M846 PolarHBondContact O-N 2.74Å; F843-K847 HydrophobicContact CE2-CG 4.46Å; F843-K847 PolarHBondContact O-N 2.94Å
844	I	95.7	Very high	95.3	Very high	1 Å²	1	38.5 Å²	38.5	1%	0.005	19%	0.185	C	C	.	.	H	α-helix	trans	-60	-44.8	171.2	-71.8	165.6	0	0	0	109.9	L786 L840 S841 M846 K847 K848 P849 I868 I871 L872 L875 F881	L786-I844 HydrophobicContact CD2-CD1 4.09Å; L786-I844 HydrophobicContact CD2-CG1 3.62Å; L840-I844 HydrophobicContact CD1-CD1 4.12Å; L840-I844 HydrophobicContact CD1-CG1 4.32Å; L840-I844 HydrophobicContact CG-CD1 4.03Å; L840-I844 WeakPolarHBondContact O-CB 3.37Å; L840-I844 VanDerWaalsContact O-CG1 3.25Å; L840-I844 WeakPolarHBondContact O-CG1 3.18Å; L840-I844 PolarHBondContact O-N 2.55Å; S841-I844 PolarHBondContact O-N 3.44Å; I844-M846 VanDerWaalsContact C-N 3.31Å; I844-M846 PolarHBondContact O-N 2.8Å; I844-K847 PolarHBondContact O-N 3.04Å; I844-K848 WeakPolarHBondContact O-CA 3.37Å; I844-K848 PolarHBondContact O-N 3.43Å; I844-P849 HydrophobicContact CG2-CG 4.45Å; I844-I868 HydrophobicContact CD1-CG2 4.41Å; I844-I871 HydrophobicContact CD1-CG2 4.24Å; I844-L872 HydrophobicContact CG2-CD2 3.79Å; I844-L875 HydrophobicContact CB-CD1 4.31Å; I844-L875 HydrophobicContact CG2-CD1 3.73Å; I844-F881 HydrophobicContact CG2-CE1 4.48Å
845	K	93.7	Very high	95.4	Very high	77 Å²	77	36.1 Å²	36.1	34%	0.335	17%	0.173	S	C	.	.	H	α-helix	trans	-61.6	-38.8	178.2	-174.6	176.9	178.3	176.6	0	112.4	S841 D842 F843 L875 E879 F881	S841-K845 VanDerWaalsContact O-CB 3.29Å; S841-K845 WeakPolarHBondContact O-CB 3.44Å; S841-K845 PolarHBondContact O-N 3.38Å; D842-K845 PolarHBondContact O-N 3.1Å; F843-K845 VanDerWaalsContact C-N 3.32Å; F843-K845 PolarHBondContact O-N 2.88Å; K845-L875 HydrophobicContact CB-CD2 4.26Å; K845-L875 HydrophobicContact CD-CD2 4.36Å; K845-L875 HydrophobicContact CG-CD2 4.45Å; K845-E879 HydrophobicContact CD-CG 4.37Å; K845-E879 WeakPolarHBondContact CE-OE2 3.34Å; K845-E879 IonicContact NZ-OE1 2.61Å; K845-E879 PolarHBondContact NZ-OE1 2.87Å; K845-E879 IonicContact NZ-OE2 2.69Å; K845-E879 PolarHBondContact NZ-OE2 3.46Å; K845-F881 HydrophobicContact CB-CZ 4.41Å; K845-F881 HydrophobicContact CG-CE2 4.46Å; K845-F881 HydrophobicContact CG-CZ 4.2Å
846	M	93.7	Very high	95.4	Very high	120 Å²	120	34.2 Å²	34.2	59%	0.591	16%	0.156	S	C	*	.	H	α-helix	trans	-73.5	-43.4	179.2	178.8	170.4	65.9	0	0	113.4	D842 F843 I844	D842-M846 VanDerWaalsContact O-CB 3.3Å; D842-M846 WeakPolarHBondContact O-CB 3.38Å; D842-M846 PolarHBondContact O-N 3.22Å; F843-M846 HydrophobicContact CD2-CE 4.01Å; F843-M846 PolarHBondContact O-N 2.74Å; I844-M846 VanDerWaalsContact C-N 3.31Å; I844-M846 PolarHBondContact O-N 2.8Å
847	K	93.9	Very high	95.3	Very high	49 Å²	49	35.6 Å²	35.6	21%	0.213	16%	0.163	C	C	.	.	H	α-helix	trans	-100.9	-10.7	-170.1	-63.6	-74.9	168.9	158.2	0	114.7	V802 S810 D811 F843 I844	V802-K847 HydrophobicContact CB-CB 4.29Å; V802-K847 HydrophobicContact CG1-CB 4.09Å; V802-K847 HydrophobicContact CG2-CB 3.95Å; V802-K847 HydrophobicContact CG2-CG 4.35Å; S810-K847 PolarHBondContact O-NZ 2.94Å; D811-K847 HydrophobicContact CB-CD 4.05Å; D811-K847 VanDerWaalsContact CB-CE 3.47Å; D811-K847 HydrophobicContact CB-CG 4.41Å; D811-K847 WeakPolarHBondContact OD2-CE 3.44Å; D811-K847 IonicContact OD2-NZ 3.17Å; D811-K847 PolarHBondContact OD2-NZ 2.95Å; F843-K847 HydrophobicContact CE2-CG 4.46Å; F843-K847 PolarHBondContact O-N 2.94Å; I844-K847 PolarHBondContact O-N 3.04Å
848	K	93	Very high	95.1	Very high	48 Å²	48	36 Å²	36	21%	0.209	17%	0.167	C	C	.	.			trans	46.4	59.1	171.8	-64.8	-173.6	175.5	-178.7	0	113.9	E776 W777 R784 I844 F881	E776-K848 HydrophobicContact CG-CD 4.17Å; E776-K848 IonicContact OE1-NZ 2.64Å; E776-K848 PolarHBondContact OE1-NZ 3.49Å; E776-K848 IonicContact OE2-NZ 2.79Å; E776-K848 PolarHBondContact OE2-NZ 2.95Å; W777-K848 HydrophobicContact CH2-CB 3.55Å; W777-K848 HydrophobicContact CH2-CD 4.35Å; W777-K848 HydrophobicContact CH2-CG 3.94Å; W777-K848 HydrophobicContact CZ2-CB 3.94Å; W777-K848 HydrophobicContact CZ2-CD 3.86Å; W777-K848 HydrophobicContact CZ2-CG 3.95Å; W777-K848 HydrophobicContact CZ3-CB 3.98Å; R784-K848 VanDerWaalsContact CZ-O 3.29Å; R784-K848 PolarHBondContact NE-O 3.27Å; R784-K848 PolarHBondContact NH2-O 2.81Å; I844-K848 WeakPolarHBondContact O-CA 3.37Å; I844-K848 PolarHBondContact O-N 3.43Å; K848-F881 HydrophobicContact CD-CZ 4.3Å; K848-F881 HydrophobicContact CG-CE1 4.01Å; K848-F881 HydrophobicContact CG-CZ 3.87Å
849	P	94.6	Very high	94.8	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	15%	0.153	C	C	.	.			trans	-68.5	146.2	176.6	31.7	-36.4	0	0	0	111.4	L786 I844 V852 I884	L786-P849 HydrophobicContact CB-CB 3.7Å; L786-P849 HydrophobicContact CB-CG 3.83Å; L786-P849 HydrophobicContact CD2-CG 4.32Å; I844-P849 HydrophobicContact CG2-CG 4.45Å; P849-V852 HydrophobicContact CG-CG2 4.42Å; P849-I884 WeakPolarHBondContact O-CD1 3.32Å
850	H	93.9	Very high	94.6	Very high	4 Å²	4	30.3 Å²	30.3	2%	0.019	15%	0.146	C	C	.	.	S	Bend	trans	-84.6	-17.5	-179.9	-52.6	86	0	0	0	113.1	P766 W777 I783 R784	P766-H850 HydrophobicContact CG-CB 4.24Å; W777-H850 AromaticContact CE3-CD2 3.96Å; I783-H850 HydrophobicContact CB-CB 4.41Å; I783-H850 HydrophobicContact CG2-CB 4.26Å; R784-H850 PolarHBondContact N-CE1 2.66Å; R784-H850 PolarHBondContact N-ND1 2.73Å; R784-H850 PolarHBondContact NH2-NE2 2.73Å; R784-H850 PolarHBondContact O-N 3.49Å; R784-H850 PolarHBondContact O-ND1 3.04Å; R784-H850 VanDerWaalsContact O-ND1 3.14Å
851	I	95.5	Very high	94.5	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	144.5	175.6	176.6	165.6	0	0	0	108.4	Y764 I783 V785 L786 V853 E887 M924	Y764-I851 HydrophobicContact CD1-CB 4.09Å; Y764-I851 HydrophobicContact CD1-CD1 3.82Å; Y764-I851 HydrophobicContact CD1-CG2 3.79Å; Y764-I851 HydrophobicContact CD2-CD1 4.27Å; Y764-I851 HydrophobicContact CE1-CB 3.76Å; Y764-I851 HydrophobicContact CE1-CD1 3.59Å; Y764-I851 HydrophobicContact CE1-CG1 4.21Å; Y764-I851 HydrophobicContact CE1-CG2 4Å; Y764-I851 HydrophobicContact CE2-CD1 4.09Å; Y764-I851 HydrophobicContact CG-CD1 4.15Å; I783-I851 HydrophobicContact CD1-CG2 4.28Å; V785-I851 HydrophobicContact CB-CG2 4.39Å; V785-I851 HydrophobicContact CG1-CG2 4.11Å; V785-I851 HydrophobicContact CG2-CG2 3.84Å; L786-I851 PolarHBondContact N-O 3.04Å; L786-I851 VanDerWaalsContact N-O 3.08Å; I851-V853 HydrophobicContact CD1-CG2 4.38Å; I851-V853 HydrophobicContact CG1-CG2 4.11Å; I851-E887 HydrophobicContact CD1-CB 4.43Å; I851-E887 HydrophobicContact CD1-CG 3.95Å; I851-M924 HydrophobicContact CD1-CG 4.21Å; I851-M924 HydrophobicContact CD1-SD 3.87Å; I851-M924 HydrophobicContact CG2-CG 4.23Å
852	V	97.4	Very high	94.4	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	135.8	170	-173	0	0	0	0	109.2	L786 P849 I868 L872 I884 E885 V886 E887	L786-V852 HydrophobicContact CB-CG1 4.34Å; L786-V852 HydrophobicContact CB-CG2 4.29Å; L786-V852 HydrophobicContact CD2-CG1 3.88Å; L786-V852 HydrophobicContact CD2-CG2 3.99Å; L786-V852 HydrophobicContact CG-CG1 4.04Å; L786-V852 CarbonylContact O-C 3.5Å; L786-V852 WeakPolarHBondContact O-CA 3.39Å; P849-V852 HydrophobicContact CG-CG2 4.42Å; V852-I868 HydrophobicContact CG1-CD1 4.25Å; V852-I868 HydrophobicContact CG1-CG2 4.23Å; V852-I868 HydrophobicContact CG2-CG2 4.45Å; V852-L872 HydrophobicContact CG2-CD1 4.29Å; V852-I884 HydrophobicContact CG2-CG2 4.13Å; V852-E885 PolarHBondContact N-O 3.03Å; V852-V886 HydrophobicContact CB-CB 4.46Å; V852-V886 HydrophobicContact CB-CG1 4.1Å; V852-V886 HydrophobicContact CB-CG2 4.23Å; V852-V886 HydrophobicContact CG1-CG1 4.2Å; V852-V886 CarbonylContact O-C 3.46Å; V852-V886 WeakPolarHBondContact O-CA 3.47Å; V852-E887 PolarHBondContact O-N 3.42Å
853	V	97.3	Very high	94.2	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	125.5	-172	176.4	0	0	0	0	109.1	V785 L786 G787 L788 I851 I889 L920 M924	V785-V853 HydrophobicContact CG1-CB 4.39Å; V785-V853 HydrophobicContact CG1-CG2 3.69Å; L786-V853 PolarHBondContact O-N 3.16Å; G787-V853 CarbonylContact C-O 3.4Å; G787-V853 WeakPolarHBondContact CA-O 3.46Å; L788-V853 PolarHBondContact N-O 3.33Å; I851-V853 HydrophobicContact CD1-CG2 4.38Å; I851-V853 HydrophobicContact CG1-CG2 4.11Å; V853-I889 HydrophobicContact CG1-CD1 3.38Å; V853-I889 HydrophobicContact CG1-CG1 3.56Å; V853-I889 HydrophobicContact CG1-CG2 4.29Å; V853-L920 HydrophobicContact CG1-CB 4.28Å; V853-M924 HydrophobicContact CG2-CB 4.04Å; V853-M924 HydrophobicContact CG2-CG 3.89Å; V853-M924 HydrophobicContact CG2-SD 4.32Å
854	I	97.8	Very high	94.2	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	129.9	-179.7	-58.9	166.6	0	0	0	109.4	L788 Y790 A856 A861 I864 Q865 I868 V886 E887 I888 I889	L788-I854 HydrophobicContact CD2-CG2 4.5Å; Y790-I854 HydrophobicContact CE1-CG2 4.09Å; I854-A856 PolarHBondContact O-N 3.31Å; I854-A861 HydrophobicContact CG2-CB 3.89Å; I854-I864 HydrophobicContact CD1-CB 4.34Å; I854-I864 HydrophobicContact CD1-CG2 3.91Å; I854-I864 HydrophobicContact CG1-CG2 4.42Å; I854-Q865 HydrophobicContact CD1-CB 3.75Å; I854-Q865 HydrophobicContact CD1-CG 4.22Å; I854-I868 HydrophobicContact CD1-CD1 4.27Å; I854-V886 HydrophobicContact CD1-CG1 3.71Å; I854-V886 HydrophobicContact CG1-CG1 4.31Å; I854-E887 PolarHBondContact N-O 3.38Å; I854-I888 HydrophobicContact CB-CG1 4.3Å; I854-I888 WeakPolarHBondContact O-CA 3.19Å; I854-I889 PolarHBondContact O-N 3.01Å
855	G	96.7	Very high	94.2	Very high	2 Å²	2	31.6 Å²	31.6	2%	0.021	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65	127.6	172.3	0	0	0	0	0	112.1	L788 Y790 E857	L788-G855 PolarHBondContact O-N 3.27Å; Y790-G855 VanDerWaalsContact CE1-O 3.3Å; Y790-G855 WeakPolarHBondContact CE1-O 3.48Å; G855-E857 VanDerWaalsContact C-N 3.31Å; G855-E857 PolarHBondContact O-N 3.12Å
856	A	94.7	Very high	94.3	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	16%	0.156	C	C	.	.			trans	-77.7	70.5	-178.3	0	0	0	0	0	112.3	I854 I888 I889 N891 M1154 L1155 K1157	I854-A856 PolarHBondContact O-N 3.31Å; A856-I888 HydrophobicContact CB-CG2 3.68Å; A856-I889 WeakPolarHBondContact CB-O 3.15Å; A856-I889 PolarHBondContact N-O 3.43Å; A856-N891 PolarHBondContact O-OD1 3.1Å; A856-M1154 HydrophobicContact CB-CB 3.96Å; A856-M1154 HydrophobicContact CB-SD 4.47Å; A856-M1154 VanDerWaalsContact O-O 3.08Å; A856-L1155 HydrophobicContact CB-CD2 3.68Å; A856-K1157 VanDerWaalsContact O-CE 3.3Å; A856-K1157 WeakPolarHBondContact O-CE 3.29Å; A856-K1157 PolarHBondContact O-NZ 2.78Å
857	E	92.5	Very high	94.3	Very high	31 Å²	31	25.9 Å²	25.9	15%	0.145	13%	0.133	C	C	.	.	S	Bend	trans	-90	-50.6	-177.2	-171.1	59.2	-167.9	0	0	114.2	Y790 P792 G855 N891 K895	Y790-E857 HydrophobicContact CE1-CB 4.37Å; Y790-E857 HydrophobicContact CE2-CB 4.13Å; P792-E857 HydrophobicContact CG-CG 3.81Å; G855-E857 VanDerWaalsContact C-N 3.31Å; G855-E857 PolarHBondContact O-N 3.12Å; E857-N891 PolarHBondContact OE2-ND2 3.08Å; E857-K895 IonicContact OE1-NZ 2.72Å; E857-K895 PolarHBondContact OE1-NZ 3.32Å; E857-K895 WeakPolarHBondContact OE2-CE 3.28Å; E857-K895 IonicContact OE2-NZ 2.73Å; E857-K895 PolarHBondContact OE2-NZ 2.87Å
858	S	91.9	Very high	94.4	Very high	18 Å²	18	23.6 Å²	23.6	13%	0.126	12%	0.123	C	C	.	.	S	Bend	trans	-138.2	175.2	173.6	83.4	0	0	0	0	110.9	Y790 D860 A861 L1155	Y790-S858 PolarHBondContact OH-N 3.41Å; Y790-S858 PolarHBondContact OH-O 3.46Å; S858-D860 PolarHBondContact O-N 3.35Å; S858-D860 WeakPolarHBondContact OG-CB 3.48Å; S858-D860 PolarHBondContact OG-N 3.34Å; S858-D860 PolarHBondContact OG-OD2 2.92Å; S858-D860 VanDerWaalsContact OG-OD2 3.04Å; S858-A861 WeakPolarHBondContact O-CB 3.44Å; S858-A861 PolarHBondContact O-N 3.26Å; S858-L1155 WeakPolarHBondContact O-CD2 3.5Å
859	R	90.3	Very high	94.6	Very high	97 Å²	97	25.4 Å²	25.4	37%	0.366	13%	0.131	S	C	.	.	T	Hydrogen-bonded Turn	trans	-50	-23.6	170.3	-171.8	177	-178.8	158.3	9.9	113.9	A861 Q862 R1278 F1279	R859-A861 PolarHBondContact O-N 2.7Å; R859-Q862 WeakPolarHBondContact O-CB 3.24Å; R859-Q862 PolarHBondContact O-N 2.78Å; R859-R1278 PolarHBondContact NH2-O 2.81Å; R859-F1279 VanDerWaalsContact NH1-CB 3.32Å; R859-F1279 PolarHBondContact NH1-O 3.41Å; R859-F1279 VanDerWaalsContact NH1-O 3.1Å
860	D	91.6	Very high	94.6	Very high	46 Å²	46	29.7 Å²	29.7	25%	0.246	15%	0.151	C	C	.	.	H	α-helix	trans	-65.9	-16.3	179.4	-63.3	-71.6	0	0	0	113.8	Y790 L819 S858 Q862 N863 I864	Y790-D860 HydrophobicContact CE2-CB 4.35Å; L819-D860 HydrophobicContact CD2-CB 4.02Å; S858-D860 PolarHBondContact O-N 3.35Å; S858-D860 WeakPolarHBondContact OG-CB 3.48Å; S858-D860 PolarHBondContact OG-N 3.34Å; S858-D860 PolarHBondContact OG-OD2 2.92Å; S858-D860 VanDerWaalsContact OG-OD2 3.04Å; D860-Q862 PolarHBondContact O-N 3.13Å; D860-N863 WeakPolarHBondContact O-CA 3.24Å; D860-N863 WeakPolarHBondContact O-CB 3.33Å; D860-N863 PolarHBondContact O-N 2.9Å; D860-N863 PolarHBondContact OD1-ND2 3.48Å; D860-I864 WeakPolarHBondContact O-CG1 3.43Å; D860-I864 PolarHBondContact O-N 3.2Å
861	A	94.1	Very high	94.6	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-53.5	-36.2	165.2	0	0	0	0	0	112.1	Y790 I854 S858 R859 I864 Q865 I888 L1155	Y790-A861 HydrophobicContact CE1-CB 4.17Å; Y790-A861 WeakPolarHBondContact OH-CB 3.41Å; Y790-A861 PolarHBondContact OH-N 3.22Å; I854-A861 HydrophobicContact CG2-CB 3.89Å; S858-A861 WeakPolarHBondContact O-CB 3.44Å; S858-A861 PolarHBondContact O-N 3.26Å; R859-A861 PolarHBondContact O-N 2.7Å; A861-I864 PolarHBondContact O-N 3.37Å; A861-Q865 VanDerWaalsContact O-CB 3.25Å; A861-Q865 WeakPolarHBondContact O-CB 3.08Å; A861-Q865 PolarHBondContact O-N 3.05Å; A861-I888 HydrophobicContact CB-CD1 4.01Å; A861-I888 HydrophobicContact CB-CG1 4.33Å; A861-I888 HydrophobicContact CB-CG2 4.28Å; A861-L1155 HydrophobicContact CB-CD2 3.83Å
862	Q	92.4	Very high	94.6	Very high	46 Å²	46	30.5 Å²	30.5	22%	0.215	16%	0.155	C	C	.	.	H	α-helix	trans	-68.1	-36.1	176.1	-62.3	178.1	-19.1	0	0	112	R859 D860 A866 I888 L1155 F1279	R859-Q862 WeakPolarHBondContact O-CB 3.24Å; R859-Q862 PolarHBondContact O-N 2.78Å; D860-Q862 PolarHBondContact O-N 3.13Å; Q862-A866 WeakPolarHBondContact O-CB 3.47Å; Q862-A866 PolarHBondContact O-N 2.82Å; Q862-I888 HydrophobicContact CG-CD1 4.39Å; Q862-L1155 HydrophobicContact CG-CD1 3.85Å; Q862-F1279 VanDerWaalsContact NE2-CZ 3.28Å
863	N	92.5	Very high	94.5	Very high	87 Å²	87	36 Å²	36	47%	0.465	18%	0.18	S	C	.	.	H	α-helix	trans	-67.2	-45.7	176	-64.1	-39.9	0	0	0	110.2	D860 A866 D867	D860-N863 WeakPolarHBondContact O-CA 3.24Å; D860-N863 WeakPolarHBondContact O-CB 3.33Å; D860-N863 PolarHBondContact O-N 2.9Å; D860-N863 PolarHBondContact OD1-ND2 3.48Å; N863-A866 PolarHBondContact O-N 2.8Å; N863-D867 PolarHBondContact O-N 2.96Å
864	I	94.9	Very high	94.3	Very high	2 Å²	2	41.3 Å²	41.3	1%	0.01	21%	0.205	C	C	.	.	H	α-helix	trans	-62.7	-44.7	175.8	-61.1	167.9	0	0	0	110.6	L788 Y790 I818 L819 I854 D860 A861 A866 D867 I868	L788-I864 HydrophobicContact CD1-CG2 4.05Å; L788-I864 HydrophobicContact CD2-CD1 4.34Å; L788-I864 HydrophobicContact CD2-CG2 4.31Å; Y790-I864 HydrophobicContact CD1-CD1 3.63Å; Y790-I864 HydrophobicContact CD2-CD1 4.37Å; Y790-I864 HydrophobicContact CE1-CD1 3.82Å; Y790-I864 HydrophobicContact CG-CD1 3.95Å; I818-I864 HydrophobicContact CG1-CG1 4.34Å; I818-I864 HydrophobicContact CG2-CD1 4.3Å; L819-I864 HydrophobicContact CD2-CD1 4.04Å; I854-I864 HydrophobicContact CD1-CB 4.34Å; I854-I864 HydrophobicContact CD1-CG2 3.91Å; I854-I864 HydrophobicContact CG1-CG2 4.42Å; D860-I864 WeakPolarHBondContact O-CG1 3.43Å; D860-I864 PolarHBondContact O-N 3.2Å; A861-I864 PolarHBondContact O-N 3.37Å; I864-A866 VanDerWaalsContact C-N 3.32Å; I864-A866 PolarHBondContact O-N 2.86Å; I864-D867 PolarHBondContact O-N 3.09Å; I864-I868 HydrophobicContact CG2-CD1 3.71Å; I864-I868 HydrophobicContact CG2-CG1 4.32Å; I864-I868 WeakPolarHBondContact O-CG1 3.42Å; I864-I868 PolarHBondContact O-N 2.94Å
865	Q	95.3	Very high	94.1	Very high	37 Å²	37	41.7 Å²	41.7	17%	0.173	21%	0.207	C	C	.	.	H	α-helix	trans	-60.3	-40.6	177.8	-165.3	-161.1	49.6	0	0	111.7	I854 A861 K869 V886 I888	I854-Q865 HydrophobicContact CD1-CB 3.75Å; I854-Q865 HydrophobicContact CD1-CG 4.22Å; A861-Q865 VanDerWaalsContact O-CB 3.25Å; A861-Q865 WeakPolarHBondContact O-CB 3.08Å; A861-Q865 PolarHBondContact O-N 3.05Å; Q865-K869 VanDerWaalsContact CD-NZ 3.27Å; Q865-K869 HydrophobicContact CG-CD 4.17Å; Q865-K869 VanDerWaalsContact NE2-NZ 3.14Å; Q865-K869 WeakPolarHBondContact O-CB 3.43Å; Q865-K869 VanDerWaalsContact O-CG 3.29Å; Q865-K869 WeakPolarHBondContact O-CG 3.24Å; Q865-K869 PolarHBondContact O-N 2.96Å; Q865-V886 HydrophobicContact CG-CB 4.11Å; Q865-V886 HydrophobicContact CG-CG1 3.78Å; Q865-V886 PolarHBondContact NE2-O 3.43Å; Q865-I888 HydrophobicContact CB-CD1 4.1Å; Q865-I888 HydrophobicContact CB-CG1 4.43Å; Q865-I888 HydrophobicContact CG-CD1 4.35Å; Q865-I888 HydrophobicContact CG-CG1 4.42Å
866	A	95.3	Very high	93.8	Very high	58 Å²	58	45.4 Å²	45.4	48%	0.479	22%	0.224	S	C	.	.	H	α-helix	trans	-65.6	-46.6	176.2	0	0	0	0	0	112.3	Q862 N863 I864 I868 K869 E870	Q862-A866 WeakPolarHBondContact O-CB 3.47Å; Q862-A866 PolarHBondContact O-N 2.82Å; N863-A866 PolarHBondContact O-N 2.8Å; I864-A866 VanDerWaalsContact C-N 3.32Å; I864-A866 PolarHBondContact O-N 2.86Å; A866-I868 VanDerWaalsContact C-N 3.33Å; A866-I868 PolarHBondContact O-N 3.42Å; A866-K869 PolarHBondContact O-N 3.44Å; A866-E870 PolarHBondContact O-N 3.2Å
867	D	95.2	Very high	93.6	Very high	19 Å²	19	50.3 Å²	50.3	10%	0.102	25%	0.254	C	S	.	.	H	α-helix	trans	-61.6	-38.7	176.6	-77.6	-54.8	0	0	0	112.3	K822 K833 L837 N863 I864 E870 I871	K822-D867 VanDerWaalsContact CD-OD1 3.25Å; K822-D867 WeakPolarHBondContact CD-OD1 3.49Å; K833-D867 WeakPolarHBondContact CE-OD2 3.35Å; K833-D867 IonicContact NZ-OD2 3.85Å; K833-D867 PolarHBondContact NZ-OD2 3.29Å; L837-D867 HydrophobicContact CD1-CB 4.37Å; L837-D867 HydrophobicContact CD2-CB 3.77Å; N863-D867 PolarHBondContact O-N 2.96Å; I864-D867 PolarHBondContact O-N 3.09Å; D867-E870 PolarHBondContact O-N 3.14Å; D867-I871 WeakPolarHBondContact O-CG1 3.39Å; D867-I871 PolarHBondContact O-N 2.95Å; D867-I871 VanDerWaalsContact O-N 3.16Å
868	I	96	Very high	93.5	Very high	1 Å²	1	52.7 Å²	52.7	1%	0.005	27%	0.274	C	S	.	.	H	α-helix	trans	-73.2	-38.6	178.3	-65.1	176.1	0	0	0	111.4	L788 L840 I844 V852 I854 I864 A866 E870 I871 L872 V886	L788-I868 HydrophobicContact CD1-CD1 4.01Å; L840-I868 HydrophobicContact CD2-CD1 3.9Å; L840-I868 HydrophobicContact CD2-CG1 3.8Å; I844-I868 HydrophobicContact CD1-CG2 4.41Å; V852-I868 HydrophobicContact CG1-CD1 4.25Å; V852-I868 HydrophobicContact CG1-CG2 4.23Å; V852-I868 HydrophobicContact CG2-CG2 4.45Å; I854-I868 HydrophobicContact CD1-CD1 4.27Å; I864-I868 HydrophobicContact CG2-CD1 3.71Å; I864-I868 HydrophobicContact CG2-CG1 4.32Å; I864-I868 WeakPolarHBondContact O-CG1 3.42Å; I864-I868 PolarHBondContact O-N 2.94Å; A866-I868 VanDerWaalsContact C-N 3.33Å; A866-I868 PolarHBondContact O-N 3.42Å; I868-E870 VanDerWaalsContact C-N 3.26Å; I868-E870 PolarHBondContact O-N 2.81Å; I868-I871 WeakPolarHBondContact O-CB 3.48Å; I868-I871 PolarHBondContact O-N 3.34Å; I868-L872 HydrophobicContact CG2-CD1 3.99Å; I868-L872 HydrophobicContact CG2-CG 4.31Å; I868-L872 WeakPolarHBondContact O-CG 3.39Å; I868-L872 PolarHBondContact O-N 2.84Å; I868-V886 HydrophobicContact CB-CG1 4.37Å; I868-V886 HydrophobicContact CG2-CG1 4.11Å; I868-V886 HydrophobicContact CG2-CG2 3.77Å
869	K	96.2	Very high	93.2	Very high	86 Å²	86	56.3 Å²	56.3	37%	0.374	29%	0.289	S	S	.	.	H	α-helix	trans	-62.7	-33.3	173.8	-76.6	175.8	178.6	175.1	0	112	Q865 A866 H873 V886	Q865-K869 VanDerWaalsContact CD-NZ 3.27Å; Q865-K869 HydrophobicContact CG-CD 4.17Å; Q865-K869 VanDerWaalsContact NE2-NZ 3.14Å; Q865-K869 WeakPolarHBondContact O-CB 3.43Å; Q865-K869 VanDerWaalsContact O-CG 3.29Å; Q865-K869 WeakPolarHBondContact O-CG 3.24Å; Q865-K869 PolarHBondContact O-N 2.96Å; A866-K869 PolarHBondContact O-N 3.44Å; K869-H873 WeakPolarHBondContact O-CB 3.4Å; K869-H873 PolarHBondContact O-N 3.32Å; K869-H873 VanDerWaalsContact O-N 3.07Å; K869-V886 HydrophobicContact CG-CB 4.11Å; K869-V886 HydrophobicContact CG-CG2 3.82Å
870	E	94.8	Very high	92.9	Very high	89 Å²	89	59.4 Å²	59.4	42%	0.416	31%	0.308	S	S	.	.	H	α-helix	trans	-66	-46.6	171.8	-159.5	-179.3	147.2	0	0	111.5	K822 A866 D867 I868 L872 H873 E874	K822-E870 IonicContact NZ-OE1 2.69Å; K822-E870 PolarHBondContact NZ-OE1 3.02Å; K822-E870 IonicContact NZ-OE2 3.77Å; K822-E870 PolarHBondContact NZ-OE2 2.79Å; A866-E870 PolarHBondContact O-N 3.2Å; D867-E870 PolarHBondContact O-N 3.14Å; I868-E870 VanDerWaalsContact C-N 3.26Å; I868-E870 PolarHBondContact O-N 2.81Å; E870-L872 PolarHBondContact O-N 2.67Å; E870-H873 PolarHBondContact O-N 3.38Å; E870-E874 WeakPolarHBondContact O-CG 3.45Å; E870-E874 PolarHBondContact O-N 2.88Å
871	I	95.2	Very high	92.8	Very high	9 Å²	9	57.8 Å²	57.8	5%	0.046	30%	0.299	C	S	.	.	H	α-helix	trans	-57.3	-45.6	174.4	-72.6	167.7	0	0	0	111.8	L837 I844 D867 I868 E874 L875	L837-I871 HydrophobicContact CB-CD1 4.19Å; L837-I871 HydrophobicContact CD2-CD1 3.93Å; L837-I871 WeakPolarHBondContact O-CD1 3.3Å; I844-I871 HydrophobicContact CD1-CG2 4.24Å; D867-I871 WeakPolarHBondContact O-CG1 3.39Å; D867-I871 PolarHBondContact O-N 2.95Å; D867-I871 VanDerWaalsContact O-N 3.16Å; I868-I871 WeakPolarHBondContact O-CB 3.48Å; I868-I871 PolarHBondContact O-N 3.34Å; I871-E874 PolarHBondContact O-N 3.2Å; I871-L875 HydrophobicContact CG2-CD1 4Å; I871-L875 WeakPolarHBondContact O-CG 3.45Å; I871-L875 PolarHBondContact O-N 3.39Å
872	L	95	Very high	92.6	Very high	13 Å²	13	58 Å²	58	7%	0.068	30%	0.3	C	S	.	.	H	α-helix	trans	-68.3	-36.2	-178.3	-71.3	172.2	0	0	0	112.3	I844 V852 I868 E870 L875 E876 I884 V886	I844-L872 HydrophobicContact CG2-CD2 3.79Å; V852-L872 HydrophobicContact CG2-CD1 4.29Å; I868-L872 HydrophobicContact CG2-CD1 3.99Å; I868-L872 HydrophobicContact CG2-CG 4.31Å; I868-L872 WeakPolarHBondContact O-CG 3.39Å; I868-L872 PolarHBondContact O-N 2.84Å; E870-L872 PolarHBondContact O-N 2.67Å; L872-L875 PolarHBondContact O-N 2.86Å; L872-E876 WeakPolarHBondContact O-CB 3.37Å; L872-E876 PolarHBondContact O-N 3Å; L872-I884 HydrophobicContact CD1-CB 4.08Å; L872-I884 HydrophobicContact CD1-CG2 3.92Å; L872-I884 HydrophobicContact CD2-CB 4.1Å; L872-I884 HydrophobicContact CD2-CD1 4.03Å; L872-I884 HydrophobicContact CD2-CG2 4.26Å; L872-V886 HydrophobicContact CD1-CG2 3.3Å
873	H	94.8	Very high	92.5	Very high	115 Å²	115	59.3 Å²	59.3	53%	0.532	31%	0.312	S	S	.	.	H	α-helix	trans	-70.6	-33.1	174	-171.9	50.8	0	0	0	112.5	K869 E870 E876 T877	K869-H873 WeakPolarHBondContact O-CB 3.4Å; K869-H873 PolarHBondContact O-N 3.32Å; K869-H873 VanDerWaalsContact O-N 3.07Å; E870-H873 PolarHBondContact O-N 3.38Å; H873-E876 IonicContact CE1-OE2 3.95Å; H873-E876 IonicContact CG-OE2 3.92Å; H873-E876 IonicContact ND1-OE2 2.66Å; H873-E876 PolarHBondContact ND1-OE2 3.41Å; H873-T877 WeakPolarHBondContact O-CB 3.49Å; H873-T877 PolarHBondContact O-N 3.14Å; H873-T877 VanDerWaalsContact O-N 3.08Å; H873-T877 PolarHBondContact O-OG1 2.84Å
874	E	93.3	Very high	92.5	Very high	112 Å²	112	56 Å²	56	52%	0.523	29%	0.294	S	S	.	.	H	α-helix	trans	-62.4	-43.8	168.3	-74.4	-176.2	170.9	0	0	111.2	E870 I871 T877 S878	E870-E874 WeakPolarHBondContact O-CG 3.45Å; E870-E874 PolarHBondContact O-N 2.88Å; I871-E874 PolarHBondContact O-N 3.2Å; E874-T877 PolarHBondContact O-N 3.15Å; E874-S878 VanDerWaalsContact O-CB 3.27Å; E874-S878 WeakPolarHBondContact O-CB 3.22Å; E874-S878 PolarHBondContact O-N 3.07Å; E874-S878 PolarHBondContact O-OG 3.34Å
875	L	92.5	Very high	92.4	Very high	7 Å²	7	59.1 Å²	59.1	4%	0.037	31%	0.309	C	S	.	.	H	α-helix	trans	-70.6	-38.2	178.2	-71.2	171.8	0	0	0	113.6	I844 K845 I871 L872 T877 E879 Q880 F881	I844-L875 HydrophobicContact CB-CD1 4.31Å; I844-L875 HydrophobicContact CG2-CD1 3.73Å; K845-L875 HydrophobicContact CB-CD2 4.26Å; K845-L875 HydrophobicContact CD-CD2 4.36Å; K845-L875 HydrophobicContact CG-CD2 4.45Å; I871-L875 HydrophobicContact CG2-CD1 4Å; I871-L875 WeakPolarHBondContact O-CG 3.45Å; I871-L875 PolarHBondContact O-N 3.39Å; L872-L875 PolarHBondContact O-N 2.86Å; L875-T877 VanDerWaalsContact C-N 3.32Å; L875-T877 PolarHBondContact O-N 3.01Å; L875-E879 HydrophobicContact CD2-CG 4.07Å; L875-E879 CarbonylContact O-C 3.46Å; L875-E879 WeakPolarHBondContact O-CA 3.43Å; L875-E879 PolarHBondContact O-N 3.44Å; L875-Q880 PolarHBondContact O-N 3.38Å; L875-F881 HydrophobicContact CB-CB 4.32Å; L875-F881 HydrophobicContact CB-CD1 4.44Å; L875-F881 HydrophobicContact CB-CD2 4.38Å; L875-F881 HydrophobicContact CB-CG 4.12Å; L875-F881 PolarHBondContact O-N 2.95Å
876	E	90.4	Very high	92.5	Very high	80 Å²	80	57.3 Å²	57.3	37%	0.374	30%	0.301	S	S	.	.	H	α-helix	trans	-54.5	-49.9	169.4	176.9	-173	-155.9	0	0	110.1	L872 H873 Q880	L872-E876 WeakPolarHBondContact O-CB 3.37Å; L872-E876 PolarHBondContact O-N 3Å; H873-E876 IonicContact CE1-OE2 3.95Å; H873-E876 IonicContact CG-OE2 3.92Å; H873-E876 IonicContact ND1-OE2 2.66Å; H873-E876 PolarHBondContact ND1-OE2 3.41Å; E876-Q880 WeakPolarHBondContact O-CA 3.3Å; E876-Q880 PolarHBondContact O-N 3.39Å
877	T	91.2	Very high	92.5	Very high	104 Å²	104	55.1 Å²	55.1	64%	0.638	28%	0.28	S	S	*	.	H	α-helix	trans	-73.9	-33.1	-175.8	-55.5	0	0	0	0	113.6	H873 E874 L875	H873-T877 WeakPolarHBondContact O-CB 3.49Å; H873-T877 PolarHBondContact O-N 3.14Å; H873-T877 VanDerWaalsContact O-N 3.08Å; H873-T877 PolarHBondContact O-OG1 2.84Å; E874-T877 PolarHBondContact O-N 3.15Å; L875-T877 VanDerWaalsContact C-N 3.32Å; L875-T877 PolarHBondContact O-N 3.01Å
878	S	90.7	Very high	92.5	Very high	80 Å²	80	54.3 Å²	54.3	56%	0.559	28%	0.276	S	S	*	.	H	α-helix	trans	-101.2	-33.6	-172	59.8	0	0	0	0	115	E874	E874-S878 VanDerWaalsContact O-CB 3.27Å; E874-S878 WeakPolarHBondContact O-CB 3.22Å; E874-S878 PolarHBondContact O-N 3.07Å; E874-S878 PolarHBondContact O-OG 3.34Å
879	E	85.8	Confident	92.5	Very high	94 Å²	94	54.8 Å²	54.8	44%	0.439	28%	0.279	S	S	.	.	H	α-helix	trans	-122.1	7.6	-172.4	-58.3	-76.6	161.9	0	0	112.4	K845 L875 F881	K845-E879 HydrophobicContact CD-CG 4.37Å; K845-E879 WeakPolarHBondContact CE-OE2 3.34Å; K845-E879 IonicContact NZ-OE1 2.61Å; K845-E879 PolarHBondContact NZ-OE1 2.87Å; K845-E879 IonicContact NZ-OE2 2.69Å; K845-E879 PolarHBondContact NZ-OE2 3.46Å; L875-E879 HydrophobicContact CD2-CG 4.07Å; L875-E879 CarbonylContact O-C 3.46Å; L875-E879 WeakPolarHBondContact O-CA 3.43Å; L875-E879 PolarHBondContact O-N 3.44Å; E879-F881 VanDerWaalsContact C-N 3.31Å; E879-F881 HydrophobicContact CB-CD2 3.75Å; E879-F881 HydrophobicContact CB-CE2 3.88Å; E879-F881 PolarHBondContact O-N 2.84Å
880	Q	83.9	Confident	92.3	Very high	162 Å²	162	52.3 Å²	52.3	76%	0.757	27%	0.269	S	S	*	.			trans	58.8	37.4	179	-56.2	-179.9	-0.1	0	0	113.5	F772 L875 E876	F772-Q880 WeakPolarHBondContact CE1-O 3.29Å; L875-Q880 PolarHBondContact O-N 3.38Å; E876-Q880 WeakPolarHBondContact O-CA 3.3Å; E876-Q880 PolarHBondContact O-N 3.39Å
881	F	89.4	Confident	92.3	Very high	13 Å²	13	48.2 Å²	48.2	6%	0.057	25%	0.25	C	S	.	.			trans	-66.6	145.2	172.1	-85.7	-129.2	0	0	0	110.6	W777 I844 K845 K848 L875 E879 I884	W777-F881 AromaticContact CH2-CD1 3.7Å; W777-F881 HydrophobicContact CH2-CD1 3.7Å; W777-F881 AromaticContact CH2-CE1 3.75Å; W777-F881 HydrophobicContact CH2-CE1 3.75Å; W777-F881 HydrophobicContact CH2-CG 4.47Å; W777-F881 AromaticContact CZ2-CD1 3.84Å; W777-F881 HydrophobicContact CZ2-CD1 3.84Å; W777-F881 AromaticContact CZ2-CE1 3.9Å; W777-F881 HydrophobicContact CZ2-CE1 3.9Å; W777-F881 HydrophobicContact CZ2-CG 4.22Å; W777-F881 HydrophobicContact CZ2-CZ 4.33Å; I844-F881 HydrophobicContact CG2-CE1 4.48Å; K845-F881 HydrophobicContact CB-CZ 4.41Å; K845-F881 HydrophobicContact CG-CE2 4.46Å; K845-F881 HydrophobicContact CG-CZ 4.2Å; K848-F881 HydrophobicContact CD-CZ 4.3Å; K848-F881 HydrophobicContact CG-CE1 4.01Å; K848-F881 HydrophobicContact CG-CZ 3.87Å; L875-F881 HydrophobicContact CB-CB 4.32Å; L875-F881 HydrophobicContact CB-CD1 4.44Å; L875-F881 HydrophobicContact CB-CD2 4.38Å; L875-F881 HydrophobicContact CB-CG 4.12Å; L875-F881 PolarHBondContact O-N 2.95Å; E879-F881 VanDerWaalsContact C-N 3.31Å; E879-F881 HydrophobicContact CB-CD2 3.75Å; E879-F881 HydrophobicContact CB-CE2 3.88Å; E879-F881 PolarHBondContact O-N 2.84Å; F881-I884 HydrophobicContact CD1-CD1 3.88Å
882	P	89	Confident	92.3	Very high	3 Å²	3	50 Å²	50	2%	0.019	26%	0.259	C	S	.	.			trans	-64.9	161.1	169.3	29.9	-34.9	0	0	0	110.6	L768 F772 W777 I884	L768-P882 HydrophobicContact CD2-CB 3.87Å; L768-P882 HydrophobicContact CD2-CG 4.06Å; F772-P882 HydrophobicContact CD1-CB 4.12Å; F772-P882 HydrophobicContact CD1-CG 4.43Å; F772-P882 HydrophobicContact CD2-CB 4.15Å; F772-P882 HydrophobicContact CE1-CB 4.22Å; F772-P882 HydrophobicContact CE2-CB 4.25Å; F772-P882 HydrophobicContact CG-CB 4.08Å; F772-P882 HydrophobicContact CZ-CB 4.28Å; W777-P882 HydrophobicContact CD2-CG 3.71Å; W777-P882 HydrophobicContact CE3-CG 3.84Å; W777-P882 HydrophobicContact CG-CG 4.21Å; W777-P882 HydrophobicContact CH2-CG 4.2Å; W777-P882 HydrophobicContact CZ2-CG 4.1Å; W777-P882 HydrophobicContact CZ3-CG 4.08Å; P882-I884 HydrophobicContact CG-CG1 4.49Å; P882-I884 PolarHBondContact O-N 3.27Å
883	P	90.3	Very high	92.3	Very high	74 Å²	74	49.4 Å²	49.4	48%	0.481	26%	0.255	S	S	.	.			trans	-66.3	96.5	175.9	27.4	-34.8	0	0	0	110.8	P769	P769-P883 HydrophobicContact CG-CG 4.32Å
884	I	93	Very high	92.3	Very high	17 Å²	17	44 Å²	44	9%	0.087	23%	0.23	C	C	.	.			trans	-84.5	130.6	177.7	-67.7	157.9	0	0	0	109.5	W777 P849 V852 L872 F881 P882	W777-I884 HydrophobicContact CH2-CD1 3.85Å; W777-I884 HydrophobicContact CZ3-CD1 3.98Å; W777-I884 HydrophobicContact CZ3-CG1 4.48Å; P849-I884 WeakPolarHBondContact O-CD1 3.32Å; V852-I884 HydrophobicContact CG2-CG2 4.13Å; L872-I884 HydrophobicContact CD1-CB 4.08Å; L872-I884 HydrophobicContact CD1-CG2 3.92Å; L872-I884 HydrophobicContact CD2-CB 4.1Å; L872-I884 HydrophobicContact CD2-CD1 4.03Å; L872-I884 HydrophobicContact CD2-CG2 4.26Å; F881-I884 HydrophobicContact CD1-CD1 3.88Å; P882-I884 HydrophobicContact CG-CG1 4.49Å; P882-I884 PolarHBondContact O-N 3.27Å
885	E	94.1	Very high	92.4	Very high	68 Å²	68	42 Å²	42	32%	0.318	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	151.2	177.7	-73.5	-77.2	-152.9	0	0	112.3	V852 K1145	V852-E885 PolarHBondContact N-O 3.03Å; E885-K1145 IonicContact OE1-NZ 3.26Å; E885-K1145 PolarHBondContact OE1-NZ 3.27Å; E885-K1145 IonicContact OE2-NZ 2.73Å; E885-K1145 PolarHBondContact OE2-NZ 3.32Å
886	V	95.9	Very high	92.6	Very high	0 Å²	0	43 Å²	43	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	102.1	177.1	-169	0	0	0	0	108.7	V852 I854 Q865 I868 K869 L872	V852-V886 HydrophobicContact CB-CB 4.46Å; V852-V886 HydrophobicContact CB-CG1 4.1Å; V852-V886 HydrophobicContact CB-CG2 4.23Å; V852-V886 HydrophobicContact CG1-CG1 4.2Å; V852-V886 CarbonylContact O-C 3.46Å; V852-V886 WeakPolarHBondContact O-CA 3.47Å; I854-V886 HydrophobicContact CD1-CG1 3.71Å; I854-V886 HydrophobicContact CG1-CG1 4.31Å; Q865-V886 HydrophobicContact CG-CB 4.11Å; Q865-V886 HydrophobicContact CG-CG1 3.78Å; Q865-V886 PolarHBondContact NE2-O 3.43Å; I868-V886 HydrophobicContact CB-CG1 4.37Å; I868-V886 HydrophobicContact CG2-CG1 4.11Å; I868-V886 HydrophobicContact CG2-CG2 3.77Å; K869-V886 HydrophobicContact CG-CB 4.11Å; K869-V886 HydrophobicContact CG-CG2 3.82Å; L872-V886 HydrophobicContact CD1-CG2 3.3Å
887	E	95.3	Very high	92.8	Very high	11 Å²	11	39.2 Å²	39.2	5%	0.051	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	152.4	-177.4	-62	-52	142.3	0	0	112.1	I851 V852 I854 I889 Y1143 K1145	I851-E887 HydrophobicContact CD1-CB 4.43Å; I851-E887 HydrophobicContact CD1-CG 3.95Å; V852-E887 PolarHBondContact O-N 3.42Å; I854-E887 PolarHBondContact N-O 3.38Å; E887-I889 HydrophobicContact CB-CG2 4.44Å; E887-Y1143 HydrophobicContact CG-CE1 4.33Å; E887-K1145 VanDerWaalsContact OE1-CD 3.29Å; E887-K1145 WeakPolarHBondContact OE1-CD 3.44Å; E887-K1145 WeakPolarHBondContact OE1-CE 3.46Å; E887-K1145 IonicContact OE1-NZ 3.1Å; E887-K1145 PolarHBondContact OE1-NZ 3.24Å
888	I	96.5	Very high	93	Very high	2 Å²	2	34.3 Å²	34.3	1%	0.01	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	123.9	172.9	-66.2	171.5	0	0	0	106.3	I854 A856 A861 Q862 Q865 L1151 L1155	I854-I888 HydrophobicContact CB-CG1 4.3Å; I854-I888 WeakPolarHBondContact O-CA 3.19Å; A856-I888 HydrophobicContact CB-CG2 3.68Å; A861-I888 HydrophobicContact CB-CD1 4.01Å; A861-I888 HydrophobicContact CB-CG1 4.33Å; A861-I888 HydrophobicContact CB-CG2 4.28Å; Q862-I888 HydrophobicContact CG-CD1 4.39Å; Q865-I888 HydrophobicContact CB-CD1 4.1Å; Q865-I888 HydrophobicContact CB-CG1 4.43Å; Q865-I888 HydrophobicContact CG-CD1 4.35Å; Q865-I888 HydrophobicContact CG-CG1 4.42Å; I888-L1151 HydrophobicContact CB-CD1 3.98Å; I888-L1151 HydrophobicContact CD1-CD1 4.24Å; I888-L1151 HydrophobicContact CG2-CD1 3.73Å; I888-L1155 HydrophobicContact CG2-CD2 3.98Å
889	I	94.6	Very high	93.1	Very high	12 Å²	12	35.9 Å²	35.9	6%	0.062	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	154.5	-177.1	74.8	171.6	0	0	0	112	V853 I854 A856 E887 N891 L920 K923	V853-I889 HydrophobicContact CG1-CD1 3.38Å; V853-I889 HydrophobicContact CG1-CG1 3.56Å; V853-I889 HydrophobicContact CG1-CG2 4.29Å; I854-I889 PolarHBondContact O-N 3.01Å; A856-I889 WeakPolarHBondContact CB-O 3.15Å; A856-I889 PolarHBondContact N-O 3.43Å; E887-I889 HydrophobicContact CB-CG2 4.44Å; I889-N891 PolarHBondContact O-N 3.4Å; I889-L920 HydrophobicContact CD1-CD2 3.86Å; I889-L920 HydrophobicContact CG1-CD2 3.69Å; I889-K923 HydrophobicContact CD1-CD 4.13Å
890	D	93.5	Very high	93.3	Very high	33 Å²	33	31.5 Å²	31.5	18%	0.176	16%	0.159	C	C	.	.			trans	-52.2	133.9	170	162.1	58.4	0	0	0	112	E892 K923 M1154	D890-E892 VanDerWaalsContact OD1-CB 3.28Å; D890-E892 WeakPolarHBondContact OD1-CB 3.37Å; D890-E892 PolarHBondContact OD1-N 3.01Å; D890-E892 PolarHBondContact OD2-N 3.43Å; D890-K923 PolarHBondContact O-NZ 3.03Å; D890-K923 IonicContact OD2-NZ 3.19Å; D890-K923 PolarHBondContact OD2-NZ 2.73Å; D890-M1154 HydrophobicContact CB-SD 3.82Å; D890-M1154 PolarHBondContact N-SD 2.98Å; D890-M1154 VanDerWaalsContact N-SD 3.44Å
891	N	94.4	Very high	93.5	Very high	3 Å²	3	28.8 Å²	28.8	2%	0.016	15%	0.145	C	C	.	.			trans	-109.3	6.5	-179.2	66.2	-28	0	0	0	114.6	A856 E857 I889 A894 K895 L920 K1157	A856-N891 PolarHBondContact O-OD1 3.1Å; E857-N891 PolarHBondContact OE2-ND2 3.08Å; I889-N891 PolarHBondContact O-N 3.4Å; N891-A894 PolarHBondContact O-N 3.12Å; N891-A894 VanDerWaalsContact O-N 3.16Å; N891-K895 PolarHBondContact O-N 3.37Å; N891-L920 HydrophobicContact CB-CD2 4.01Å; N891-K1157 PolarHBondContact OD1-NZ 2.85Å
892	E	93.6	Very high	93.5	Very high	48 Å²	48	29.6 Å²	29.6	22%	0.224	15%	0.148	C	C	.	.	H	α-helix	trans	-55.6	-55.2	-179.9	-167.7	-174.7	173.7	0	0	112.2	D890 A894 K895 I896 L944 R945	D890-E892 VanDerWaalsContact OD1-CB 3.28Å; D890-E892 WeakPolarHBondContact OD1-CB 3.37Å; D890-E892 PolarHBondContact OD1-N 3.01Å; D890-E892 PolarHBondContact OD2-N 3.43Å; E892-A894 VanDerWaalsContact C-N 3.27Å; E892-A894 PolarHBondContact O-N 3.25Å; E892-K895 PolarHBondContact O-N 3.03Å; E892-I896 PolarHBondContact O-N 2.92Å; E892-L944 HydrophobicContact CB-CD2 4.49Å; E892-L944 HydrophobicContact CG-CD2 3.99Å; E892-R945 WeakPolarHBondContact OE1-CB 3.31Å; E892-R945 PolarHBondContact OE1-N 3.21Å
893	L	95.2	Very high	93.6	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-51.7	-45	173.5	174.4	60.7	0	0	0	112.4	K895 I896 Y897 K923 E930 Y931 L934 L944	L893-K895 PolarHBondContact O-N 3.18Å; L893-I896 PolarHBondContact O-N 3.12Å; L893-Y897 WeakPolarHBondContact O-CB 3.38Å; L893-Y897 PolarHBondContact O-N 3.44Å; L893-K923 HydrophobicContact CD2-CD 3.97Å; L893-K923 HydrophobicContact CD2-CG 4.15Å; L893-E930 HydrophobicContact CD2-CB 4.18Å; L893-E930 HydrophobicContact CD2-CG 3.82Å; L893-Y931 HydrophobicContact CB-CE1 4.11Å; L893-Y931 HydrophobicContact CD1-CD1 3.85Å; L893-Y931 HydrophobicContact CD1-CE1 4.12Å; L893-Y931 HydrophobicContact CD1-CG 4.44Å; L893-Y931 HydrophobicContact CD2-CD1 3.84Å; L893-Y931 HydrophobicContact CD2-CD2 3.92Å; L893-Y931 HydrophobicContact CD2-CE1 3.85Å; L893-Y931 HydrophobicContact CD2-CE2 3.9Å; L893-Y931 HydrophobicContact CD2-CG 3.86Å; L893-Y931 HydrophobicContact CG-CD1 4.33Å; L893-Y931 HydrophobicContact CG-CE1 4.25Å; L893-L934 HydrophobicContact CD1-CD1 3.58Å; L893-L934 HydrophobicContact CD1-CG 3.92Å; L893-L944 HydrophobicContact CB-CD2 4.47Å
894	A	96.4	Very high	93.6	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-69.4	-33.8	-175.5	0	0	0	0	0	112.2	N891 E892 A898 Q916 L920	N891-A894 PolarHBondContact O-N 3.12Å; N891-A894 VanDerWaalsContact O-N 3.16Å; E892-A894 VanDerWaalsContact C-N 3.27Å; E892-A894 PolarHBondContact O-N 3.25Å; A894-A898 WeakPolarHBondContact O-CB 3.17Å; A894-A898 PolarHBondContact O-N 2.8Å; A894-Q916 HydrophobicContact CB-CB 4.34Å; A894-Q916 WeakPolarHBondContact O-CG 3.5Å; A894-L920 HydrophobicContact CB-CD2 4.15Å; A894-L920 HydrophobicContact CB-CG 3.87Å
895	K	94.9	Very high	93.4	Very high	70 Å²	70	33.6 Å²	33.6	30%	0.304	17%	0.168	S	C	.	.	H	α-helix	trans	-65.3	-43	173.3	-79.6	-176.7	169.3	-174.2	0	112.1	E857 N891 E892 L893 A898	E857-K895 IonicContact OE1-NZ 2.72Å; E857-K895 PolarHBondContact OE1-NZ 3.32Å; E857-K895 WeakPolarHBondContact OE2-CE 3.28Å; E857-K895 IonicContact OE2-NZ 2.73Å; E857-K895 PolarHBondContact OE2-NZ 2.87Å; N891-K895 PolarHBondContact O-N 3.37Å; E892-K895 PolarHBondContact O-N 3.03Å; L893-K895 PolarHBondContact O-N 3.18Å; K895-A898 PolarHBondContact O-N 3.13Å
896	I	95.6	Very high	93.2	Very high	29 Å²	29	32.6 Å²	32.6	15%	0.149	16%	0.164	C	C	.	.	H	α-helix	trans	-67	-49.9	178.4	-59.5	164.9	0	0	0	109.3	E892 L893 A898 N899 S900 L934 C943 L944	E892-I896 PolarHBondContact O-N 2.92Å; L893-I896 PolarHBondContact O-N 3.12Å; I896-A898 VanDerWaalsContact C-N 3.25Å; I896-A898 PolarHBondContact O-N 2.87Å; I896-N899 CarbonylContact O-C 3.52Å; I896-N899 PolarHBondContact O-N 2.89Å; I896-S900 PolarHBondContact O-N 2.81Å; I896-L934 HydrophobicContact CB-CD1 4.08Å; I896-L934 HydrophobicContact CB-CD2 4.44Å; I896-L934 HydrophobicContact CD1-CD1 4.45Å; I896-L934 HydrophobicContact CG2-CD1 3.72Å; I896-L934 HydrophobicContact CG2-CD2 3.81Å; I896-L934 HydrophobicContact CG2-CG 4.42Å; I896-C943 HydrophobicContact CD1-CB 4.04Å; I896-C943 HydrophobicContact CG1-CB 4.41Å; I896-C943 HydrophobicContact CG2-CB 4.14Å; I896-L944 HydrophobicContact CD1-CB 4.39Å; I896-L944 HydrophobicContact CD1-CD2 3.66Å; I896-L944 HydrophobicContact CD1-CG 3.69Å
897	Y	95.4	Very high	93	Very high	1 Å²	1	33.8 Å²	33.8	0%	0.004	17%	0.169	C	C	.	.	H	α-helix	trans	-58.7	-31.8	176.1	174.3	-90.8	0	0	0	113.5	L893 N899 S900 K902 G903 D906 F907 R922 Q933	L893-Y897 WeakPolarHBondContact O-CB 3.38Å; L893-Y897 PolarHBondContact O-N 3.44Å; Y897-N899 PolarHBondContact O-N 2.79Å; Y897-S900 WeakPolarHBondContact CA-OG 3.24Å; Y897-S900 PolarHBondContact O-N 3.33Å; Y897-S900 PolarHBondContact O-OG 3.19Å; Y897-K902 HydrophobicContact CE2-CG 4.11Å; Y897-G903 WeakPolarHBondContact O-CA 3.3Å; Y897-D906 WeakPolarHBondContact OH-CB 3.31Å; Y897-D906 PolarHBondContact OH-OD2 2.81Å; Y897-F907 HydrophobicContact CE1-CD2 4.48Å; Y897-F907 HydrophobicContact CE1-CE2 4.36Å; Y897-F907 WeakPolarHBondContact OH-CE2 3.25Å; Y897-R922 PolarHBondContact OH-NH1 3.13Å; Y897-Q933 HydrophobicContact CD2-CB 3.85Å; Y897-Q933 HydrophobicContact CD2-CG 4.44Å; Y897-Q933 HydrophobicContact CE2-CB 4.03Å; Y897-Q933 HydrophobicContact CE2-CG 4.29Å
898	A	95	Very high	92.7	Very high	1 Å²	1	40.1 Å²	40.1	1%	0.008	20%	0.197	C	C	.	.	H	α-helix	trans	-66.9	-23.6	176.7	0	0	0	0	0	114	A894 K895 I896 P912 K915 Q916	A894-A898 WeakPolarHBondContact O-CB 3.17Å; A894-A898 PolarHBondContact O-N 2.8Å; K895-A898 PolarHBondContact O-N 3.13Å; I896-A898 VanDerWaalsContact C-N 3.25Å; I896-A898 PolarHBondContact O-N 2.87Å; A898-P912 HydrophobicContact CB-CB 4.28Å; A898-P912 WeakPolarHBondContact CB-O 3.35Å; A898-K915 HydrophobicContact CB-CB 3.8Å; A898-K915 HydrophobicContact CB-CD 4.47Å; A898-K915 WeakPolarHBondContact O-CD 3.32Å; A898-K915 PolarHBondContact O-NZ 2.8Å; A898-Q916 HydrophobicContact CB-CG 3.57Å
899	N	92.2	Very high	92.5	Very high	113 Å²	113	48.7 Å²	48.7	60%	0.604	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-109.2	4.3	-179.2	-58.4	-16.9	0	0	0	112.3	I896 Y897	I896-N899 CarbonylContact O-C 3.52Å; I896-N899 PolarHBondContact O-N 2.89Å; Y897-N899 PolarHBondContact O-N 2.79Å
900	S	91.1	Very high	92.5	Very high	2 Å²	2	50.6 Å²	50.6	1%	0.014	24%	0.244	C	C	.	.	S	Bend	trans	-81	156.9	-178.8	57.1	0	0	0	0	113.2	I896 Y897 K902 G903 E904 E940	I896-S900 PolarHBondContact O-N 2.81Å; Y897-S900 WeakPolarHBondContact CA-OG 3.24Å; Y897-S900 PolarHBondContact O-N 3.33Å; Y897-S900 PolarHBondContact O-OG 3.19Å; S900-K902 PolarHBondContact O-N 3.28Å; S900-G903 PolarHBondContact O-N 3.05Å; S900-G903 VanDerWaalsContact O-N 3.13Å; S900-G903 PolarHBondContact OG-N 3.4Å; S900-E904 WeakPolarHBondContact O-CB 3.32Å; S900-E904 WeakPolarHBondContact O-CG 3.47Å; S900-E904 PolarHBondContact O-N 2.96Å; S900-E940 WeakPolarHBondContact CA-OE1 3.36Å; S900-E940 WeakPolarHBondContact CB-OE1 3.48Å; S900-E940 WeakPolarHBondContact CB-OE2 3.48Å
901	K	89	Confident	92.5	Very high	104 Å²	104	51.5 Å²	51.5	45%	0.452	25%	0.251	S	S	.	.	H	α-helix	trans	-59.5	-34.2	169.2	-59.2	-177.9	-164.8	177.3	0	110.6	S905 D938 E940	K901-S905 WeakPolarHBondContact O-CB 3.43Å; K901-S905 PolarHBondContact O-N 3.19Å; K901-S905 PolarHBondContact O-OG 3.47Å; K901-D938 WeakPolarHBondContact CD-OD2 3.46Å; K901-D938 WeakPolarHBondContact CE-OD2 3.48Å; K901-D938 IonicContact NZ-OD1 2.58Å; K901-D938 PolarHBondContact NZ-OD1 2.94Å; K901-D938 IonicContact NZ-OD2 2.67Å; K901-D938 PolarHBondContact NZ-OD2 2.87Å; K901-E940 PolarHBondContact N-OE1 3.26Å
902	K	88.6	Confident	92.6	Very high	30 Å²	30	54.5 Å²	54.5	13%	0.13	27%	0.271	C	S	.	.	H	α-helix	trans	-65.2	-46.4	173.3	-176.9	52.3	177.1	160.4	0	112.6	Y897 S900 E904 S905 D906 Q933	Y897-K902 HydrophobicContact CE2-CG 4.11Å; S900-K902 PolarHBondContact O-N 3.28Å; K902-E904 VanDerWaalsContact C-N 3.34Å; K902-E904 PolarHBondContact O-N 2.62Å; K902-S905 WeakPolarHBondContact CA-OG 3.48Å; K902-S905 PolarHBondContact O-N 2.88Å; K902-S905 PolarHBondContact O-OG 3.03Å; K902-D906 WeakPolarHBondContact CE-OD1 3.11Å; K902-D906 WeakPolarHBondContact CE-OD2 3.3Å; K902-D906 IonicContact NZ-OD1 3.14Å; K902-D906 PolarHBondContact NZ-OD1 3.18Å; K902-D906 IonicContact NZ-OD2 2.74Å; K902-D906 WeakPolarHBondContact O-CB 3.43Å; K902-D906 VanDerWaalsContact O-CG 3.32Å; K902-D906 PolarHBondContact O-N 2.99Å; K902-Q933 HydrophobicContact CG-CB 4.36Å
903	G	90.3	Very high	92.7	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-73.9	-21.3	177.3	0	0	0	0	0	114.3	Y897 S900 F907 K915	Y897-G903 WeakPolarHBondContact O-CA 3.3Å; S900-G903 PolarHBondContact O-N 3.05Å; S900-G903 VanDerWaalsContact O-N 3.13Å; S900-G903 PolarHBondContact OG-N 3.4Å; G903-F907 PolarHBondContact O-N 3.18Å; G903-K915 WeakPolarHBondContact O-CD 3.5Å; G903-K915 WeakPolarHBondContact O-CE 3.38Å; G903-K915 PolarHBondContact O-NZ 3.08Å; G903-K915 VanDerWaalsContact O-NZ 3.15Å
904	E	90.9	Very high	92.7	Very high	110 Å²	110	53.2 Å²	53.2	51%	0.514	27%	0.266	S	S	.	.	H	α-helix	trans	-73.9	-46	166.5	-75.2	-174.6	168.5	0	0	112.6	S900 K902 F907 K908	S900-E904 WeakPolarHBondContact O-CB 3.32Å; S900-E904 WeakPolarHBondContact O-CG 3.47Å; S900-E904 PolarHBondContact O-N 2.96Å; K902-E904 VanDerWaalsContact C-N 3.34Å; K902-E904 PolarHBondContact O-N 2.62Å; E904-F907 CarbonylContact O-C 3.59Å; E904-F907 PolarHBondContact O-N 3.37Å; E904-K908 WeakPolarHBondContact O-CA 3.41Å; E904-K908 WeakPolarHBondContact O-CG 3.33Å; E904-K908 PolarHBondContact O-N 2.98Å
905	S	89.6	Confident	92.7	Very high	69 Å²	69	53.7 Å²	53.7	48%	0.483	27%	0.268	S	S	.	.	H	α-helix	trans	-64.6	-42.6	175.3	53.5	0	0	0	0	113	K901 K902 F907	K901-S905 WeakPolarHBondContact O-CB 3.43Å; K901-S905 PolarHBondContact O-N 3.19Å; K901-S905 PolarHBondContact O-OG 3.47Å; K902-S905 WeakPolarHBondContact CA-OG 3.48Å; K902-S905 PolarHBondContact O-N 2.88Å; K902-S905 PolarHBondContact O-OG 3.03Å; S905-F907 VanDerWaalsContact C-N 3.31Å; S905-F907 PolarHBondContact O-N 3.13Å
906	D	89.2	Confident	92.8	Very high	46 Å²	46	51.3 Å²	51.3	25%	0.246	26%	0.257	C	S	.	.	H	α-helix	trans	-64.4	-32.8	177.6	-77.2	-7.6	0	0	0	112.8	Y897 K902 R922	Y897-D906 WeakPolarHBondContact OH-CB 3.31Å; Y897-D906 PolarHBondContact OH-OD2 2.81Å; K902-D906 WeakPolarHBondContact CE-OD1 3.11Å; K902-D906 WeakPolarHBondContact CE-OD2 3.3Å; K902-D906 IonicContact NZ-OD1 3.14Å; K902-D906 PolarHBondContact NZ-OD1 3.18Å; K902-D906 IonicContact NZ-OD2 2.74Å; K902-D906 WeakPolarHBondContact O-CB 3.43Å; K902-D906 VanDerWaalsContact O-CG 3.32Å; K902-D906 PolarHBondContact O-N 2.99Å; D906-R922 IonicContact OD2-NH1 2.65Å
907	F	91.3	Very high	92.9	Very high	25 Å²	25	49.9 Å²	49.9	11%	0.11	25%	0.25	C	S	.	.	T	Hydrogen-bonded Turn	trans	-148.3	61.1	-169.8	-57.4	-68.4	0	0	0	113.9	I809 Y897 G903 E904 S905 E909 Y910 K915 A918	I809-F907 HydrophobicContact CG1-CE1 3.82Å; I809-F907 HydrophobicContact CG1-CZ 3.62Å; Y897-F907 HydrophobicContact CE1-CD2 4.48Å; Y897-F907 HydrophobicContact CE1-CE2 4.36Å; Y897-F907 WeakPolarHBondContact OH-CE2 3.25Å; G903-F907 PolarHBondContact O-N 3.18Å; E904-F907 CarbonylContact O-C 3.59Å; E904-F907 PolarHBondContact O-N 3.37Å; S905-F907 VanDerWaalsContact C-N 3.31Å; S905-F907 PolarHBondContact O-N 3.13Å; F907-E909 PolarHBondContact O-N 3.46Å; F907-E909 VanDerWaalsContact O-N 3.11Å; F907-Y910 HydrophobicContact CB-CD2 3.75Å; F907-Y910 HydrophobicContact CB-CG 3.8Å; F907-Y910 AromaticContact CD1-CD2 3.46Å; F907-Y910 HydrophobicContact CD1-CD2 3.46Å; F907-Y910 VanDerWaalsContact CD1-CD2 3.46Å; F907-Y910 AromaticContact CD1-CE2 3.37Å; F907-Y910 HydrophobicContact CD1-CE2 3.37Å; F907-Y910 HydrophobicContact CD1-CG 4.18Å; F907-Y910 HydrophobicContact CD2-CD2 4.42Å; F907-Y910 HydrophobicContact CE1-CD2 4.1Å; F907-Y910 AromaticContact CE1-CE2 3.66Å; F907-Y910 HydrophobicContact CE1-CE2 3.66Å; F907-Y910 AromaticContact CG-CD2 3.65Å; F907-Y910 HydrophobicContact CG-CD2 3.65Å; F907-Y910 HydrophobicContact CG-CE2 4.06Å; F907-Y910 HydrophobicContact CG-CG 4.22Å; F907-Y910 PolarHBondContact O-N 3.18Å; F907-K915 HydrophobicContact CB-CG 4.22Å; F907-K915 HydrophobicContact CD2-CG 4.45Å; F907-K915 WeakPolarHBondContact O-CE 3.24Å; F907-A918 HydrophobicContact CE2-CB 4.16Å; F907-A918 HydrophobicContact CZ-CB 4.34Å
908	K	90.1	Very high	93	Very high	144 Å²	144	49.9 Å²	49.9	63%	0.626	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.3	-37.3	-177.9	-63.1	180	-173.5	176.6	0	114.7	E205 E904	E205-K908 IonicContact OE1-NZ 2.74Å; E205-K908 PolarHBondContact OE1-NZ 2.81Å; E904-K908 WeakPolarHBondContact O-CA 3.41Å; E904-K908 WeakPolarHBondContact O-CG 3.33Å; E904-K908 PolarHBondContact O-N 2.98Å
909	E	92.1	Very high	93	Very high	182 Å²	182	49.9 Å²	49.9	85%	0.85	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.3	-11.8	-177.9	-60.4	-171.2	163.1	0	0	114.5	F907	F907-E909 PolarHBondContact O-N 3.46Å; F907-E909 VanDerWaalsContact O-N 3.11Å
910	Y	94.1	Very high	93.3	Very high	53 Å²	53	44.5 Å²	44.5	21%	0.208	22%	0.221	C	C	.	.	S	Bend	trans	-85.9	133.5	-170.5	-72.9	9.3	0	0	0	111.7	I809 Y812 F907 L914 K915	I809-Y910 HydrophobicContact CG2-CE2 4.49Å; Y812-Y910 HydrophobicContact CE1-CE1 4.11Å; F907-Y910 HydrophobicContact CB-CD2 3.75Å; F907-Y910 HydrophobicContact CB-CG 3.8Å; F907-Y910 AromaticContact CD1-CD2 3.46Å; F907-Y910 HydrophobicContact CD1-CD2 3.46Å; F907-Y910 VanDerWaalsContact CD1-CD2 3.46Å; F907-Y910 AromaticContact CD1-CE2 3.37Å; F907-Y910 HydrophobicContact CD1-CE2 3.37Å; F907-Y910 HydrophobicContact CD1-CG 4.18Å; F907-Y910 HydrophobicContact CD2-CD2 4.42Å; F907-Y910 HydrophobicContact CE1-CD2 4.1Å; F907-Y910 AromaticContact CE1-CE2 3.66Å; F907-Y910 HydrophobicContact CE1-CE2 3.66Å; F907-Y910 AromaticContact CG-CD2 3.65Å; F907-Y910 HydrophobicContact CG-CD2 3.65Å; F907-Y910 HydrophobicContact CG-CE2 4.06Å; F907-Y910 HydrophobicContact CG-CG 4.22Å; F907-Y910 PolarHBondContact O-N 3.18Å; Y910-L914 HydrophobicContact CD1-CD2 3.95Å; Y910-L914 HydrophobicContact CD2-CD2 3.58Å; Y910-L914 HydrophobicContact CD2-CG 3.63Å; Y910-L914 HydrophobicContact CE1-CD2 4.29Å; Y910-L914 HydrophobicContact CE2-CD2 3.93Å; Y910-L914 HydrophobicContact CE2-CG 4.13Å; Y910-L914 HydrophobicContact CG-CD2 3.59Å; Y910-L914 HydrophobicContact CG-CG 4.01Å; Y910-K915 WeakPolarHBondContact O-CE 3.22Å
911	P	94.4	Very high	93.5	Very high	51 Å²	51	44.4 Å²	44.4	33%	0.331	22%	0.221	S	C	.	.			trans	-64.8	152.5	173.5	27.8	-34.2	0	0	0	110.8	F799 L913 L914 K915	F799-P911 HydrophobicContact CD1-CG 4.47Å; F799-P911 HydrophobicContact CE1-CG 3.85Å; F799-P911 HydrophobicContact CE2-CG 4.02Å; F799-P911 HydrophobicContact CZ-CG 3.6Å; P911-L913 VanDerWaalsContact C-N 3.31Å; P911-L913 PolarHBondContact O-N 3.01Å; P911-L913 VanDerWaalsContact O-N 3.13Å; P911-L914 HydrophobicContact CG-CB 3.92Å; P911-L914 WeakPolarHBondContact O-CA 3.39Å; P911-L914 WeakPolarHBondContact O-CB 3.43Å; P911-L914 PolarHBondContact O-N 3.06Å; P911-K915 PolarHBondContact O-N 3.33Å
912	P	94.8	Very high	93.9	Very high	67 Å²	67	40 Å²	40	44%	0.435	20%	0.201	S	C	.	.	H	α-helix	trans	-52.6	-41	-174.1	-30.8	36.2	0	0	0	114.7	A898 L914 K915 Q916	A898-P912 HydrophobicContact CB-CB 4.28Å; A898-P912 WeakPolarHBondContact CB-O 3.35Å; P912-L914 VanDerWaalsContact C-N 3.27Å; P912-L914 PolarHBondContact O-N 3.49Å; P912-K915 WeakPolarHBondContact O-CB 3.34Å; P912-K915 PolarHBondContact O-N 3Å; P912-Q916 WeakPolarHBondContact O-CG 3.45Å; P912-Q916 PolarHBondContact O-N 2.95Å
913	L	95.8	Very high	94.2	Very high	20 Å²	20	39.5 Å²	39.5	11%	0.105	20%	0.199	C	C	.	.	H	α-helix	trans	-62.6	-29.8	175.7	-73.8	178.2	0	0	0	113.7	A789 D791 V796 A797 F799 P911 A917	A789-L913 HydrophobicContact CB-CD2 4.27Å; A789-L913 WeakPolarHBondContact CB-O 3.44Å; D791-L913 HydrophobicContact CB-CD1 4.3Å; V796-L913 HydrophobicContact CG1-CD1 3.49Å; V796-L913 VanDerWaalsContact CG1-CD1 3.49Å; A797-L913 WeakPolarHBondContact O-CD1 3.37Å; F799-L913 HydrophobicContact CD2-CB 3.79Å; F799-L913 HydrophobicContact CD2-CD1 4.46Å; F799-L913 HydrophobicContact CE2-CB 4.5Å; P911-L913 VanDerWaalsContact C-N 3.31Å; P911-L913 PolarHBondContact O-N 3.01Å; P911-L913 VanDerWaalsContact O-N 3.13Å; L913-A917 WeakPolarHBondContact O-CB 3.35Å; L913-A917 PolarHBondContact O-N 3.43Å
914	L	96.7	Very high	94.5	Very high	1 Å²	1	39.9 Å²	39.9	1%	0.005	20%	0.201	C	C	.	.	H	α-helix	trans	-74.3	-38.3	174.8	-179.4	55.9	0	0	0	111.3	F799 A801 Y812 Y910 P911 P912 Q916 A917 A918	F799-L914 HydrophobicContact CB-CB 4.19Å; F799-L914 HydrophobicContact CB-CD1 4.26Å; F799-L914 HydrophobicContact CD1-CB 4.02Å; F799-L914 HydrophobicContact CD1-CD1 4.4Å; F799-L914 HydrophobicContact CD1-CD2 4.47Å; F799-L914 HydrophobicContact CG-CB 4.13Å; A801-L914 HydrophobicContact CB-CD1 3.96Å; Y812-L914 HydrophobicContact CD1-CD2 4.02Å; Y812-L914 HydrophobicContact CD2-CD1 4.37Å; Y812-L914 HydrophobicContact CD2-CD2 3.73Å; Y812-L914 HydrophobicContact CE1-CD2 4.33Å; Y812-L914 HydrophobicContact CE2-CD2 4.06Å; Y812-L914 HydrophobicContact CG-CD1 3.98Å; Y812-L914 HydrophobicContact CG-CD2 3.71Å; Y910-L914 HydrophobicContact CD1-CD2 3.95Å; Y910-L914 HydrophobicContact CD2-CD2 3.58Å; Y910-L914 HydrophobicContact CD2-CG 3.63Å; Y910-L914 HydrophobicContact CE1-CD2 4.29Å; Y910-L914 HydrophobicContact CE2-CD2 3.93Å; Y910-L914 HydrophobicContact CE2-CG 4.13Å; Y910-L914 HydrophobicContact CG-CD2 3.59Å; Y910-L914 HydrophobicContact CG-CG 4.01Å; P911-L914 HydrophobicContact CG-CB 3.92Å; P911-L914 WeakPolarHBondContact O-CA 3.39Å; P911-L914 WeakPolarHBondContact O-CB 3.43Å; P911-L914 PolarHBondContact O-N 3.06Å; P912-L914 VanDerWaalsContact C-N 3.27Å; P912-L914 PolarHBondContact O-N 3.49Å; L914-Q916 VanDerWaalsContact C-N 3.34Å; L914-A917 PolarHBondContact O-N 3.28Å; L914-A918 PolarHBondContact O-N 2.77Å
915	K	96.7	Very high	94.6	Very high	10 Å²	10	35.6 Å²	35.6	4%	0.043	18%	0.181	C	C	.	.	H	α-helix	trans	-62.1	-40.3	170.2	-58.7	178.4	-178.4	-176.5	0	111.7	A898 G903 F907 Y910 P911 P912 A918 S919	A898-K915 HydrophobicContact CB-CB 3.8Å; A898-K915 HydrophobicContact CB-CD 4.47Å; A898-K915 WeakPolarHBondContact O-CD 3.32Å; A898-K915 PolarHBondContact O-NZ 2.8Å; G903-K915 WeakPolarHBondContact O-CD 3.5Å; G903-K915 WeakPolarHBondContact O-CE 3.38Å; G903-K915 PolarHBondContact O-NZ 3.08Å; G903-K915 VanDerWaalsContact O-NZ 3.15Å; F907-K915 HydrophobicContact CB-CG 4.22Å; F907-K915 HydrophobicContact CD2-CG 4.45Å; F907-K915 WeakPolarHBondContact O-CE 3.24Å; Y910-K915 WeakPolarHBondContact O-CE 3.22Å; P911-K915 PolarHBondContact O-N 3.33Å; P912-K915 WeakPolarHBondContact O-CB 3.34Å; P912-K915 PolarHBondContact O-N 3Å; K915-A918 WeakPolarHBondContact O-CB 3.29Å; K915-A918 PolarHBondContact O-N 2.64Å; K915-S919 PolarHBondContact O-N 3.24Å
916	Q	96.9	Very high	94.8	Very high	19 Å²	19	33.7 Å²	33.7	9%	0.089	17%	0.166	C	C	.	.	H	α-helix	trans	-60.2	-45.7	172.2	-68.9	179	29.1	0	0	111.5	A789 A894 A898 P912 L914 A918 S919 L920	A789-Q916 HydrophobicContact CB-CB 3.72Å; A894-Q916 HydrophobicContact CB-CB 4.34Å; A894-Q916 WeakPolarHBondContact O-CG 3.5Å; A898-Q916 HydrophobicContact CB-CG 3.57Å; P912-Q916 WeakPolarHBondContact O-CG 3.45Å; P912-Q916 PolarHBondContact O-N 2.95Å; L914-Q916 VanDerWaalsContact C-N 3.34Å; Q916-A918 VanDerWaalsContact C-N 3.34Å; Q916-A918 PolarHBondContact O-N 3.42Å; Q916-S919 PolarHBondContact O-N 2.74Å; Q916-L920 WeakPolarHBondContact O-CB 3.48Å; Q916-L920 VanDerWaalsContact O-CG 3.25Å; Q916-L920 WeakPolarHBondContact O-CG 3.35Å; Q916-L920 PolarHBondContact O-N 2.93Å
917	A	97.4	Very high	95.1	Very high	0 Å²	0	32 Å²	32	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-62.3	-39.3	177.9	0	0	0	0	0	112.5	A789 A801 L913 L914 A921	A789-A917 HydrophobicContact CB-CB 4.1Å; A801-A917 HydrophobicContact CB-CB 4.23Å; L913-A917 WeakPolarHBondContact O-CB 3.35Å; L913-A917 PolarHBondContact O-N 3.43Å; L914-A917 PolarHBondContact O-N 3.28Å; A917-A921 PolarHBondContact O-N 2.89Å
918	A	96.3	Very high	95.3	Very high	1 Å²	1	30.9 Å²	30.9	1%	0.008	15%	0.152	C	C	.	.	H	α-helix	trans	-61.4	-49.1	172.2	0	0	0	0	0	112	I809 F907 L914 K915 Q916 A921 R922	I809-A918 HydrophobicContact CD1-CB 3.6Å; I809-A918 HydrophobicContact CG1-CB 4.09Å; F907-A918 HydrophobicContact CE2-CB 4.16Å; F907-A918 HydrophobicContact CZ-CB 4.34Å; L914-A918 PolarHBondContact O-N 2.77Å; K915-A918 WeakPolarHBondContact O-CB 3.29Å; K915-A918 PolarHBondContact O-N 2.64Å; Q916-A918 VanDerWaalsContact C-N 3.34Å; Q916-A918 PolarHBondContact O-N 3.42Å; A918-A921 WeakPolarHBondContact O-CB 3.4Å; A918-A921 PolarHBondContact O-N 3.47Å; A918-R922 WeakPolarHBondContact O-CG 3.12Å; A918-R922 PolarHBondContact O-N 3.28Å
919	S	96.5	Very high	95.5	Very high	0 Å²	0	25 Å²	25	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-66.1	-40.6	-179.3	-177.4	0	0	0	0	113	K915 Q916 A921 R922 K923 E930	K915-S919 PolarHBondContact O-N 3.24Å; Q916-S919 PolarHBondContact O-N 2.74Å; S919-A921 VanDerWaalsContact C-N 3.27Å; S919-A921 PolarHBondContact O-N 3.48Å; S919-R922 PolarHBondContact O-N 3.35Å; S919-K923 VanDerWaalsContact O-CB 3.31Å; S919-K923 WeakPolarHBondContact O-CB 3.46Å; S919-K923 PolarHBondContact O-N 2.78Å; S919-E930 WeakPolarHBondContact CA-OE1 3.43Å; S919-E930 WeakPolarHBondContact CB-OE1 3.28Å; S919-E930 PolarHBondContact OG-OE1 2.95Å
920	L	97	Very high	95.7	Very high	0 Å²	0	16.4 Å²	16.4	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-57.1	-39.5	173	-74.3	167.1	0	0	0	112.3	A789 V853 I889 N891 A894 Q916	A789-L920 HydrophobicContact CB-CD1 4.06Å; V853-L920 HydrophobicContact CG1-CB 4.28Å; I889-L920 HydrophobicContact CD1-CD2 3.86Å; I889-L920 HydrophobicContact CG1-CD2 3.69Å; N891-L920 HydrophobicContact CB-CD2 4.01Å; A894-L920 HydrophobicContact CB-CD2 4.15Å; A894-L920 HydrophobicContact CB-CG 3.87Å; Q916-L920 WeakPolarHBondContact O-CB 3.48Å; Q916-L920 VanDerWaalsContact O-CG 3.25Å; Q916-L920 WeakPolarHBondContact O-CG 3.35Å; Q916-L920 PolarHBondContact O-N 2.93Å
921	A	96.9	Very high	95.7	Very high	0 Å²	0	14.1 Å²	14.1	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-68.5	-44.3	176.4	0	0	0	0	0	111.9	V785 T803 A917 A918 S919 M924 Q925	V785-A921 HydrophobicContact CB-CB 4.06Å; V785-A921 HydrophobicContact CG1-CB 3.84Å; T803-A921 HydrophobicContact CG2-CB 3.61Å; A917-A921 PolarHBondContact O-N 2.89Å; A918-A921 WeakPolarHBondContact O-CB 3.4Å; A918-A921 PolarHBondContact O-N 3.47Å; S919-A921 VanDerWaalsContact C-N 3.27Å; S919-A921 PolarHBondContact O-N 3.48Å; A921-M924 PolarHBondContact O-N 3.04Å; A921-Q925 PolarHBondContact O-N 2.81Å
922	R	95.7	Very high	95.8	Very high	11 Å²	11	11.7 Å²	11.7	4%	0.042	6%	0.063	C	C	.	.	H	α-helix	trans	-68.2	-38.7	179	-68.4	172.7	167.6	174.1	-0.5	113.2	T803 G807 Y897 D906 A918 S919 M924 Q925 D926 E930 R985	T803-R922 HydrophobicContact CG2-CG 4.2Å; G807-R922 PolarHBondContact O-NE 2.82Å; Y897-R922 PolarHBondContact OH-NH1 3.13Å; D906-R922 IonicContact OD2-NH1 2.65Å; A918-R922 WeakPolarHBondContact O-CG 3.12Å; A918-R922 PolarHBondContact O-N 3.28Å; S919-R922 PolarHBondContact O-N 3.35Å; R922-M924 PolarHBondContact O-N 2.74Å; R922-M924 VanDerWaalsContact O-N 3.15Å; R922-Q925 WeakPolarHBondContact O-CA 3.13Å; R922-Q925 WeakPolarHBondContact O-CB 3.5Å; R922-Q925 PolarHBondContact O-N 3.21Å; R922-D926 PolarHBondContact O-N 3.36Å; R922-E930 VanDerWaalsContact CB-CD 3.49Å; R922-E930 HydrophobicContact CB-CG 4.28Å; R922-E930 WeakPolarHBondContact CB-OE2 3.39Å; R922-E930 WeakPolarHBondContact CD-OE2 3.31Å; R922-R985 VanDerWaalsContact CZ-CD 3.44Å
923	K	95.7	Very high	95.7	Very high	21 Å²	21	8.5 Å²	8.5	9%	0.091	4%	0.042	C	C	.	.	H	α-helix	trans	-55	-29.5	171.8	-171.5	178	-176.2	175.7	0	112.4	I889 D890 L893 S919 P927 E930	I889-K923 HydrophobicContact CD1-CD 4.13Å; D890-K923 PolarHBondContact O-NZ 3.03Å; D890-K923 IonicContact OD2-NZ 3.19Å; D890-K923 PolarHBondContact OD2-NZ 2.73Å; L893-K923 HydrophobicContact CD2-CD 3.97Å; L893-K923 HydrophobicContact CD2-CG 4.15Å; S919-K923 VanDerWaalsContact O-CB 3.31Å; S919-K923 WeakPolarHBondContact O-CB 3.46Å; S919-K923 PolarHBondContact O-N 2.78Å; K923-P927 WeakPolarHBondContact O-CG 3.45Å; K923-E930 HydrophobicContact CB-CB 4.37Å; K923-E930 HydrophobicContact CB-CG 4.12Å
924	M	95.4	Very high	95.6	Very high	7 Å²	7	7.5 Å²	7.5	3%	0.034	4%	0.037	C	C	.	.	H	α-helix	trans	-85.3	-22.1	175.8	-168.7	78.6	-69	0	0	113.4	Y764 V785 I851 V853 A921 R922 Y1143	Y764-M924 HydrophobicContact CG-CG 4.47Å; Y764-M924 HydrophobicContact CG-SD 4.29Å; Y764-M924 PolarHBondContact N-O 2.64Å; V785-M924 HydrophobicContact CG1-CB 4.28Å; I851-M924 HydrophobicContact CD1-CG 4.21Å; I851-M924 HydrophobicContact CD1-SD 3.87Å; I851-M924 HydrophobicContact CG2-CG 4.23Å; V853-M924 HydrophobicContact CG2-CB 4.04Å; V853-M924 HydrophobicContact CG2-CG 3.89Å; V853-M924 HydrophobicContact CG2-SD 4.32Å; A921-M924 PolarHBondContact O-N 3.04Å; R922-M924 PolarHBondContact O-N 2.74Å; R922-M924 VanDerWaalsContact O-N 3.15Å; M924-Y1143 HydrophobicContact CE-CD1 4.31Å; M924-Y1143 HydrophobicContact CE-CD2 3.54Å; M924-Y1143 HydrophobicContact CE-CE2 3.8Å; M924-Y1143 HydrophobicContact CE-CG 3.8Å; M924-Y1143 HydrophobicContact SD-CE2 4.44Å
925	Q	94	Very high	95.3	Very high	21 Å²	21	7.9 Å²	7.9	10%	0.098	4%	0.04	C	C	.	.	H	α-helix	trans	-74.8	-53.1	172.4	-65.8	-178.8	-42.3	0	0	111.2	P763 I783 V785 T803 T804 A921 R922	P763-Q925 VanDerWaalsContact CA-O 3.28Å; P763-Q925 WeakPolarHBondContact CA-O 3.43Å; P763-Q925 WeakPolarHBondContact CB-O 3.35Å; P763-Q925 VanDerWaalsContact CG-O 3.29Å; P763-Q925 WeakPolarHBondContact CG-O 3.5Å; I783-Q925 HydrophobicContact CG1-CG 4.45Å; I783-Q925 PolarHBondContact O-NE2 3.33Å; V785-Q925 HydrophobicContact CG2-CG 3.84Å; T803-Q925 PolarHBondContact OG1-NE2 3.05Å; T804-Q925 PolarHBondContact O-NE2 3.09Å; A921-Q925 PolarHBondContact O-N 2.81Å; R922-Q925 WeakPolarHBondContact O-CA 3.13Å; R922-Q925 WeakPolarHBondContact O-CB 3.5Å; R922-Q925 PolarHBondContact O-N 3.21Å
926	D	94.1	Very high	94.6	Very high	29 Å²	29	9.2 Å²	9.2	16%	0.155	5%	0.048	C	C	.	.			trans	-153.2	115.7	167.9	-163.6	-50.6	0	0	0	111.4	P763 R922 L928 V929 E930 R1140	P763-D926 HydrophobicContact CG-CB 4.2Å; P763-D926 WeakPolarHBondContact CG-OD2 3.38Å; R922-D926 PolarHBondContact O-N 3.36Å; D926-L928 VanDerWaalsContact C-N 3.35Å; D926-L928 PolarHBondContact O-N 3.31Å; D926-L928 WeakPolarHBondContact OD1-CB 3.25Å; D926-L928 PolarHBondContact OD1-N 3.38Å; D926-V929 HydrophobicContact CB-CB 4.26Å; D926-V929 HydrophobicContact CB-CG2 3.96Å; D926-V929 PolarHBondContact O-N 3.11Å; D926-E930 PolarHBondContact O-N 2.89Å; D926-R1140 VanDerWaalsContact CG-NH1 3.32Å; D926-R1140 IonicContact OD1-CZ 2.73Å; D926-R1140 IonicContact OD1-NH1 3.45Å; D926-R1140 PolarHBondContact OD1-NH1 2.97Å; D926-R1140 IonicContact OD1-NH2 2.8Å; D926-R1140 IonicContact OD2-CZ 2.62Å; D926-R1140 IonicContact OD2-NH1 3.43Å; D926-R1140 PolarHBondContact OD2-NH1 3.18Å; D926-R1140 VanDerWaalsContact OD2-NH1 3.11Å; D926-R1140 IonicContact OD2-NH2 3.19Å; D926-R1140 PolarHBondContact OD2-NH2 3.42Å
927	P	95	Very high	93.8	Very high	9 Å²	9	11.5 Å²	11.5	6%	0.058	7%	0.07	C	C	.	.	H	α-helix	trans	-59	-39.1	176.3	-25.4	34.4	0	0	0	114.1	V761 K923 V929 E930 Y931	V761-P927 HydrophobicContact CB-CG 4.1Å; V761-P927 HydrophobicContact CG1-CG 4.12Å; K923-P927 WeakPolarHBondContact O-CG 3.45Å; P927-V929 PolarHBondContact O-N 3.02Å; P927-E930 PolarHBondContact O-N 3.07Å; P927-Y931 HydrophobicContact CB-CD2 4.36Å; P927-Y931 WeakPolarHBondContact O-CB 3.07Å; P927-Y931 VanDerWaalsContact O-CD2 3.23Å; P927-Y931 WeakPolarHBondContact O-CD2 3.39Å; P927-Y931 PolarHBondContact O-N 3.39Å
928	L	95.5	Very high	93.2	Very high	3 Å²	3	14.2 Å²	14.2	2%	0.016	8%	0.084	C	C	.	.	H	α-helix	trans	-64.2	-42.8	-176	174.2	61.5	0	0	0	111.2	L759 D926 S932 F966 R969 V973 L989	L759-L928 HydrophobicContact CB-CD1 4.41Å; L759-L928 HydrophobicContact CD1-CD1 4.19Å; L759-L928 HydrophobicContact CD2-CD1 3.94Å; L759-L928 HydrophobicContact CG-CD1 4.4Å; D926-L928 VanDerWaalsContact C-N 3.35Å; D926-L928 PolarHBondContact O-N 3.31Å; D926-L928 WeakPolarHBondContact OD1-CB 3.25Å; D926-L928 PolarHBondContact OD1-N 3.38Å; L928-S932 PolarHBondContact O-N 2.86Å; L928-S932 PolarHBondContact O-OG 2.86Å; L928-F966 HydrophobicContact CD1-CD1 3.91Å; L928-F966 HydrophobicContact CD1-CE1 4.22Å; L928-R969 HydrophobicContact CD1-CB 4.21Å; L928-R969 HydrophobicContact CD2-CB 4.37Å; L928-V973 HydrophobicContact CD2-CB 4.31Å; L928-V973 HydrophobicContact CD2-CG2 3.92Å; L928-L989 HydrophobicContact CD1-CD2 4.07Å; L928-L989 HydrophobicContact CG-CD1 4.24Å; L928-L989 HydrophobicContact CG-CD2 4.09Å
929	V	94.6	Very high	92.8	Very high	19 Å²	19	15.7 Å²	15.7	12%	0.115	9%	0.092	C	C	.	.	H	α-helix	trans	-67.2	-41.7	176.7	-177.4	0	0	0	0	111	D926 P927 S932 Q933 T986 L989	D926-V929 HydrophobicContact CB-CB 4.26Å; D926-V929 HydrophobicContact CB-CG2 3.96Å; D926-V929 PolarHBondContact O-N 3.11Å; P927-V929 PolarHBondContact O-N 3.02Å; V929-S932 PolarHBondContact O-N 2.72Å; V929-S932 PolarHBondContact O-OG 2.6Å; V929-Q933 PolarHBondContact O-NE2 2.93Å; V929-T986 HydrophobicContact CG1-CG2 4.02Å; V929-T986 HydrophobicContact CG2-CG2 4.32Å; V929-L989 HydrophobicContact CG2-CD1 3.94Å
930	E	95.3	Very high	92.5	Very high	2 Å²	2	16.8 Å²	16.8	1%	0.009	10%	0.097	C	C	.	.	H	α-helix	trans	-72.9	-40	-177.4	-164.2	66.4	-177.1	0	0	112.4	L893 S919 R922 K923 D926 P927 S932 Q933	L893-E930 HydrophobicContact CD2-CB 4.18Å; L893-E930 HydrophobicContact CD2-CG 3.82Å; S919-E930 WeakPolarHBondContact CA-OE1 3.43Å; S919-E930 WeakPolarHBondContact CB-OE1 3.28Å; S919-E930 PolarHBondContact OG-OE1 2.95Å; R922-E930 VanDerWaalsContact CB-CD 3.49Å; R922-E930 HydrophobicContact CB-CG 4.28Å; R922-E930 WeakPolarHBondContact CB-OE2 3.39Å; R922-E930 WeakPolarHBondContact CD-OE2 3.31Å; K923-E930 HydrophobicContact CB-CB 4.37Å; K923-E930 HydrophobicContact CB-CG 4.12Å; D926-E930 PolarHBondContact O-N 2.89Å; P927-E930 PolarHBondContact O-N 3.07Å; E930-S932 VanDerWaalsContact C-N 3.26Å; E930-S932 PolarHBondContact O-N 2.98Å; E930-Q933 WeakPolarHBondContact O-CB 3.22Å; E930-Q933 WeakPolarHBondContact O-CG 3.44Å; E930-Q933 PolarHBondContact O-N 2.78Å; E930-Q933 VanDerWaalsContact O-N 3.13Å
931	Y	95.8	Very high	92.4	Very high	5 Å²	5	17 Å²	17	2%	0.02	10%	0.098	C	C	.	.	H	α-helix	trans	-63.1	-31.9	173.1	-84.6	-75.3	0	0	0	112.1	W758 L759 L893 P927 Q933 L934 L944	W758-Y931 HydrophobicContact CB-CD2 4.29Å; W758-Y931 HydrophobicContact CB-CE2 3.69Å; W758-Y931 HydrophobicContact CD2-CE1 4.1Å; W758-Y931 HydrophobicContact CD2-CE2 4.47Å; W758-Y931 AromaticContact CD2-CZ 3.75Å; W758-Y931 HydrophobicContact CE3-CD1 4.35Å; W758-Y931 AromaticContact CE3-CE1 3.53Å; W758-Y931 HydrophobicContact CE3-CE1 3.53Å; W758-Y931 AromaticContact CE3-CZ 3.69Å; W758-Y931 HydrophobicContact CG-CE2 4.17Å; W758-Y931 AromaticContact CG-CZ 3.89Å; W758-Y931 AromaticContact CZ3-CE1 3.88Å; W758-Y931 HydrophobicContact CZ3-CE1 3.88Å; L759-Y931 HydrophobicContact CD2-CD2 4.13Å; L759-Y931 HydrophobicContact CD2-CG 4.13Å; L893-Y931 HydrophobicContact CB-CE1 4.11Å; L893-Y931 HydrophobicContact CD1-CD1 3.85Å; L893-Y931 HydrophobicContact CD1-CE1 4.12Å; L893-Y931 HydrophobicContact CD1-CG 4.44Å; L893-Y931 HydrophobicContact CD2-CD1 3.84Å; L893-Y931 HydrophobicContact CD2-CD2 3.92Å; L893-Y931 HydrophobicContact CD2-CE1 3.85Å; L893-Y931 HydrophobicContact CD2-CE2 3.9Å; L893-Y931 HydrophobicContact CD2-CG 3.86Å; L893-Y931 HydrophobicContact CG-CD1 4.33Å; L893-Y931 HydrophobicContact CG-CE1 4.25Å; P927-Y931 HydrophobicContact CB-CD2 4.36Å; P927-Y931 WeakPolarHBondContact O-CB 3.07Å; P927-Y931 VanDerWaalsContact O-CD2 3.23Å; P927-Y931 WeakPolarHBondContact O-CD2 3.39Å; P927-Y931 PolarHBondContact O-N 3.39Å; Y931-Q933 PolarHBondContact O-N 3.4Å; Y931-L934 PolarHBondContact O-N 3.05Å; Y931-L944 HydrophobicContact CD1-CD1 3.76Å; Y931-L944 HydrophobicContact CE1-CD1 3.72Å; Y931-L944 HydrophobicContact CE1-CD2 4.32Å
932	S	94.7	Very high	92.2	Very high	0 Å²	0	18.3 Å²	18.3	0%	0	11%	0.105	C	C	.	.	G	3₁₀ helix	trans	-72.2	-7.4	175.7	69.7	0	0	0	0	114.8	L928 V929 E930 L934 C935 N988 L989	L928-S932 PolarHBondContact O-N 2.86Å; L928-S932 PolarHBondContact O-OG 2.86Å; V929-S932 PolarHBondContact O-N 2.72Å; V929-S932 PolarHBondContact O-OG 2.6Å; E930-S932 VanDerWaalsContact C-N 3.26Å; E930-S932 PolarHBondContact O-N 2.98Å; S932-L934 PolarHBondContact O-N 3Å; S932-C935 WeakPolarHBondContact O-CB 3.49Å; S932-C935 PolarHBondContact O-N 3.16Å; S932-N988 VanDerWaalsContact O-CB 3.25Å; S932-N988 WeakPolarHBondContact O-CB 3.46Å; S932-N988 PolarHBondContact O-ND2 2.78Å; S932-L989 VanDerWaalsContact CB-CD2 3.45Å; S932-L989 WeakPolarHBondContact OG-CD2 3.29Å; S932-L989 WeakPolarHBondContact OG-CG 3.24Å
933	Q	93.4	Very high	92.1	Very high	0 Å²	0	22 Å²	22	0%	0	13%	0.131	C	C	.	.	G	3₁₀ helix	trans	-68.8	-18.4	173.9	-57.1	-47	-74.4	0	0	112.7	Y897 K902 V929 E930 Y931 R985	Y897-Q933 HydrophobicContact CD2-CB 3.85Å; Y897-Q933 HydrophobicContact CD2-CG 4.44Å; Y897-Q933 HydrophobicContact CE2-CB 4.03Å; Y897-Q933 HydrophobicContact CE2-CG 4.29Å; K902-Q933 HydrophobicContact CG-CB 4.36Å; V929-Q933 PolarHBondContact O-NE2 2.93Å; E930-Q933 WeakPolarHBondContact O-CB 3.22Å; E930-Q933 WeakPolarHBondContact O-CG 3.44Å; E930-Q933 PolarHBondContact O-N 2.78Å; E930-Q933 VanDerWaalsContact O-N 3.13Å; Y931-Q933 PolarHBondContact O-N 3.4Å; Q933-R985 PolarHBondContact NE2-O 3.38Å
934	L	94	Very high	92	Very high	0 Å²	0	21 Å²	21	0%	0	13%	0.127	C	C	.	.	G	3₁₀ helix	trans	-93.2	2.3	174.1	-55	-172.9	0	0	0	113.4	L893 I896 Y931 S932 D936 E940 I941 L944	L893-L934 HydrophobicContact CD1-CD1 3.58Å; L893-L934 HydrophobicContact CD1-CG 3.92Å; I896-L934 HydrophobicContact CB-CD1 4.08Å; I896-L934 HydrophobicContact CB-CD2 4.44Å; I896-L934 HydrophobicContact CD1-CD1 4.45Å; I896-L934 HydrophobicContact CG2-CD1 3.72Å; I896-L934 HydrophobicContact CG2-CD2 3.81Å; I896-L934 HydrophobicContact CG2-CG 4.42Å; Y931-L934 PolarHBondContact O-N 3.05Å; S932-L934 PolarHBondContact O-N 3Å; L934-D936 VanDerWaalsContact C-N 3.32Å; L934-D936 PolarHBondContact O-N 3.39Å; L934-E940 HydrophobicContact CB-CB 4.12Å; L934-E940 HydrophobicContact CD2-CB 4.28Å; L934-I941 HydrophobicContact CB-CB 4.15Å; L934-I941 HydrophobicContact CB-CD1 4.17Å; L934-I941 WeakPolarHBondContact O-CB 3.41Å; L934-I941 PolarHBondContact O-N 3.41Å; L934-L944 HydrophobicContact CD1-CD1 3.99Å; L934-L944 HydrophobicContact CD1-CG 4.23Å
935	C	90.7	Very high	91.8	Very high	8 Å²	8	25.3 Å²	25.3	5%	0.054	14%	0.143	C	C	.	.			trans	-92.3	63.8	179.5	-65	0	0	0	0	110.5	S932 F966 Q991 Y992	S932-C935 WeakPolarHBondContact O-CB 3.49Å; S932-C935 PolarHBondContact O-N 3.16Å; C935-F966 VanDerWaalsContact SG-CZ 3.57Å; C935-Q991 PolarHBondContact O-NE2 2.91Å; C935-Y992 HydrophobicContact CB-CE2 4.02Å; C935-Y992 WeakPolarHBondContact CB-OH 3.34Å; C935-Y992 PolarHBondContact SG-OH 3.24Å
936	D	81.9	Confident	91.7	Very high	39 Å²	39	24.7 Å²	24.7	21%	0.209	14%	0.14	C	C	.	.	S	Bend	trans	-107.5	-173.4	179	75.9	-7.2	0	0	0	112.4	L934 D938 D939	L934-D936 VanDerWaalsContact C-N 3.32Å; L934-D936 PolarHBondContact O-N 3.39Å; D936-D938 PolarHBondContact O-N 3.31Å; D936-D938 PolarHBondContact OD1-N 3.24Å; D936-D939 PolarHBondContact O-N 3.21Å; D936-D939 PolarHBondContact OD1-N 3.3Å
937	A	80.7	Confident	91.5	Very high	67 Å²	67	24.7 Å²	24.7	55%	0.554	14%	0.139	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.5	7.2	-178.3	0	0	0	0	0	114.3
938	D	83.6	Confident	91.3	Very high	56 Å²	56	28.5 Å²	28.5	30%	0.299	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	-116.8	1.5	176.4	-63	-78.8	0	0	0	111.9	R274 K901 D936 E940	R274-D938 IonicContact CZ-OD1 2.66Å; R274-D938 IonicContact NE-OD1 2.66Å; R274-D938 VanDerWaalsContact NH2-CG 3.3Å; R274-D938 IonicContact NH2-OD1 2.79Å; R274-D938 PolarHBondContact NH2-OD1 3.35Å; R274-D938 IonicContact NH2-OD2 3.71Å; R274-D938 PolarHBondContact NH2-OD2 3.26Å; K901-D938 WeakPolarHBondContact CD-OD2 3.46Å; K901-D938 WeakPolarHBondContact CE-OD2 3.48Å; K901-D938 IonicContact NZ-OD1 2.58Å; K901-D938 PolarHBondContact NZ-OD1 2.94Å; K901-D938 IonicContact NZ-OD2 2.67Å; K901-D938 PolarHBondContact NZ-OD2 2.87Å; D936-D938 PolarHBondContact O-N 3.31Å; D936-D938 PolarHBondContact OD1-N 3.24Å; D938-E940 PolarHBondContact O-N 3.34Å
939	D	87.4	Confident	91.1	Very high	33 Å²	33	29.1 Å²	29.1	18%	0.176	17%	0.167	C	C	.	.			trans	55.6	39.8	177.3	-51.4	-63.1	0	0	0	114.9	D936 I941 L942 R955 L959	D936-D939 PolarHBondContact O-N 3.21Å; D936-D939 PolarHBondContact OD1-N 3.3Å; D939-I941 PolarHBondContact O-N 2.84Å; D939-L942 HydrophobicContact CB-CD1 3.75Å; D939-L942 HydrophobicContact CB-CG 4.08Å; D939-L942 WeakPolarHBondContact O-CB 3.09Å; D939-L942 WeakPolarHBondContact O-CG 3.34Å; D939-L942 PolarHBondContact O-N 3.49Å; D939-R955 IonicContact OD2-CZ 3.5Å; D939-R955 IonicContact OD2-NH1 2.7Å; D939-R955 PolarHBondContact OD2-NH1 3.48Å; D939-R955 IonicContact OD2-NH2 2.76Å; D939-R955 PolarHBondContact OD2-NH2 3.41Å; D939-L959 HydrophobicContact CB-CD1 4.29Å; D939-L959 WeakPolarHBondContact OD1-CD1 3.37Å; D939-L959 WeakPolarHBondContact OD1-CD2 3.37Å
940	E	91.6	Very high	91.1	Very high	23 Å²	23	29 Å²	29	11%	0.107	17%	0.165	C	C	.	.	G	3₁₀ helix	trans	-53.7	-23.3	178.3	-62.1	178.9	153.3	0	0	113.5	S900 K901 L934 D938 L942 C943	S900-E940 WeakPolarHBondContact CA-OE1 3.36Å; S900-E940 WeakPolarHBondContact CB-OE1 3.48Å; S900-E940 WeakPolarHBondContact CB-OE2 3.48Å; K901-E940 PolarHBondContact N-OE1 3.26Å; L934-E940 HydrophobicContact CB-CB 4.12Å; L934-E940 HydrophobicContact CD2-CB 4.28Å; D938-E940 PolarHBondContact O-N 3.34Å; E940-L942 PolarHBondContact O-N 2.81Å; E940-L942 VanDerWaalsContact O-N 3.12Å; E940-C943 VanDerWaalsContact O-CB 3.27Å; E940-C943 WeakPolarHBondContact O-CB 3.22Å; E940-C943 PolarHBondContact O-N 3.49Å
941	I	93.8	Very high	90.9	Very high	3 Å²	3	35.6 Å²	35.6	2%	0.015	20%	0.196	C	C	.	.	G	3₁₀ helix	trans	-54.3	-24.2	172.6	-166.6	65.9	0	0	0	113.5	L934 D939 L944 Y946 L959 F966	L934-I941 HydrophobicContact CB-CB 4.15Å; L934-I941 HydrophobicContact CB-CD1 4.17Å; L934-I941 WeakPolarHBondContact O-CB 3.41Å; L934-I941 PolarHBondContact O-N 3.41Å; D939-I941 PolarHBondContact O-N 2.84Å; I941-L944 HydrophobicContact CD1-CD1 4Å; I941-Y946 VanDerWaalsContact O-CE2 3.32Å; I941-Y946 WeakPolarHBondContact O-CE2 3.48Å; I941-Y946 PolarHBondContact O-OH 3.37Å; I941-L959 HydrophobicContact CG2-CD1 4.02Å; I941-F966 HydrophobicContact CD1-CE2 3.93Å; I941-F966 HydrophobicContact CD1-CZ 3.88Å; I941-F966 HydrophobicContact CG1-CE2 4.12Å
942	L	93.3	Very high	90.8	Very high	29 Å²	29	39.3 Å²	39.3	15%	0.152	21%	0.21	C	C	.	.	G	3₁₀ helix	trans	-77.4	-18.1	177.6	-60.9	177.3	0	0	0	113.3	D939 E940 L944 Q950 R955 L958 L962	D939-L942 HydrophobicContact CB-CD1 3.75Å; D939-L942 HydrophobicContact CB-CG 4.08Å; D939-L942 WeakPolarHBondContact O-CB 3.09Å; D939-L942 WeakPolarHBondContact O-CG 3.34Å; D939-L942 PolarHBondContact O-N 3.49Å; E940-L942 PolarHBondContact O-N 2.81Å; E940-L942 VanDerWaalsContact O-N 3.12Å; L942-L944 PolarHBondContact O-N 2.94Å; L942-Q950 PolarHBondContact O-NE2 3.18Å; L942-Q950 VanDerWaalsContact O-NE2 3.08Å; L942-R955 HydrophobicContact CD1-CG 3.77Å; L942-L958 HydrophobicContact CD2-CD2 4.03Å; L942-L958 HydrophobicContact CD2-CG 4.04Å; L942-L962 HydrophobicContact CD2-CD1 3.96Å
943	C	93.3	Very high	90.7	Very high	88 Å²	88	39.8 Å²	39.8	60%	0.595	21%	0.213	S	C	*	.	G	3₁₀ helix	trans	-72.7	-13	177.2	-63.6	0	0	0	0	113.4	I896 E940	I896-C943 HydrophobicContact CD1-CB 4.04Å; I896-C943 HydrophobicContact CG1-CB 4.41Å; I896-C943 HydrophobicContact CG2-CB 4.14Å; E940-C943 VanDerWaalsContact O-CB 3.27Å; E940-C943 WeakPolarHBondContact O-CB 3.22Å; E940-C943 PolarHBondContact O-N 3.49Å
944	L	93.3	Very high	90.7	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	22%	0.224	C	C	.	.	S	Bend	trans	-71.8	135.1	171	-76.8	163.6	0	0	0	110.7	W758 E892 L893 I896 Y931 L934 I941 L942 Y946 Q950	W758-L944 HydrophobicContact CH2-CD2 4.31Å; W758-L944 HydrophobicContact CZ3-CB 4.32Å; W758-L944 HydrophobicContact CZ3-CD1 4.16Å; W758-L944 HydrophobicContact CZ3-CD2 4.3Å; E892-L944 HydrophobicContact CB-CD2 4.49Å; E892-L944 HydrophobicContact CG-CD2 3.99Å; L893-L944 HydrophobicContact CB-CD2 4.47Å; I896-L944 HydrophobicContact CD1-CB 4.39Å; I896-L944 HydrophobicContact CD1-CD2 3.66Å; I896-L944 HydrophobicContact CD1-CG 3.69Å; Y931-L944 HydrophobicContact CD1-CD1 3.76Å; Y931-L944 HydrophobicContact CE1-CD1 3.72Å; Y931-L944 HydrophobicContact CE1-CD2 4.32Å; L934-L944 HydrophobicContact CD1-CD1 3.99Å; L934-L944 HydrophobicContact CD1-CG 4.23Å; I941-L944 HydrophobicContact CD1-CD1 4Å; L942-L944 PolarHBondContact O-N 2.94Å; L944-Y946 HydrophobicContact CB-CD2 4.44Å; L944-Y946 HydrophobicContact CB-CE1 4.32Å; L944-Y946 HydrophobicContact CB-CE2 3.76Å; L944-Y946 WeakPolarHBondContact CD1-OH 3.18Å; L944-Y946 WeakPolarHBondContact O-CD2 3.42Å; L944-Y946 WeakPolarHBondContact O-CE2 3.24Å; L944-Y946 PolarHBondContact O-N 2.93Å; L944-Q950 PolarHBondContact O-NE2 3.48Å; L944-Q950 PolarHBondContact O-OE1 2.86Å
945	R	91.3	Very high	90.7	Very high	97 Å²	97	47.7 Å²	47.7	37%	0.366	25%	0.247	S	C	.	.			trans	-84.1	79.5	-177	-169.1	45.3	153.8	-166.5	-15	111.6	K754 E892 H947 P948 E951	K754-R945 PolarHBondContact NZ-O 3.43Å; E892-R945 WeakPolarHBondContact OE1-CB 3.31Å; E892-R945 PolarHBondContact OE1-N 3.21Å; R945-H947 PolarHBondContact NH1-O 3Å; R945-P948 PolarHBondContact NH2-O 2.68Å; R945-E951 IonicContact CZ-OE1 3.52Å; R945-E951 IonicContact NH1-OE1 3.12Å; R945-E951 PolarHBondContact NH1-OE1 3.36Å; R945-E951 IonicContact NH2-OE1 2.63Å; R945-E951 PolarHBondContact NH2-OE1 2.79Å
946	Y	92.1	Very high	90.7	Very high	9 Å²	9	55.1 Å²	55.1	4%	0.035	28%	0.281	C	S	.	.			trans	-64.9	-52.5	175.2	-56.7	-78.9	0	0	0	112.7	C751 K754 L755 W758 I941 L944 L962	C751-Y946 HydrophobicContact CB-CG 4.32Å; K754-Y946 WeakPolarHBondContact CD-O 3.42Å; L755-Y946 HydrophobicContact CB-CD1 4.35Å; L755-Y946 HydrophobicContact CB-CE1 3.94Å; L755-Y946 HydrophobicContact CD1-CE1 4.23Å; W758-Y946 HydrophobicContact CE3-CE1 4.11Å; W758-Y946 HydrophobicContact CH2-CE1 4.48Å; W758-Y946 AromaticContact CZ3-CD1 3.92Å; W758-Y946 HydrophobicContact CZ3-CD1 3.92Å; W758-Y946 AromaticContact CZ3-CE1 3.54Å; W758-Y946 HydrophobicContact CZ3-CE1 3.54Å; I941-Y946 VanDerWaalsContact O-CE2 3.32Å; I941-Y946 WeakPolarHBondContact O-CE2 3.48Å; I941-Y946 PolarHBondContact O-OH 3.37Å; L944-Y946 HydrophobicContact CB-CD2 4.44Å; L944-Y946 HydrophobicContact CB-CE1 4.32Å; L944-Y946 HydrophobicContact CB-CE2 3.76Å; L944-Y946 WeakPolarHBondContact CD1-OH 3.18Å; L944-Y946 WeakPolarHBondContact O-CD2 3.42Å; L944-Y946 WeakPolarHBondContact O-CE2 3.24Å; L944-Y946 PolarHBondContact O-N 2.93Å; Y946-L962 HydrophobicContact CD1-CD2 4.23Å; Y946-L962 HydrophobicContact CD2-CD1 4.29Å; Y946-L962 HydrophobicContact CE1-CD2 3.98Å; Y946-L962 HydrophobicContact CE2-CD1 3.72Å; Y946-L962 HydrophobicContact CE2-CD2 4.32Å
947	H	90.7	Very high	91.2	Very high	28 Å²	28	55.6 Å²	55.6	13%	0.13	28%	0.282	C	S	.	.			trans	-142.6	145	-175.8	-170.9	-105.7	0	0	0	110.9	D656 V747 C751 R945 L949 Q950	D656-H947 IonicContact OD2-CE1 3.78Å; D656-H947 IonicContact OD2-NE2 3.52Å; V747-H947 HydrophobicContact CG1-CB 4.28Å; C751-H947 VanDerWaalsContact SG-CB 3.54Å; R945-H947 PolarHBondContact NH1-O 3Å; H947-L949 PolarHBondContact ND1-N 2.84Å; H947-L949 PolarHBondContact O-N 2.77Å; H947-Q950 HydrophobicContact CB-CB 4.39Å; H947-Q950 VanDerWaalsContact N-OE1 3.08Å; H947-Q950 PolarHBondContact O-N 3.46Å; H947-Q950 VanDerWaalsContact O-N 3.08Å; H947-Q950 PolarHBondContact O-OE1 2.9Å
948	P	89.8	Confident	91.9	Very high	89 Å²	89	52.8 Å²	52.8	58%	0.578	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.3	-18.5	178.8	-27.9	36.9	0	0	0	115.7	R945	R945-P948 PolarHBondContact NH2-O 2.68Å
949	L	92.6	Very high	92.3	Very high	17 Å²	17	51.8 Å²	51.8	9%	0.089	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-117	20.3	178.9	-53.8	-178.5	0	0	0	113.6	D656 I659 K660 M663 V747 H947 E951 R952	D656-L949 HydrophobicContact CB-CD1 4Å; I659-L949 HydrophobicContact CB-CD1 4.35Å; I659-L949 HydrophobicContact CG2-CD1 3.95Å; K660-L949 HydrophobicContact CG-CD1 3.97Å; M663-L949 HydrophobicContact CE-CD2 4.23Å; M663-L949 HydrophobicContact SD-CD2 3.68Å; V747-L949 HydrophobicContact CG2-CB 4.38Å; H947-L949 PolarHBondContact ND1-N 2.84Å; H947-L949 PolarHBondContact O-N 2.77Å; L949-E951 PolarHBondContact O-N 2.9Å; L949-R952 PolarHBondContact O-N 3.48Å
950	Q	93	Very high	92.6	Very high	15 Å²	15	54.3 Å²	54.3	7%	0.07	26%	0.263	C	S	.	.	G	3₁₀ helix	trans	-61.6	-25.9	-178	82.4	-162.1	51.7	0	0	113.1	L942 L944 H947 R952 V953 L958	L942-Q950 PolarHBondContact O-NE2 3.18Å; L942-Q950 VanDerWaalsContact O-NE2 3.08Å; L944-Q950 PolarHBondContact O-NE2 3.48Å; L944-Q950 PolarHBondContact O-OE1 2.86Å; H947-Q950 HydrophobicContact CB-CB 4.39Å; H947-Q950 VanDerWaalsContact N-OE1 3.08Å; H947-Q950 PolarHBondContact O-N 3.46Å; H947-Q950 VanDerWaalsContact O-N 3.08Å; H947-Q950 PolarHBondContact O-OE1 2.9Å; Q950-R952 PolarHBondContact O-N 2.96Å; Q950-V953 PolarHBondContact O-N 2.91Å; Q950-L958 HydrophobicContact CB-CD2 4.13Å; Q950-L958 HydrophobicContact CG-CD2 4.36Å
951	E	91.9	Very high	92.6	Very high	141 Å²	141	55.5 Å²	55.5	66%	0.659	27%	0.268	S	S	*	.	G	3₁₀ helix	trans	-71.5	-10.4	174.6	-65.8	145.2	-109.5	0	0	113.6	R945 L949 V953	R945-E951 IonicContact CZ-OE1 3.52Å; R945-E951 IonicContact NH1-OE1 3.12Å; R945-E951 PolarHBondContact NH1-OE1 3.36Å; R945-E951 IonicContact NH2-OE1 2.63Å; R945-E951 PolarHBondContact NH2-OE1 2.79Å; L949-E951 PolarHBondContact O-N 2.9Å; E951-V953 VanDerWaalsContact C-N 3.34Å
952	R	92.6	Very high	92.7	Very high	83 Å²	83	55.4 Å²	55.4	31%	0.313	27%	0.268	S	S	.	.	G	3₁₀ helix	trans	-98.8	22	176.6	-58.3	-48.5	-159.5	112.9	-4	112.6	I659 M663 E666 Q744 L949 Q950	I659-R952 HydrophobicContact CG2-CB 3.81Å; I659-R952 HydrophobicContact CG2-CG 4.08Å; M663-R952 HydrophobicContact SD-CG 4.06Å; E666-R952 VanDerWaalsContact CD-NH1 3.34Å; E666-R952 IonicContact OE1-NH1 3.89Å; E666-R952 PolarHBondContact OE1-NH1 2.93Å; E666-R952 IonicContact OE2-CZ 2.68Å; E666-R952 VanDerWaalsContact OE2-CZ 3.24Å; E666-R952 IonicContact OE2-NH1 2.77Å; E666-R952 PolarHBondContact OE2-NH1 3.34Å; E666-R952 IonicContact OE2-NH2 2.66Å; E666-R952 PolarHBondContact OE2-NH2 2.98Å; Q744-R952 PolarHBondContact NE2-O 2.72Å; L949-R952 PolarHBondContact O-N 3.48Å; Q950-R952 PolarHBondContact O-N 2.96Å
953	V	93.3	Very high	92.7	Very high	11 Å²	11	55.2 Å²	55.2	7%	0.067	27%	0.269	C	S	.	.	S	Bend	trans	-126.9	141.4	176.4	175.8	0	0	0	0	107.8	Q744 V747 L748 Q950 E951 R955 L958	Q744-V953 HydrophobicContact CB-CG2 4.28Å; Q744-V953 HydrophobicContact CG-CG2 4.28Å; V747-V953 HydrophobicContact CB-CG2 3.83Å; V747-V953 HydrophobicContact CG1-CG2 3.61Å; L748-V953 HydrophobicContact CD1-CG1 4.05Å; L748-V953 HydrophobicContact CD2-CG1 3.6Å; L748-V953 HydrophobicContact CG-CG1 3.68Å; Q950-V953 PolarHBondContact O-N 2.91Å; E951-V953 VanDerWaalsContact C-N 3.34Å; V953-R955 PolarHBondContact O-N 3.05Å; V953-L958 HydrophobicContact CG1-CB 4.43Å
954	P	94.2	Very high	92.7	Very high	35 Å²	35	51.8 Å²	51.8	23%	0.227	25%	0.245	C	C	.	.			trans	-56.1	133.5	179.3	-25.8	35.7	0	0	0	112.2	E956 Q957 L958	P954-E956 VanDerWaalsContact C-N 3.31Å; P954-E956 PolarHBondContact O-N 3.19Å; P954-Q957 HydrophobicContact CB-CB 4.23Å; P954-Q957 PolarHBondContact O-N 3Å; P954-L958 PolarHBondContact O-N 3.23Å
955	R	93.8	Very high	92.7	Very high	131 Å²	131	52.6 Å²	52.6	49%	0.494	25%	0.248	S	C	.	.	H	α-helix	trans	-54.3	-46	-173.4	-173.9	-173.7	-178.3	-78.1	4.3	112.2	D939 L942 V953 L958 L959	D939-R955 IonicContact OD2-CZ 3.5Å; D939-R955 IonicContact OD2-NH1 2.7Å; D939-R955 PolarHBondContact OD2-NH1 3.48Å; D939-R955 IonicContact OD2-NH2 2.76Å; D939-R955 PolarHBondContact OD2-NH2 3.41Å; L942-R955 HydrophobicContact CD1-CG 3.77Å; V953-R955 PolarHBondContact O-N 3.05Å; R955-L958 PolarHBondContact O-N 3.2Å; R955-L959 WeakPolarHBondContact O-CB 3.48Å; R955-L959 PolarHBondContact O-N 3.34Å
956	E	91	Very high	93	Very high	163 Å²	163	48 Å²	48	76%	0.762	23%	0.231	S	C	*	.	H	α-helix	trans	-65.7	-43.4	-178.7	-56.3	-173.2	147.5	0	0	111.8	P954 L958 L959 E960	P954-E956 VanDerWaalsContact C-N 3.31Å; P954-E956 PolarHBondContact O-N 3.19Å; E956-L958 VanDerWaalsContact C-N 3.34Å; E956-L958 PolarHBondContact O-N 2.83Å; E956-L959 PolarHBondContact O-N 2.99Å; E956-E960 WeakPolarHBondContact O-CB 3.48Å; E956-E960 PolarHBondContact O-N 3.26Å
957	Q	91.9	Very high	93.1	Very high	49 Å²	49	47.8 Å²	47.8	23%	0.229	23%	0.23	C	C	.	.	H	α-helix	trans	-66.4	-36.3	178.2	-169	175.2	50.6	0	0	111.9	L748 P954 Q961	L748-Q957 HydrophobicContact CD1-CG 3.76Å; L748-Q957 HydrophobicContact CD2-CG 4.4Å; P954-Q957 HydrophobicContact CB-CB 4.23Å; P954-Q957 PolarHBondContact O-N 3Å; Q957-Q961 WeakPolarHBondContact O-CB 3.44Å; Q957-Q961 WeakPolarHBondContact O-CG 3.44Å; Q957-Q961 PolarHBondContact O-N 3.06Å
958	L	94.5	Very high	93.3	Very high	8 Å²	8	46.5 Å²	46.5	4%	0.042	22%	0.224	C	C	.	.	H	α-helix	trans	-65.6	-45.2	172.2	-179.6	59	0	0	0	111.3	L748 C751 L942 Q950 V953 P954 R955 E956 Q961 L962	L748-L958 HydrophobicContact CD2-CB 4.3Å; L748-L958 HydrophobicContact CD2-CD1 4.1Å; C751-L958 HydrophobicContact CB-CD1 3.88Å; L942-L958 HydrophobicContact CD2-CD2 4.03Å; L942-L958 HydrophobicContact CD2-CG 4.04Å; Q950-L958 HydrophobicContact CB-CD2 4.13Å; Q950-L958 HydrophobicContact CG-CD2 4.36Å; V953-L958 HydrophobicContact CG1-CB 4.43Å; P954-L958 PolarHBondContact O-N 3.23Å; R955-L958 PolarHBondContact O-N 3.2Å; E956-L958 VanDerWaalsContact C-N 3.34Å; E956-L958 PolarHBondContact O-N 2.83Å; L958-Q961 PolarHBondContact O-N 2.93Å; L958-L962 HydrophobicContact CD1-CD1 4.02Å; L958-L962 HydrophobicContact CD1-CG 4.1Å; L958-L962 HydrophobicContact CG-CD1 3.98Å; L958-L962 HydrophobicContact CG-CG 4.47Å; L958-L962 WeakPolarHBondContact O-CB 3.44Å; L958-L962 VanDerWaalsContact O-CG 3.24Å; L958-L962 WeakPolarHBondContact O-CG 3.35Å; L958-L962 PolarHBondContact O-N 3.42Å
959	L	93.7	Very high	93.5	Very high	36 Å²	36	43.3 Å²	43.3	19%	0.188	20%	0.201	C	C	.	.	H	α-helix	trans	-63.2	-43.1	179.2	-177.5	66.4	0	0	0	112.7	D939 I941 R955 E956 S963	D939-L959 HydrophobicContact CB-CD1 4.29Å; D939-L959 WeakPolarHBondContact OD1-CD1 3.37Å; D939-L959 WeakPolarHBondContact OD1-CD2 3.37Å; I941-L959 HydrophobicContact CG2-CD1 4.02Å; R955-L959 WeakPolarHBondContact O-CB 3.48Å; R955-L959 PolarHBondContact O-N 3.34Å; E956-L959 PolarHBondContact O-N 2.99Å; L959-S963 VanDerWaalsContact O-CB 3.3Å; L959-S963 WeakPolarHBondContact O-CB 3.38Å; L959-S963 PolarHBondContact O-N 3.32Å; L959-S963 PolarHBondContact O-OG 2.86Å
960	E	91.7	Very high	93.6	Very high	85 Å²	85	42.5 Å²	42.5	40%	0.397	20%	0.197	S	C	.	.	H	α-helix	trans	-56.8	-54.7	173.9	-174.6	-151.1	-148.5	0	0	110.2	E956 L962 S963 L964	E956-E960 WeakPolarHBondContact O-CB 3.48Å; E956-E960 PolarHBondContact O-N 3.26Å; E960-L962 VanDerWaalsContact C-N 3.34Å; E960-L962 PolarHBondContact O-N 2.95Å; E960-S963 CarbonylContact O-C 3.5Å; E960-S963 WeakPolarHBondContact O-CA 3.42Å; E960-S963 WeakPolarHBondContact O-CB 3.47Å; E960-S963 PolarHBondContact O-N 3.33Å; E960-L964 WeakPolarHBondContact O-CG 3.38Å; E960-L964 PolarHBondContact O-N 3.43Å
961	Q	92.3	Very high	93.6	Very high	48 Å²	48	41.8 Å²	41.8	22%	0.224	19%	0.193	C	C	.	.	H	α-helix	trans	-66.8	-33	-174.3	-67.3	-63.8	-49.2	0	0	112.8	L748 T752 Q957 L958	L748-Q961 HydrophobicContact CD2-CB 4.17Å; L748-Q961 HydrophobicContact CD2-CG 4.13Å; T752-Q961 HydrophobicContact CG2-CB 3.74Å; T752-Q961 WeakPolarHBondContact CG2-O 3.47Å; Q957-Q961 WeakPolarHBondContact O-CB 3.44Å; Q957-Q961 WeakPolarHBondContact O-CG 3.44Å; Q957-Q961 PolarHBondContact O-N 3.06Å; L958-Q961 PolarHBondContact O-N 2.93Å
962	L	95.2	Very high	93.7	Very high	2 Å²	2	37 Å²	37	1%	0.01	17%	0.171	C	C	.	.	H	α-helix	trans	-67.9	-41.1	169.3	-66.1	172.4	0	0	0	111.3	L755 L942 Y946 L958 E960 L964 Q965 F966	L755-L962 HydrophobicContact CB-CD2 3.96Å; L755-L962 HydrophobicContact CD2-CB 3.88Å; L755-L962 HydrophobicContact CD2-CD2 3.6Å; L755-L962 HydrophobicContact CD2-CG 4.31Å; L755-L962 HydrophobicContact CG-CD2 4.39Å; L942-L962 HydrophobicContact CD2-CD1 3.96Å; Y946-L962 HydrophobicContact CD1-CD2 4.23Å; Y946-L962 HydrophobicContact CD2-CD1 4.29Å; Y946-L962 HydrophobicContact CE1-CD2 3.98Å; Y946-L962 HydrophobicContact CE2-CD1 3.72Å; Y946-L962 HydrophobicContact CE2-CD2 4.32Å; L958-L962 HydrophobicContact CD1-CD1 4.02Å; L958-L962 HydrophobicContact CD1-CG 4.1Å; L958-L962 HydrophobicContact CG-CD1 3.98Å; L958-L962 HydrophobicContact CG-CG 4.47Å; L958-L962 WeakPolarHBondContact O-CB 3.44Å; L958-L962 VanDerWaalsContact O-CG 3.24Å; L958-L962 WeakPolarHBondContact O-CG 3.35Å; L958-L962 PolarHBondContact O-N 3.42Å; E960-L962 VanDerWaalsContact C-N 3.34Å; E960-L962 PolarHBondContact O-N 2.95Å; L962-L964 VanDerWaalsContact C-N 3.34Å; L962-L964 PolarHBondContact O-N 2.82Å; L962-Q965 WeakPolarHBondContact O-CB 3.33Å; L962-Q965 PolarHBondContact O-N 3.13Å; L962-Q965 VanDerWaalsContact O-N 3.07Å; L962-F966 PolarHBondContact O-N 3.28Å
963	S	93.7	Very high	93.7	Very high	24 Å²	24	34.2 Å²	34.2	17%	0.168	16%	0.163	C	C	.	.	H	α-helix	trans	-62.4	-36.8	176.6	-62.6	0	0	0	0	112.6	L959 E960 Q965 F966 I967	L959-S963 VanDerWaalsContact O-CB 3.3Å; L959-S963 WeakPolarHBondContact O-CB 3.38Å; L959-S963 PolarHBondContact O-N 3.32Å; L959-S963 PolarHBondContact O-OG 2.86Å; E960-S963 CarbonylContact O-C 3.5Å; E960-S963 WeakPolarHBondContact O-CA 3.42Å; E960-S963 WeakPolarHBondContact O-CB 3.47Å; E960-S963 PolarHBondContact O-N 3.33Å; S963-Q965 PolarHBondContact O-N 3.35Å; S963-F966 PolarHBondContact O-N 2.97Å; S963-F966 VanDerWaalsContact O-N 3.13Å; S963-I967 WeakPolarHBondContact O-CD1 3.34Å; S963-I967 VanDerWaalsContact O-CG1 3.29Å; S963-I967 WeakPolarHBondContact O-CG1 3.17Å; S963-I967 PolarHBondContact O-N 3.46Å
964	L	93.7	Very high	93.6	Very high	17 Å²	17	34.2 Å²	34.2	9%	0.089	17%	0.166	C	C	.	.	H	α-helix	trans	-57	-35.9	172.4	-62.9	-171.3	0	0	0	112.2	W384 E960 L962 I967 N968	W384-L964 HydrophobicContact CD2-CD1 4.13Å; W384-L964 HydrophobicContact CD2-CD2 3.99Å; W384-L964 HydrophobicContact CE3-CD1 4.26Å; W384-L964 HydrophobicContact CE3-CD2 3.81Å; W384-L964 HydrophobicContact CG-CD1 4.27Å; W384-L964 HydrophobicContact CH2-CD2 3.73Å; W384-L964 HydrophobicContact CZ2-CD2 3.89Å; W384-L964 HydrophobicContact CZ3-CD2 3.69Å; E960-L964 WeakPolarHBondContact O-CG 3.38Å; E960-L964 PolarHBondContact O-N 3.43Å; L962-L964 VanDerWaalsContact C-N 3.34Å; L962-L964 PolarHBondContact O-N 2.82Å; L964-I967 HydrophobicContact CD2-CD1 4.28Å; L964-I967 PolarHBondContact O-N 3.33Å; L964-N968 WeakPolarHBondContact O-CB 3.18Å; L964-N968 PolarHBondContact O-N 3.34Å; L964-N968 PolarHBondContact O-ND2 3.03Å; L964-N968 VanDerWaalsContact O-ND2 3.14Å
965	Q	94.2	Very high	93.5	Very high	17 Å²	17	33.3 Å²	33.3	8%	0.079	16%	0.158	C	C	.	.	H	α-helix	trans	-71.8	-37.9	176.6	-63.2	-56.6	-34.3	0	0	112.5	T752 L755 L962 S963 N968 R969	T752-Q965 HydrophobicContact CG2-CG 4.22Å; L755-Q965 HydrophobicContact CD2-CB 4.04Å; L755-Q965 HydrophobicContact CG-CB 4.41Å; L962-Q965 WeakPolarHBondContact O-CB 3.33Å; L962-Q965 PolarHBondContact O-N 3.13Å; L962-Q965 VanDerWaalsContact O-N 3.07Å; S963-Q965 PolarHBondContact O-N 3.35Å; Q965-N968 PolarHBondContact O-N 3.17Å; Q965-R969 WeakPolarHBondContact O-CG 3.34Å; Q965-R969 PolarHBondContact O-N 3.49Å
966	F	95.9	Very high	93.4	Very high	1 Å²	1	28.1 Å²	28.1	0%	0.004	14%	0.141	C	C	.	.	H	α-helix	trans	-62.3	-44.2	170.2	-80.5	-78.7	0	0	0	111.9	L755 L759 L928 C935 I941 L962 S963 N968 R969 T970 L989 Y992	L755-F966 HydrophobicContact CD1-CE2 4.29Å; L755-F966 HydrophobicContact CD1-CZ 4.38Å; L755-F966 HydrophobicContact CD2-CD2 4.04Å; L755-F966 HydrophobicContact CD2-CE2 3.79Å; L759-F966 HydrophobicContact CD1-CD1 3.84Å; L759-F966 HydrophobicContact CD1-CD2 4.32Å; L759-F966 HydrophobicContact CD1-CE1 3.94Å; L759-F966 HydrophobicContact CD1-CE2 4.4Å; L759-F966 HydrophobicContact CD1-CG 4.04Å; L759-F966 HydrophobicContact CD1-CZ 4.23Å; L759-F966 HydrophobicContact CD2-CD1 4.46Å; L759-F966 HydrophobicContact CD2-CE1 3.85Å; L759-F966 HydrophobicContact CD2-CZ 4.19Å; L928-F966 HydrophobicContact CD1-CD1 3.91Å; L928-F966 HydrophobicContact CD1-CE1 4.22Å; C935-F966 VanDerWaalsContact SG-CZ 3.57Å; I941-F966 HydrophobicContact CD1-CE2 3.93Å; I941-F966 HydrophobicContact CD1-CZ 3.88Å; I941-F966 HydrophobicContact CG1-CE2 4.12Å; L962-F966 PolarHBondContact O-N 3.28Å; S963-F966 PolarHBondContact O-N 2.97Å; S963-F966 VanDerWaalsContact O-N 3.13Å; F966-N968 PolarHBondContact O-N 3.29Å; F966-R969 PolarHBondContact O-N 2.83Å; F966-T970 WeakPolarHBondContact O-CB 3.3Å; F966-T970 PolarHBondContact O-N 2.85Å; F966-T970 PolarHBondContact O-OG1 3.08Å; F966-L989 HydrophobicContact CD1-CD2 4.41Å; F966-Y992 HydrophobicContact CB-CD1 3.92Å; F966-Y992 HydrophobicContact CB-CD2 3.64Å; F966-Y992 HydrophobicContact CB-CE1 4.09Å; F966-Y992 HydrophobicContact CB-CE2 3.82Å; F966-Y992 HydrophobicContact CB-CG 3.68Å; F966-Y992 HydrophobicContact CD1-CD2 4.27Å; F966-Y992 HydrophobicContact CD1-CE2 4.16Å; F966-Y992 HydrophobicContact CD2-CE2 4.45Å; F966-Y992 HydrophobicContact CG-CD2 4.12Å; F966-Y992 AromaticContact CG-CE2 3.91Å; F966-Y992 HydrophobicContact CG-CE2 3.91Å
967	I	95.7	Very high	93.3	Very high	3 Å²	3	20.7 Å²	20.7	2%	0.015	11%	0.106	C	C	.	.	H	α-helix	trans	-59.6	-48	177.1	-66.9	157.5	0	0	0	110.9	R292 P364 W384 S963 L964 R969 S971 Y992	R292-I967 VanDerWaalsContact CD-CD1 3.45Å; P364-I967 HydrophobicContact CG-CG2 3.56Å; W384-I967 HydrophobicContact CZ2-CG2 4.08Å; S963-I967 WeakPolarHBondContact O-CD1 3.34Å; S963-I967 VanDerWaalsContact O-CG1 3.29Å; S963-I967 WeakPolarHBondContact O-CG1 3.17Å; S963-I967 PolarHBondContact O-N 3.46Å; L964-I967 HydrophobicContact CD2-CD1 4.28Å; L964-I967 PolarHBondContact O-N 3.33Å; I967-R969 PolarHBondContact O-N 3.08Å; I967-S971 VanDerWaalsContact O-CB 3.27Å; I967-S971 WeakPolarHBondContact O-CB 3.19Å; I967-S971 PolarHBondContact O-N 3.42Å; I967-S971 PolarHBondContact O-OG 3.01Å; I967-Y992 WeakPolarHBondContact CA-O 3.38Å; I967-Y992 HydrophobicContact CG1-CD1 3.85Å; I967-Y992 HydrophobicContact CG1-CG 4.42Å
968	N	94.6	Very high	93.2	Very high	1 Å²	1	18.8 Å²	18.8	1%	0.005	10%	0.098	C	C	.	.	H	α-helix	trans	-62.5	-41.6	179.7	-72	-24.2	0	0	0	112.8	I380 W384 L964 Q965 F966 E972	I380-N968 HydrophobicContact CD1-CB 4.3Å; I380-N968 WeakPolarHBondContact CD1-OD1 3.41Å; W384-N968 PolarHBondContact NE1-ND2 2.84Å; W384-N968 PolarHBondContact NE1-OD1 2.7Å; L964-N968 WeakPolarHBondContact O-CB 3.18Å; L964-N968 PolarHBondContact O-N 3.34Å; L964-N968 PolarHBondContact O-ND2 3.03Å; L964-N968 VanDerWaalsContact O-ND2 3.14Å; Q965-N968 PolarHBondContact O-N 3.17Å; F966-N968 PolarHBondContact O-N 3.29Å; N968-E972 WeakPolarHBondContact O-CB 3.46Å; N968-E972 PolarHBondContact O-N 2.98Å
969	R	94.1	Very high	92.7	Very high	23 Å²	23	22.7 Å²	22.7	9%	0.087	12%	0.118	C	C	.	.	H	α-helix	trans	-80.5	-35.9	179.5	-62.8	-46.8	109.9	-161.1	4.2	113.4	L759 L928 Q965 F966 I967 S971 E972 V973	L759-R969 HydrophobicContact CB-CB 4.32Å; L759-R969 HydrophobicContact CB-CG 3.75Å; L759-R969 HydrophobicContact CD1-CG 4.37Å; L928-R969 HydrophobicContact CD1-CB 4.21Å; L928-R969 HydrophobicContact CD2-CB 4.37Å; Q965-R969 WeakPolarHBondContact O-CG 3.34Å; Q965-R969 PolarHBondContact O-N 3.49Å; F966-R969 PolarHBondContact O-N 2.83Å; I967-R969 PolarHBondContact O-N 3.08Å; R969-S971 VanDerWaalsContact C-N 3.34Å; R969-E972 WeakPolarHBondContact CD-OE2 3.37Å; R969-E972 IonicContact CZ-OE2 3.23Å; R969-E972 IonicContact NE-OE2 2.8Å; R969-E972 IonicContact NH1-OE1 2.73Å; R969-E972 PolarHBondContact NH1-OE1 3.44Å; R969-E972 VanDerWaalsContact NH1-OE1 3.1Å; R969-E972 IonicContact NH1-OE2 3.98Å; R969-E972 PolarHBondContact NH1-OE2 2.73Å; R969-E972 PolarHBondContact O-N 3.39Å; R969-V973 WeakPolarHBondContact O-CG2 3.23Å; R969-V973 PolarHBondContact O-N 3.4Å
970	T	94.7	Very high	92.5	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-64.4	-41.3	176.3	-54.9	0	0	0	0	110.6	F966 G974 L975 L989 I993	F966-T970 WeakPolarHBondContact O-CB 3.3Å; F966-T970 PolarHBondContact O-N 2.85Å; F966-T970 PolarHBondContact O-OG1 3.08Å; T970-G974 PolarHBondContact O-N 3.13Å; T970-L975 HydrophobicContact CG2-CD1 3.69Å; T970-L975 HydrophobicContact CG2-CD2 4.15Å; T970-L975 HydrophobicContact CG2-CG 3.82Å; T970-L989 HydrophobicContact CG2-CB 4.16Å; T970-I993 HydrophobicContact CG2-CD1 4.02Å; T970-I993 HydrophobicContact CG2-CG1 4.29Å
971	S	93.4	Very high	92.2	Very high	0 Å²	0	19 Å²	19	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-68.4	-32.2	174.2	-54.3	0	0	0	0	112.8	I967 R969 F1038	I967-S971 VanDerWaalsContact O-CB 3.27Å; I967-S971 WeakPolarHBondContact O-CB 3.19Å; I967-S971 PolarHBondContact O-N 3.42Å; I967-S971 PolarHBondContact O-OG 3.01Å; R969-S971 VanDerWaalsContact C-N 3.34Å; S971-F1038 WeakPolarHBondContact O-CD1 3.27Å; S971-F1038 WeakPolarHBondContact O-CE1 3.33Å
972	E	92.3	Very high	91.8	Very high	39 Å²	39	22.3 Å²	22.3	18%	0.182	12%	0.118	C	C	.	.	H	α-helix	trans	-68.1	-46.3	174.2	179.9	175.4	-119.5	0	0	112.3	F368 N968 R969 R1061	F368-E972 HydrophobicContact CZ-CB 3.86Å; F368-E972 HydrophobicContact CZ-CG 4.29Å; N968-E972 WeakPolarHBondContact O-CB 3.46Å; N968-E972 PolarHBondContact O-N 2.98Å; R969-E972 WeakPolarHBondContact CD-OE2 3.37Å; R969-E972 IonicContact CZ-OE2 3.23Å; R969-E972 IonicContact NE-OE2 2.8Å; R969-E972 IonicContact NH1-OE1 2.73Å; R969-E972 PolarHBondContact NH1-OE1 3.44Å; R969-E972 VanDerWaalsContact NH1-OE1 3.1Å; R969-E972 IonicContact NH1-OE2 3.98Å; R969-E972 PolarHBondContact NH1-OE2 2.73Å; R969-E972 PolarHBondContact O-N 3.39Å; E972-R1061 PolarHBondContact O-NE 3.45Å; E972-R1061 PolarHBondContact O-NH2 3.28Å
973	V	93.2	Very high	91.1	Very high	26 Å²	26	23 Å²	23	16%	0.158	12%	0.122	C	C	.	.	H	α-helix	trans	-73.2	-49	-178.2	178.6	0	0	0	0	110.8	L928 R969 R1061 R1140	L928-V973 HydrophobicContact CD2-CB 4.31Å; L928-V973 HydrophobicContact CD2-CG2 3.92Å; R969-V973 WeakPolarHBondContact O-CG2 3.23Å; R969-V973 PolarHBondContact O-N 3.4Å; V973-R1061 PolarHBondContact O-NH2 3.36Å; V973-R1140 HydrophobicContact CG2-CG 4.23Å
974	G	92.3	Very high	90.7	Very high	11 Å²	11	25 Å²	25	11%	0.113	14%	0.136	C	C	.	.			trans	85.6	154.7	-169.3	0	0	0	0	0	112.6	T970 F1038	T970-G974 PolarHBondContact O-N 3.13Å; G974-F1038 VanDerWaalsContact CA-O 3.3Å; G974-F1038 WeakPolarHBondContact CA-O 3.48Å
975	L	92	Very high	90.3	Very high	15 Å²	15	25.5 Å²	25.5	8%	0.079	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	137.8	-178.7	-62	-179.5	0	0	0	111.9	T970 M980 L989 I993 F1038 I1039 K1040	T970-L975 HydrophobicContact CG2-CD1 3.69Å; T970-L975 HydrophobicContact CG2-CD2 4.15Å; T970-L975 HydrophobicContact CG2-CG 3.82Å; L975-M980 HydrophobicContact CB-SD 3.7Å; L975-M980 HydrophobicContact CD1-CE 3.69Å; L975-M980 HydrophobicContact CD1-SD 3.89Å; L975-M980 HydrophobicContact CG-SD 4.33Å; L975-L989 HydrophobicContact CD1-CB 3.62Å; L975-L989 HydrophobicContact CD2-CB 3.93Å; L975-L989 HydrophobicContact CD2-CD1 3.79Å; L975-L989 HydrophobicContact CG-CB 4.42Å; L975-I993 HydrophobicContact CB-CD1 4.28Å; L975-I993 HydrophobicContact CD1-CD1 3.86Å; L975-I993 HydrophobicContact CD1-CG1 3.68Å; L975-I993 HydrophobicContact CG-CD1 3.96Å; L975-I993 HydrophobicContact CG-CG1 4.35Å; L975-F1038 PolarHBondContact N-O 3.08Å; L975-I1039 CarbonylContact O-C 3.55Å; L975-I1039 WeakPolarHBondContact O-CA 3.48Å; L975-K1040 PolarHBondContact O-N 2.99Å
976	D	90.8	Very high	90	Very high	23 Å²	23	25.5 Å²	25.5	12%	0.123	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	111.7	172.2	-172.2	-59.9	0	0	0	110.7	N978 L979 M980 K1040 D1042	D976-N978 VanDerWaalsContact C-N 3.34Å; D976-N978 PolarHBondContact O-N 2.68Å; D976-N978 WeakPolarHBondContact OD1-CA 3.21Å; D976-N978 WeakPolarHBondContact OD1-CB 3.48Å; D976-N978 PolarHBondContact OD1-N 3.26Å; D976-L979 HydrophobicContact CB-CB 3.95Å; D976-L979 WeakPolarHBondContact O-CB 3.33Å; D976-L979 PolarHBondContact O-N 3.04Å; D976-L979 PolarHBondContact OD1-N 3.31Å; D976-M980 VanDerWaalsContact O-CG 3.26Å; D976-M980 WeakPolarHBondContact O-CG 3.34Å; D976-M980 PolarHBondContact O-N 3.04Å; D976-K1040 WeakPolarHBondContact CA-O 3.38Å; D976-K1040 HydrophobicContact CB-CB 4.25Å; D976-K1040 HydrophobicContact CB-CG 4.47Å; D976-D1042 WeakPolarHBondContact OD2-CB 3.13Å; D976-D1042 PolarHBondContact OD2-N 2.9Å
977	I	89.4	Confident	89.7	Confident	6 Å²	6	27.1 Å²	27.1	3%	0.031	15%	0.146	C	C	.	.	H	α-helix	trans	-66.8	-34.2	-176	-75.8	-177.3	0	0	0	112.2	L979 M980 V981 L1004 L1008 L1021 I1039	I977-L979 VanDerWaalsContact C-N 3.31Å; I977-L979 PolarHBondContact O-N 3.19Å; I977-M980 HydrophobicContact CG1-SD 4.33Å; I977-M980 PolarHBondContact O-N 3.05Å; I977-M980 VanDerWaalsContact O-N 3.15Å; I977-V981 WeakPolarHBondContact O-CG2 3.31Å; I977-V981 PolarHBondContact O-N 2.87Å; I977-L1004 HydrophobicContact CD1-CD2 3.97Å; I977-L1008 HydrophobicContact CG2-CD1 3.36Å; I977-L1021 HydrophobicContact CD1-CD2 4.3Å; I977-I1039 HydrophobicContact CB-CG2 4.5Å; I977-I1039 HydrophobicContact CD1-CB 4.41Å; I977-I1039 HydrophobicContact CD1-CD1 3.76Å; I977-I1039 HydrophobicContact CD1-CG1 3.88Å; I977-I1039 HydrophobicContact CD1-CG2 3.64Å; I977-I1039 HydrophobicContact CG1-CG1 4.49Å; I977-I1039 HydrophobicContact CG1-CG2 3.94Å
978	N	89.1	Confident	89.4	Confident	10 Å²	10	28.5 Å²	28.5	5%	0.053	15%	0.153	C	C	.	.	H	α-helix	trans	-65.9	-38.6	176.8	-70.8	-47.7	0	0	0	110.5	D976 Q982 R1014 L1015	D976-N978 VanDerWaalsContact C-N 3.34Å; D976-N978 PolarHBondContact O-N 2.68Å; D976-N978 WeakPolarHBondContact OD1-CA 3.21Å; D976-N978 WeakPolarHBondContact OD1-CB 3.48Å; D976-N978 PolarHBondContact OD1-N 3.26Å; N978-Q982 WeakPolarHBondContact O-CG 3.38Å; N978-Q982 PolarHBondContact O-N 3.11Å; N978-Q982 PolarHBondContact O-NE2 2.94Å; N978-R1014 WeakPolarHBondContact OD1-CA 3.48Å; N978-L1015 PolarHBondContact ND2-O 2.9Å; N978-L1015 PolarHBondContact OD1-N 2.97Å
979	L	85.6	Confident	89.4	Confident	90 Å²	90	28.5 Å²	28.5	47%	0.471	15%	0.153	S	C	.	.	H	α-helix	trans	-64.9	-37.9	171.9	-175.7	61	0	0	0	111.8	D976 I977 Q982 N983	D976-L979 HydrophobicContact CB-CB 3.95Å; D976-L979 WeakPolarHBondContact O-CB 3.33Å; D976-L979 PolarHBondContact O-N 3.04Å; D976-L979 PolarHBondContact OD1-N 3.31Å; I977-L979 VanDerWaalsContact C-N 3.31Å; I977-L979 PolarHBondContact O-N 3.19Å; L979-Q982 CarbonylContact O-C 3.48Å; L979-Q982 PolarHBondContact O-N 3.06Å; L979-N983 HydrophobicContact CD1-CB 4.24Å; L979-N983 WeakPolarHBondContact O-CB 3.34Å; L979-N983 PolarHBondContact O-N 2.95Å
980	M	87.6	Confident	89.3	Confident	3 Å²	3	27.8 Å²	27.8	2%	0.015	15%	0.151	C	C	.	.	H	α-helix	trans	-69.7	-32.5	178.8	-64.8	164.6	82.1	0	0	114	L975 D976 I977 Q982 T986 L990	L975-M980 HydrophobicContact CB-SD 3.7Å; L975-M980 HydrophobicContact CD1-CE 3.69Å; L975-M980 HydrophobicContact CD1-SD 3.89Å; L975-M980 HydrophobicContact CG-SD 4.33Å; D976-M980 VanDerWaalsContact O-CG 3.26Å; D976-M980 WeakPolarHBondContact O-CG 3.34Å; D976-M980 PolarHBondContact O-N 3.04Å; I977-M980 HydrophobicContact CG1-SD 4.33Å; I977-M980 PolarHBondContact O-N 3.05Å; I977-M980 VanDerWaalsContact O-N 3.15Å; M980-Q982 VanDerWaalsContact C-N 3.28Å; M980-T986 WeakPolarHBondContact CA-OG1 3.48Å; M980-T986 WeakPolarHBondContact CE-O 3.35Å; M980-T986 WeakPolarHBondContact CG-OG1 3.35Å; M980-L990 HydrophobicContact CE-CB 3.5Å; M980-L990 HydrophobicContact CE-CD1 3.84Å; M980-L990 HydrophobicContact CE-CD2 4.3Å; M980-L990 HydrophobicContact CE-CG 4.06Å; M980-L990 HydrophobicContact SD-CD1 4.46Å
981	V	86.9	Confident	89.3	Confident	41 Å²	41	29.9 Å²	29.9	25%	0.248	16%	0.161	C	C	.	.	H	α-helix	trans	-65.1	-35.6	170.8	172.1	0	0	0	0	110.8	I977 L1005 L1008 K1009	I977-V981 WeakPolarHBondContact O-CG2 3.31Å; I977-V981 PolarHBondContact O-N 2.87Å; V981-L1005 HydrophobicContact CG2-CD1 3.91Å; V981-L1008 HydrophobicContact CG2-CB 3.95Å; V981-L1008 HydrophobicContact CG2-CD1 4.37Å; V981-K1009 HydrophobicContact CG1-CG 4.26Å
982	Q	83.3	Confident	89.3	Confident	117 Å²	117	30.8 Å²	30.8	55%	0.547	16%	0.164	S	C	.	.	H	α-helix	trans	-85.3	-33.5	-179.2	-71.2	168	95.2	0	0	114	N978 L979 M980	N978-Q982 WeakPolarHBondContact O-CG 3.38Å; N978-Q982 PolarHBondContact O-N 3.11Å; N978-Q982 PolarHBondContact O-NE2 2.94Å; L979-Q982 CarbonylContact O-C 3.48Å; L979-Q982 PolarHBondContact O-N 3.06Å; M980-Q982 VanDerWaalsContact C-N 3.28Å
983	N	81.4	Confident	89.5	Confident	17 Å²	17	28.9 Å²	28.9	9%	0.091	16%	0.156	C	C	.	.			trans	-121	97.3	-171.2	-164.9	-43.1	0	0	0	111.3	E806 L979 R985 T986	E806-N983 PolarHBondContact O-ND2 2.85Å; L979-N983 HydrophobicContact CD1-CB 4.24Å; L979-N983 WeakPolarHBondContact O-CB 3.34Å; L979-N983 PolarHBondContact O-N 2.95Å; N983-R985 PolarHBondContact O-N 3.49Å; N983-R985 WeakPolarHBondContact OD1-CB 3.44Å; N983-R985 WeakPolarHBondContact OD1-CG 3.34Å; N983-R985 PolarHBondContact OD1-N 3.25Å; N983-R985 PolarHBondContact OD1-NE 2.84Å; N983-T986 PolarHBondContact O-N 3.41Å; N983-T986 VanDerWaalsContact O-N 3.1Å; N983-T986 PolarHBondContact O-OG1 3Å
984	S	83.7	Confident	89.5	Confident	66 Å²	66	27.7 Å²	27.7	46%	0.462	15%	0.148	S	C	.	.	G	3₁₀ helix	trans	-49.3	-31.5	-174.6	-170	0	0	0	0	114.5	T986 I987	S984-T986 VanDerWaalsContact C-N 3.3Å; S984-T986 PolarHBondContact O-N 3.24Å; S984-I987 WeakPolarHBondContact O-CB 3.33Å; S984-I987 WeakPolarHBondContact O-CD1 3.4Å; S984-I987 WeakPolarHBondContact O-CG1 3.27Å; S984-I987 PolarHBondContact O-N 3.3Å
985	R	85.8	Confident	89.5	Confident	27 Å²	27	27.1 Å²	27.1	10%	0.102	14%	0.143	C	C	.	.	G	3₁₀ helix	trans	-64.8	-31.1	-176.2	-50.2	-176.7	-55.5	123.5	0.6	113	E806 R922 Q933 N983 I987	E806-R985 PolarHBondContact O-NH2 3.11Å; R922-R985 VanDerWaalsContact CZ-CD 3.44Å; Q933-R985 PolarHBondContact NE2-O 3.38Å; N983-R985 PolarHBondContact O-N 3.49Å; N983-R985 WeakPolarHBondContact OD1-CB 3.44Å; N983-R985 WeakPolarHBondContact OD1-CG 3.34Å; N983-R985 PolarHBondContact OD1-N 3.25Å; N983-R985 PolarHBondContact OD1-NE 2.84Å; R985-I987 VanDerWaalsContact C-N 3.35Å
986	T	87.7	Confident	89.6	Confident	17 Å²	17	26.4 Å²	26.4	10%	0.104	14%	0.139	C	C	.	.	G	3₁₀ helix	trans	-82.8	-11.5	-175.8	51.9	0	0	0	0	113.7	V929 M980 N983 S984 N988 L989	V929-T986 HydrophobicContact CG1-CG2 4.02Å; V929-T986 HydrophobicContact CG2-CG2 4.32Å; M980-T986 WeakPolarHBondContact CA-OG1 3.48Å; M980-T986 WeakPolarHBondContact CE-O 3.35Å; M980-T986 WeakPolarHBondContact CG-OG1 3.35Å; N983-T986 PolarHBondContact O-N 3.41Å; N983-T986 VanDerWaalsContact O-N 3.1Å; N983-T986 PolarHBondContact O-OG1 3Å; S984-T986 VanDerWaalsContact C-N 3.3Å; S984-T986 PolarHBondContact O-N 3.24Å; T986-N988 VanDerWaalsContact C-N 3.31Å; T986-N988 PolarHBondContact O-N 3.26Å; T986-L989 PolarHBondContact O-N 3.41Å
987	I	90.4	Very high	89.7	Confident	35 Å²	35	25.4 Å²	25.4	18%	0.179	13%	0.134	C	C	.	.	G	3₁₀ helix	trans	-54.7	-42.3	-175.6	-68.9	170.9	0	0	0	112.8	S984 R985 L989 L990 L1005	S984-I987 WeakPolarHBondContact O-CB 3.33Å; S984-I987 WeakPolarHBondContact O-CD1 3.4Å; S984-I987 WeakPolarHBondContact O-CG1 3.27Å; S984-I987 PolarHBondContact O-N 3.3Å; R985-I987 VanDerWaalsContact C-N 3.35Å; I987-L989 PolarHBondContact O-N 2.97Å; I987-L990 VanDerWaalsContact O-CB 3.3Å; I987-L990 WeakPolarHBondContact O-CB 3.29Å; I987-L990 PolarHBondContact O-N 3.09Å; I987-L1005 HydrophobicContact CB-CD2 4.21Å; I987-L1005 HydrophobicContact CD1-CD2 3.77Å; I987-L1005 HydrophobicContact CG1-CD2 3.71Å; I987-L1005 HydrophobicContact CG2-CD2 3.53Å
988	N	90.1	Very high	89.8	Confident	32 Å²	32	26.5 Å²	26.5	17%	0.171	14%	0.142	C	C	.	.	G	3₁₀ helix	trans	-62.1	-16.4	-174.8	-69.2	19.3	0	0	0	114.2	S932 T986 Q991	S932-N988 VanDerWaalsContact O-CB 3.25Å; S932-N988 WeakPolarHBondContact O-CB 3.46Å; S932-N988 PolarHBondContact O-ND2 2.78Å; T986-N988 VanDerWaalsContact C-N 3.31Å; T986-N988 PolarHBondContact O-N 3.26Å; N988-Q991 WeakPolarHBondContact O-CG 3.48Å; N988-Q991 PolarHBondContact O-NE2 3.26Å
989	L	93.4	Very high	89.9	Confident	1 Å²	1	27.1 Å²	27.1	1%	0.005	14%	0.143	C	C	.	.	G	3₁₀ helix	trans	-80.5	-16.3	174.9	-65.9	174.3	0	0	0	113.3	L928 V929 S932 F966 T970 L975 T986 I987 Q991 Y992	L928-L989 HydrophobicContact CD1-CD2 4.07Å; L928-L989 HydrophobicContact CG-CD1 4.24Å; L928-L989 HydrophobicContact CG-CD2 4.09Å; V929-L989 HydrophobicContact CG2-CD1 3.94Å; S932-L989 VanDerWaalsContact CB-CD2 3.45Å; S932-L989 WeakPolarHBondContact OG-CD2 3.29Å; S932-L989 WeakPolarHBondContact OG-CG 3.24Å; F966-L989 HydrophobicContact CD1-CD2 4.41Å; T970-L989 HydrophobicContact CG2-CB 4.16Å; L975-L989 HydrophobicContact CD1-CB 3.62Å; L975-L989 HydrophobicContact CD2-CB 3.93Å; L975-L989 HydrophobicContact CD2-CD1 3.79Å; L975-L989 HydrophobicContact CG-CB 4.42Å; T986-L989 PolarHBondContact O-N 3.41Å; I987-L989 PolarHBondContact O-N 2.97Å; L989-Q991 VanDerWaalsContact C-N 3.28Å; L989-Q991 PolarHBondContact O-N 3.36Å; L989-Y992 HydrophobicContact CD2-CD2 4.39Å; L989-Y992 PolarHBondContact O-N 3.47Å
990	L	93.1	Very high	90.2	Very high	8 Å²	8	23.5 Å²	23.5	4%	0.042	12%	0.124	C	C	.	.	G	3₁₀ helix	trans	-61.5	-35.7	-173.9	-166	50.7	0	0	0	113.2	M980 I987 Y992 I993 L996 G1001 L1005	M980-L990 HydrophobicContact CE-CB 3.5Å; M980-L990 HydrophobicContact CE-CD1 3.84Å; M980-L990 HydrophobicContact CE-CD2 4.3Å; M980-L990 HydrophobicContact CE-CG 4.06Å; M980-L990 HydrophobicContact SD-CD1 4.46Å; I987-L990 VanDerWaalsContact O-CB 3.3Å; I987-L990 WeakPolarHBondContact O-CB 3.29Å; I987-L990 PolarHBondContact O-N 3.09Å; L990-Y992 PolarHBondContact O-N 2.78Å; L990-I993 PolarHBondContact O-N 3.2Å; L990-L996 HydrophobicContact CD1-CD1 3.8Å; L990-L996 HydrophobicContact CG-CD1 4.29Å; L990-G1001 WeakPolarHBondContact CD2-O 3.4Å; L990-L1005 HydrophobicContact CD2-CB 4.01Å
991	Q	92.9	Very high	90.4	Very high	43 Å²	43	23.5 Å²	23.5	20%	0.201	12%	0.124	C	C	.	.	G	3₁₀ helix	trans	-65.8	-18.7	176.8	66.2	-170.3	-31.3	0	0	113.7	R292 C935 N988 L989 P998	R292-Q991 PolarHBondContact NH1-O 2.82Å; C935-Q991 PolarHBondContact O-NE2 2.91Å; N988-Q991 WeakPolarHBondContact O-CG 3.48Å; N988-Q991 PolarHBondContact O-NE2 3.26Å; L989-Q991 VanDerWaalsContact C-N 3.28Å; L989-Q991 PolarHBondContact O-N 3.36Å; Q991-P998 HydrophobicContact CB-CB 4.41Å
992	Y	95.2	Very high	90.5	Very high	19 Å²	19	26.8 Å²	26.8	8%	0.075	14%	0.137	C	C	.	.	G	3₁₀ helix	trans	-98	3.4	-179	-58.3	-52.6	0	0	0	113.2	C935 F966 I967 L989 L990	C935-Y992 HydrophobicContact CB-CE2 4.02Å; C935-Y992 WeakPolarHBondContact CB-OH 3.34Å; C935-Y992 PolarHBondContact SG-OH 3.24Å; F966-Y992 HydrophobicContact CB-CD1 3.92Å; F966-Y992 HydrophobicContact CB-CD2 3.64Å; F966-Y992 HydrophobicContact CB-CE1 4.09Å; F966-Y992 HydrophobicContact CB-CE2 3.82Å; F966-Y992 HydrophobicContact CB-CG 3.68Å; F966-Y992 HydrophobicContact CD1-CD2 4.27Å; F966-Y992 HydrophobicContact CD1-CE2 4.16Å; F966-Y992 HydrophobicContact CD2-CE2 4.45Å; F966-Y992 HydrophobicContact CG-CD2 4.12Å; F966-Y992 AromaticContact CG-CE2 3.91Å; F966-Y992 HydrophobicContact CG-CE2 3.91Å; I967-Y992 WeakPolarHBondContact CA-O 3.38Å; I967-Y992 HydrophobicContact CG1-CD1 3.85Å; I967-Y992 HydrophobicContact CG1-CG 4.42Å; L989-Y992 HydrophobicContact CD2-CD2 4.39Å; L989-Y992 PolarHBondContact O-N 3.47Å; L990-Y992 PolarHBondContact O-N 2.78Å
993	I	95.1	Very high	90.9	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	13%	0.128	C	C	.	.	S	Bend	trans	-71.1	136.1	167.3	-71.4	-72.4	0	0	0	109.8	R292 T970 L975 L990 G995 L996 C1035 F1038	R292-I993 PolarHBondContact NH2-O 2.89Å; T970-I993 HydrophobicContact CG2-CD1 4.02Å; T970-I993 HydrophobicContact CG2-CG1 4.29Å; L975-I993 HydrophobicContact CB-CD1 4.28Å; L975-I993 HydrophobicContact CD1-CD1 3.86Å; L975-I993 HydrophobicContact CD1-CG1 3.68Å; L975-I993 HydrophobicContact CG-CD1 3.96Å; L975-I993 HydrophobicContact CG-CG1 4.35Å; L990-I993 PolarHBondContact O-N 3.2Å; I993-G995 PolarHBondContact O-N 2.76Å; I993-L996 HydrophobicContact CB-CB 4.36Å; I993-L996 HydrophobicContact CB-CD1 4.11Å; I993-L996 HydrophobicContact CB-CG 4.4Å; I993-L996 HydrophobicContact CG2-CB 4.47Å; I993-L996 HydrophobicContact CG2-CD1 3.9Å; I993-L996 HydrophobicContact CG2-CG 4.06Å; I993-L996 PolarHBondContact O-N 2.76Å; I993-L996 VanDerWaalsContact O-O 3.09Å; I993-C1035 HydrophobicContact CG2-CB 3.81Å; I993-F1038 HydrophobicContact CD1-CB 3.89Å
994	C	93.7	Very high	91.3	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	13%	0.125	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.8	132.8	171.6	-171.1	0	0	0	0	111.1	P364 L996 N1034 C1035 F1038	P364-C994 HydrophobicContact CB-CB 4.1Å; P364-C994 HydrophobicContact CG-CB 4.34Å; C994-L996 VanDerWaalsContact C-N 3.28Å; C994-L996 PolarHBondContact O-N 3.32Å; C994-N1034 VanDerWaalsContact CB-O 3.31Å; C994-N1034 WeakPolarHBondContact CB-O 3.36Å; C994-N1034 CarbonylContact O-C 3.59Å; C994-N1034 PolarHBondContact SG-O 3Å; C994-C1035 WeakPolarHBondContact O-CA 3.21Å; C994-C1035 WeakPolarHBondContact O-CB 2.8Å; C994-C1035 PolarHBondContact O-N 3.02Å; C994-F1038 HydrophobicContact CB-CD2 3.53Å; C994-F1038 HydrophobicContact CB-CE2 3.43Å; C994-F1038 VanDerWaalsContact CB-CE2 3.43Å; C994-F1038 HydrophobicContact CB-CZ 4.43Å
995	G	92.4	Very high	91.6	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	11%	0.107	C	C	.	.	T	Hydrogen-bonded Turn	trans	86.6	-28.4	-172.7	0	0	0	0	0	115	E362 I993	E362-G995 WeakPolarHBondContact OE1-CA 3.45Å; E362-G995 PolarHBondContact OE1-N 3.37Å; I993-G995 PolarHBondContact O-N 2.76Å
996	L	93.9	Very high	91.7	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	12%	0.118	C	C	.	.			trans	-102	159.2	-177.7	-56.3	-176.7	0	0	0	112.2	R292 L990 I993 C994 K1000 L1004 V1031 C1035	R292-L996 PolarHBondContact NH1-O 2.7Å; R292-L996 PolarHBondContact NH2-O 3.02Å; L990-L996 HydrophobicContact CD1-CD1 3.8Å; L990-L996 HydrophobicContact CG-CD1 4.29Å; I993-L996 HydrophobicContact CB-CB 4.36Å; I993-L996 HydrophobicContact CB-CD1 4.11Å; I993-L996 HydrophobicContact CB-CG 4.4Å; I993-L996 HydrophobicContact CG2-CB 4.47Å; I993-L996 HydrophobicContact CG2-CD1 3.9Å; I993-L996 HydrophobicContact CG2-CG 4.06Å; I993-L996 PolarHBondContact O-N 2.76Å; I993-L996 VanDerWaalsContact O-O 3.09Å; C994-L996 VanDerWaalsContact C-N 3.28Å; C994-L996 PolarHBondContact O-N 3.32Å; L996-K1000 HydrophobicContact CD2-CB 4Å; L996-L1004 HydrophobicContact CD1-CD2 4.03Å; L996-V1031 HydrophobicContact CD2-CG1 3.85Å; L996-C1035 HydrophobicContact CG-CB 4.35Å
997	G	92.4	Very high	91.8	Very high	1 Å²	1	24.8 Å²	24.8	1%	0.01	13%	0.128	C	C	.	.			trans	-141	-166.3	165.7	0	0	0	0	0	110	E291 R999 G1001	E291-G997 VanDerWaalsContact CD-CA 3.43Å; E291-G997 WeakPolarHBondContact OE2-CA 3.44Å; E291-G997 PolarHBondContact OE2-N 2.82Å; G997-R999 VanDerWaalsContact C-N 3.35Å; G997-R999 PolarHBondContact O-N 2.71Å; G997-G1001 WeakPolarHBondContact O-CA 3.2Å; G997-G1001 PolarHBondContact O-N 3.45Å
998	P	91.5	Very high	91.7	Very high	30 Å²	30	23.3 Å²	23.3	20%	0.195	12%	0.12	C	C	.	.	H	α-helix	trans	-58.1	-43.6	-178.7	21.9	-33	0	0	0	112.5	E291 Q991 Q1002	E291-P998 VanDerWaalsContact OE1-CD 3.22Å; E291-P998 WeakPolarHBondContact OE1-CD 3.42Å; E291-P998 WeakPolarHBondContact OE1-CG 3.29Å; Q991-P998 HydrophobicContact CB-CB 4.41Å; P998-Q1002 VanDerWaalsContact O-CB 3.27Å; P998-Q1002 WeakPolarHBondContact O-CB 3.48Å; P998-Q1002 WeakPolarHBondContact O-CG 3.46Å; P998-Q1002 PolarHBondContact O-N 2.81Å
999	R	91.3	Very high	91.5	Very high	22 Å²	22	26.8 Å²	26.8	8%	0.083	13%	0.134	C	C	.	.	H	α-helix	trans	-67.5	-52.6	-179.5	-82.3	155.5	-74.5	-109.4	-19.8	112.7	H276 D281 R285 E291 G997 A1003	H276-R999 HydrophobicContact CB-CG 3.52Å; D281-R999 HydrophobicContact CB-CG 4.32Å; D281-R999 VanDerWaalsContact OD1-CD 3.3Å; D281-R999 WeakPolarHBondContact OD1-CD 3.46Å; D281-R999 IonicContact OD1-CZ 2.71Å; D281-R999 IonicContact OD1-NE 3.56Å; D281-R999 IonicContact OD1-NH1 3.2Å; D281-R999 PolarHBondContact OD1-NH1 3.39Å; R285-R999 HydrophobicContact CG-CB 3.74Å; R285-R999 HydrophobicContact CG-CG 4.39Å; E291-R999 WeakPolarHBondContact OE1-CB 3.34Å; E291-R999 IonicContact OE1-CZ 3.66Å; E291-R999 PolarHBondContact OE1-N 2.81Å; E291-R999 VanDerWaalsContact OE1-N 3.14Å; E291-R999 IonicContact OE1-NE 2.71Å; E291-R999 PolarHBondContact OE1-NE 3.42Å; E291-R999 IonicContact OE1-NH2 3.33Å; E291-R999 PolarHBondContact OE1-NH2 3.33Å; E291-R999 PolarHBondContact OE2-N 2.92Å; G997-R999 VanDerWaalsContact C-N 3.35Å; G997-R999 PolarHBondContact O-N 2.71Å; R999-A1003 WeakPolarHBondContact O-CB 3.4Å; R999-A1003 PolarHBondContact O-N 3.21Å
1000	K	93.1	Very high	91.2	Very high	15 Å²	15	32.1 Å²	32.1	7%	0.065	16%	0.159	C	C	.	.	H	α-helix	trans	-67.6	-37.3	-178.2	-68.9	-171.9	-178.9	-62.3	0	111.6	I284 R285 T287 I289 E291 L996 L1004 V1031	I284-K1000 VanDerWaalsContact O-CE 3.24Å; I284-K1000 WeakPolarHBondContact O-CE 3.27Å; I284-K1000 PolarHBondContact O-NZ 3.17Å; R285-K1000 PolarHBondContact O-NZ 3.4Å; T287-K1000 PolarHBondContact O-NZ 3.17Å; I289-K1000 VanDerWaalsContact O-CE 3.24Å; I289-K1000 WeakPolarHBondContact O-CE 3.39Å; E291-K1000 HydrophobicContact CB-CD 4.26Å; E291-K1000 HydrophobicContact CB-CG 4.49Å; E291-K1000 PolarHBondContact OE2-N 2.81Å; L996-K1000 HydrophobicContact CD2-CB 4Å; K1000-L1004 WeakPolarHBondContact O-CB 3.4Å; K1000-L1004 PolarHBondContact O-N 3.16Å; K1000-V1031 HydrophobicContact CD-CG1 4.5Å; K1000-V1031 HydrophobicContact CD-CG2 4.2Å
1001	G	91.7	Very high	90.7	Very high	2 Å²	2	33.8 Å²	33.8	2%	0.021	17%	0.171	C	C	.	.	H	α-helix	trans	-65	-48.7	176	0	0	0	0	0	112.9	L990 G997 A1003 L1004 L1005	L990-G1001 WeakPolarHBondContact CD2-O 3.4Å; G997-G1001 WeakPolarHBondContact O-CA 3.2Å; G997-G1001 PolarHBondContact O-N 3.45Å; G1001-A1003 VanDerWaalsContact C-N 3.34Å; G1001-A1003 PolarHBondContact O-N 3Å; G1001-L1004 PolarHBondContact O-N 2.76Å; G1001-L1005 WeakPolarHBondContact O-CB 3.12Å; G1001-L1005 PolarHBondContact O-N 2.71Å
1002	Q	89.2	Confident	90	Very high	110 Å²	110	38.6 Å²	38.6	51%	0.514	20%	0.198	S	C	.	.	H	α-helix	trans	-62.5	-39.5	176.5	-72.6	174.3	12.8	0	0	112.2	P998 L1005 K1006	P998-Q1002 VanDerWaalsContact O-CB 3.27Å; P998-Q1002 WeakPolarHBondContact O-CB 3.48Å; P998-Q1002 WeakPolarHBondContact O-CG 3.46Å; P998-Q1002 PolarHBondContact O-N 2.81Å; Q1002-L1005 PolarHBondContact O-N 3.1Å; Q1002-K1006 VanDerWaalsContact O-CB 3.23Å; Q1002-K1006 WeakPolarHBondContact O-CB 3.18Å; Q1002-K1006 PolarHBondContact O-N 3.06Å
1003	A	90.1	Very high	89	Confident	44 Å²	44	42.3 Å²	42.3	36%	0.364	22%	0.216	S	C	.	.	H	α-helix	trans	-61.8	-48.2	176.2	0	0	0	0	0	112.4	R999 G1001 L1005 K1006 L1007	R999-A1003 WeakPolarHBondContact O-CB 3.4Å; R999-A1003 PolarHBondContact O-N 3.21Å; G1001-A1003 VanDerWaalsContact C-N 3.34Å; G1001-A1003 PolarHBondContact O-N 3Å; A1003-L1005 PolarHBondContact O-N 2.83Å; A1003-K1006 PolarHBondContact O-N 3.34Å; A1003-L1007 WeakPolarHBondContact O-CB 3.31Å; A1003-L1007 PolarHBondContact O-N 2.92Å
1004	L	90.3	Very high	88.4	Confident	5 Å²	5	48.2 Å²	48.2	3%	0.026	24%	0.239	C	C	.	.	H	α-helix	trans	-57.5	-47.7	176	176.4	60.8	0	0	0	111.8	I977 L996 K1000 G1001 L1007 L1008 L1021 C1025 L1027	I977-L1004 HydrophobicContact CD1-CD2 3.97Å; L996-L1004 HydrophobicContact CD1-CD2 4.03Å; K1000-L1004 WeakPolarHBondContact O-CB 3.4Å; K1000-L1004 PolarHBondContact O-N 3.16Å; G1001-L1004 PolarHBondContact O-N 2.76Å; L1004-L1007 PolarHBondContact O-N 3.46Å; L1004-L1008 HydrophobicContact CD1-CD1 4.18Å; L1004-L1008 HydrophobicContact CG-CD1 4.34Å; L1004-L1008 WeakPolarHBondContact O-CG 3.3Å; L1004-L1008 PolarHBondContact O-N 3.28Å; L1004-L1021 HydrophobicContact CD1-CD2 4.24Å; L1004-C1025 HydrophobicContact CD1-CB 3.5Å; L1004-C1025 VanDerWaalsContact CD1-CB 3.5Å; L1004-L1027 HydrophobicContact CD2-CD1 4.42Å
1005	L	89.5	Confident	88.1	Confident	16 Å²	16	48.3 Å²	48.3	8%	0.084	24%	0.239	C	C	.	.	H	α-helix	trans	-66	-40.3	179.5	-178.3	66.7	0	0	0	112.4	V981 I987 L990 G1001 Q1002 A1003 L1008 K1009	V981-L1005 HydrophobicContact CG2-CD1 3.91Å; I987-L1005 HydrophobicContact CB-CD2 4.21Å; I987-L1005 HydrophobicContact CD1-CD2 3.77Å; I987-L1005 HydrophobicContact CG1-CD2 3.71Å; I987-L1005 HydrophobicContact CG2-CD2 3.53Å; L990-L1005 HydrophobicContact CD2-CB 4.01Å; G1001-L1005 WeakPolarHBondContact O-CB 3.12Å; G1001-L1005 PolarHBondContact O-N 2.71Å; Q1002-L1005 PolarHBondContact O-N 3.1Å; A1003-L1005 PolarHBondContact O-N 2.83Å; L1005-L1008 PolarHBondContact O-N 3.43Å; L1005-K1009 HydrophobicContact CG-CD 4.37Å; L1005-K1009 WeakPolarHBondContact O-CB 3.34Å; L1005-K1009 WeakPolarHBondContact O-CG 3.45Å; L1005-K1009 PolarHBondContact O-N 3.14Å
1006	K	88.6	Confident	87.8	Confident	78 Å²	78	50.9 Å²	50.9	34%	0.339	25%	0.251	S	S	.	.	H	α-helix	trans	-61.5	-45.5	177.3	-179.8	176	177.6	176	0	111.1	Y216 Q1002 A1003 L1008 K1009 Q1010	Y216-K1006 PolarHBondContact OH-NZ 3.46Å; Q1002-K1006 VanDerWaalsContact O-CB 3.23Å; Q1002-K1006 WeakPolarHBondContact O-CB 3.18Å; Q1002-K1006 PolarHBondContact O-N 3.06Å; A1003-K1006 PolarHBondContact O-N 3.34Å; K1006-L1008 PolarHBondContact O-N 2.94Å; K1006-K1009 PolarHBondContact O-N 3.31Å; K1006-Q1010 HydrophobicContact CG-CG 4.36Å; K1006-Q1010 WeakPolarHBondContact O-CB 3.33Å; K1006-Q1010 WeakPolarHBondContact O-CG 3.16Å; K1006-Q1010 PolarHBondContact O-N 2.95Å
1007	L	89.8	Confident	87.6	Confident	59 Å²	59	52.1 Å²	52.1	31%	0.309	26%	0.258	S	S	.	.	H	α-helix	trans	-62.8	-41.7	178.8	-179.1	57.3	0	0	0	112.4	A1003 L1004 Q1010 S1011 C1025	A1003-L1007 WeakPolarHBondContact O-CB 3.31Å; A1003-L1007 PolarHBondContact O-N 2.92Å; L1004-L1007 PolarHBondContact O-N 3.46Å; L1007-Q1010 PolarHBondContact O-N 2.79Å; L1007-S1011 VanDerWaalsContact O-CB 3.31Å; L1007-S1011 WeakPolarHBondContact O-CB 3.43Å; L1007-S1011 PolarHBondContact O-N 3.49Å; L1007-S1011 PolarHBondContact O-OG 3.07Å; L1007-C1025 HydrophobicContact CD2-CB 4.35Å
1008	L	87.9	Confident	87.5	Confident	5 Å²	5	52.2 Å²	52.2	3%	0.026	26%	0.258	C	S	.	.	H	α-helix	trans	-66.9	-41.2	175.9	-70.1	168.2	0	0	0	112	I977 V981 L1004 L1005 K1006 S1011 N1012	I977-L1008 HydrophobicContact CG2-CD1 3.36Å; V981-L1008 HydrophobicContact CG2-CB 3.95Å; V981-L1008 HydrophobicContact CG2-CD1 4.37Å; L1004-L1008 HydrophobicContact CD1-CD1 4.18Å; L1004-L1008 HydrophobicContact CG-CD1 4.34Å; L1004-L1008 WeakPolarHBondContact O-CG 3.3Å; L1004-L1008 PolarHBondContact O-N 3.28Å; L1005-L1008 PolarHBondContact O-N 3.43Å; K1006-L1008 PolarHBondContact O-N 2.94Å; L1008-S1011 PolarHBondContact O-OG 3.42Å; L1008-N1012 WeakPolarHBondContact O-CA 3.23Å; L1008-N1012 PolarHBondContact O-N 3.47Å
1009	K	87.5	Confident	87.4	Confident	104 Å²	104	54.8 Å²	54.8	45%	0.452	27%	0.273	S	S	.	.	H	α-helix	trans	-65.2	-41.6	174.2	-74.5	-175.3	175	-169.7	0	112.9	V981 L1005 K1006 N1012	V981-K1009 HydrophobicContact CG1-CG 4.26Å; L1005-K1009 HydrophobicContact CG-CD 4.37Å; L1005-K1009 WeakPolarHBondContact O-CB 3.34Å; L1005-K1009 WeakPolarHBondContact O-CG 3.45Å; L1005-K1009 PolarHBondContact O-N 3.14Å; K1006-K1009 PolarHBondContact O-N 3.31Å; K1009-N1012 PolarHBondContact O-N 3.27Å
1010	Q	86.6	Confident	87.3	Confident	113 Å²	113	55 Å²	55	53%	0.528	28%	0.275	S	S	.	.	H	α-helix	trans	-70.4	-40.8	179.8	-75.4	180	-52.8	0	0	112.8	K1006 L1007 N1012	K1006-Q1010 HydrophobicContact CG-CG 4.36Å; K1006-Q1010 WeakPolarHBondContact O-CB 3.33Å; K1006-Q1010 WeakPolarHBondContact O-CG 3.16Å; K1006-Q1010 PolarHBondContact O-N 2.95Å; L1007-Q1010 PolarHBondContact O-N 2.79Å; Q1010-N1012 VanDerWaalsContact C-N 3.31Å
1011	S	82.6	Confident	87.2	Confident	44 Å²	44	54.3 Å²	54.3	31%	0.308	27%	0.272	S	S	.	.	H	α-helix	trans	-74.3	-22.1	176.4	59.9	0	0	0	0	113.2	L1007 L1008 Q1013	L1007-S1011 VanDerWaalsContact O-CB 3.31Å; L1007-S1011 WeakPolarHBondContact O-CB 3.43Å; L1007-S1011 PolarHBondContact O-N 3.49Å; L1007-S1011 PolarHBondContact O-OG 3.07Å; L1008-S1011 PolarHBondContact O-OG 3.42Å; S1011-Q1013 PolarHBondContact O-N 3.43Å
1012	N	78.4	Confident	87.1	Confident	143 Å²	143	56.8 Å²	56.8	77%	0.765	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.3	32.3	-171.9	-165	26	0	0	0	112.8	L1008 K1009 Q1010	L1008-N1012 WeakPolarHBondContact O-CA 3.23Å; L1008-N1012 PolarHBondContact O-N 3.47Å; K1009-N1012 PolarHBondContact O-N 3.27Å; Q1010-N1012 VanDerWaalsContact C-N 3.31Å
1013	Q	73.9	Confident	87.1	Confident	98 Å²	98	56 Å²	56	46%	0.458	29%	0.289	S	S	.	.			trans	-93.7	139.1	175.6	-65.6	-179.4	20.6	0	0	109.6	S1011	S1011-Q1013 PolarHBondContact O-N 3.43Å
1014	R	82.6	Confident	86.9	Confident	123 Å²	123	55.9 Å²	55.9	46%	0.464	28%	0.284	S	S	.	.			trans	-83.6	144.2	165.1	-70	-177.4	172.1	-140.5	-11.3	108.4	N978 E1016	N978-R1014 WeakPolarHBondContact OD1-CA 3.48Å; R1014-E1016 PolarHBondContact O-N 2.93Å
1015	L	87.2	Confident	86.8	Confident	3 Å²	3	56 Å²	56	2%	0.016	29%	0.286	C	S	.	.			trans	-78.5	110.2	173.1	-164.9	73.8	0	0	0	108.2	N978 Q1020 L1021 I1039 I1041	N978-L1015 PolarHBondContact ND2-O 2.9Å; N978-L1015 PolarHBondContact OD1-N 2.97Å; L1015-Q1020 HydrophobicContact CD1-CB 3.58Å; L1015-L1021 HydrophobicContact CD1-CD2 4.09Å; L1015-L1021 HydrophobicContact CD1-CG 4.26Å; L1015-L1021 HydrophobicContact CD2-CD2 3.75Å; L1015-L1021 HydrophobicContact CD2-CG 4.02Å; L1015-I1039 HydrophobicContact CD2-CG2 4.36Å; L1015-I1041 HydrophobicContact CB-CD1 4.47Å; L1015-I1041 HydrophobicContact CD2-CD1 3.71Å; L1015-I1041 HydrophobicContact CD2-CG1 4.1Å; L1015-I1041 HydrophobicContact CG-CD1 3.82Å; L1015-I1041 WeakPolarHBondContact O-CG2 3.36Å
1016	E	86.5	Confident	86.7	Confident	54 Å²	54	62.5 Å²	62.5	25%	0.252	32%	0.315	S	S	.	.			trans	-88.8	-30.1	-175.6	-56.2	172.5	131.8	0	0	111.9	R1014 Q1020 L1046 T1050	R1014-E1016 PolarHBondContact O-N 2.93Å; E1016-Q1020 PolarHBondContact OE2-NE2 2.86Å; E1016-L1046 WeakPolarHBondContact O-CD1 3.42Å; E1016-T1050 VanDerWaalsContact CD-OG1 3.27Å; E1016-T1050 VanDerWaalsContact OE1-CB 3.22Å; E1016-T1050 WeakPolarHBondContact OE1-CB 3.49Å; E1016-T1050 PolarHBondContact OE1-OG1 3.25Å
1017	N	88.2	Confident	86.8	Confident	26 Å²	26	59.8 Å²	59.8	14%	0.139	30%	0.304	C	S	.	.	S	Bend	trans	-151.3	160.1	174	58.8	66.6	0	0	0	111.4	T1019 Q1020 D1058	N1017-T1019 PolarHBondContact O-N 3.26Å; N1017-T1019 VanDerWaalsContact OD1-CB 3.31Å; N1017-T1019 WeakPolarHBondContact OD1-CB 3.3Å; N1017-T1019 PolarHBondContact OD1-N 2.97Å; N1017-Q1020 WeakPolarHBondContact O-CB 3.34Å; N1017-Q1020 PolarHBondContact O-N 3.32Å; N1017-Q1020 PolarHBondContact OD1-N 3.19Å; N1017-D1058 WeakPolarHBondContact CA-OD2 3.49Å; N1017-D1058 VanDerWaalsContact CB-OD2 3.29Å; N1017-D1058 WeakPolarHBondContact CB-OD2 3.45Å
1018	R	91.1	Very high	86.9	Confident	2 Å²	2	58 Å²	58	1%	0.008	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-29.9	-178.6	-75.4	177.4	176.1	156.3	-9.3	112.5	Q1020 L1021 F1032 S1036 I1039 I1041 L1057 D1058 S1060 V1062 Y1067 Y1136	R1018-Q1020 PolarHBondContact O-N 2.93Å; R1018-L1021 WeakPolarHBondContact O-CB 3.39Å; R1018-L1021 WeakPolarHBondContact O-CG 3.36Å; R1018-L1021 PolarHBondContact O-N 3.01Å; R1018-F1032 WeakPolarHBondContact O-CE2 3.38Å; R1018-S1036 WeakPolarHBondContact CD-O 3.4Å; R1018-S1036 PolarHBondContact NE-O 2.95Å; R1018-I1039 VanDerWaalsContact CZ-O 3.25Å; R1018-I1039 PolarHBondContact NE-O 2.99Å; R1018-I1039 PolarHBondContact NH2-O 3.23Å; R1018-I1041 HydrophobicContact CG-CD1 4.09Å; R1018-L1057 PolarHBondContact NH1-O 2.87Å; R1018-D1058 WeakPolarHBondContact CD-OD1 3.24Å; R1018-D1058 HydrophobicContact CG-CB 4.17Å; R1018-D1058 WeakPolarHBondContact CG-OD1 3.48Å; R1018-D1058 PolarHBondContact N-OD2 3.27Å; R1018-S1060 PolarHBondContact NH1-O 2.79Å; R1018-S1060 PolarHBondContact NH2-O 3.42Å; R1018-V1062 PolarHBondContact NH1-O 2.59Å; R1018-Y1067 WeakPolarHBondContact CD-OH 3.3Å; R1018-Y1067 PolarHBondContact NH1-OH 3.16Å; R1018-Y1136 PolarHBondContact NH2-OH 3.13Å
1019	T	88.3	Confident	87.1	Confident	85 Å²	85	61.9 Å²	61.9	52%	0.521	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-29	179.4	-48.4	0	0	0	0	112.7	N1017 L1021 V1022 T1023	N1017-T1019 PolarHBondContact O-N 3.26Å; N1017-T1019 VanDerWaalsContact OD1-CB 3.31Å; N1017-T1019 WeakPolarHBondContact OD1-CB 3.3Å; N1017-T1019 PolarHBondContact OD1-N 2.97Å; T1019-L1021 PolarHBondContact O-N 3.37Å; T1019-V1022 PolarHBondContact O-N 3.4Å; T1019-T1023 HydrophobicContact CG2-CG2 4.33Å; T1019-T1023 PolarHBondContact O-N 3.18Å; T1019-T1023 VanDerWaalsContact O-N 3.14Å; T1019-T1023 PolarHBondContact O-OG1 2.98Å
1020	Q	90.1	Very high	87.4	Confident	26 Å²	26	61.3 Å²	61.3	12%	0.121	32%	0.321	C	S	.	.	H	α-helix	trans	-62.8	-19.6	174	-72.4	171	-13	0	0	113.6	L1015 E1016 N1017 R1018 V1022 T1023 V1024 C1025	L1015-Q1020 HydrophobicContact CD1-CB 3.58Å; E1016-Q1020 PolarHBondContact OE2-NE2 2.86Å; N1017-Q1020 WeakPolarHBondContact O-CB 3.34Å; N1017-Q1020 PolarHBondContact O-N 3.32Å; N1017-Q1020 PolarHBondContact OD1-N 3.19Å; R1018-Q1020 PolarHBondContact O-N 2.93Å; Q1020-V1022 PolarHBondContact O-N 3.23Å; Q1020-T1023 WeakPolarHBondContact CA-OG1 3.31Å; Q1020-T1023 PolarHBondContact O-N 3Å; Q1020-V1024 HydrophobicContact CB-CB 4.32Å; Q1020-V1024 HydrophobicContact CB-CG2 4Å; Q1020-V1024 HydrophobicContact CG-CG2 3.98Å; Q1020-V1024 WeakPolarHBondContact O-CA 3.28Å; Q1020-V1024 WeakPolarHBondContact O-CB 3.43Å; Q1020-V1024 PolarHBondContact O-N 2.97Å; Q1020-C1025 PolarHBondContact O-N 2.92Å
1021	L	90.5	Very high	87.8	Confident	0 Å²	0	56.1 Å²	56.1	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-60.8	-30.1	170.7	-64.9	171.1	0	0	0	112.4	I977 L1004 L1015 R1018 T1019 C1025 H1026 L1027 F1032 I1039	I977-L1021 HydrophobicContact CD1-CD2 4.3Å; L1004-L1021 HydrophobicContact CD1-CD2 4.24Å; L1015-L1021 HydrophobicContact CD1-CD2 4.09Å; L1015-L1021 HydrophobicContact CD1-CG 4.26Å; L1015-L1021 HydrophobicContact CD2-CD2 3.75Å; L1015-L1021 HydrophobicContact CD2-CG 4.02Å; R1018-L1021 WeakPolarHBondContact O-CB 3.39Å; R1018-L1021 WeakPolarHBondContact O-CG 3.36Å; R1018-L1021 PolarHBondContact O-N 3.01Å; T1019-L1021 PolarHBondContact O-N 3.37Å; L1021-C1025 CarbonylContact O-C 3.43Å; L1021-C1025 WeakPolarHBondContact O-CB 3.32Å; L1021-H1026 PolarHBondContact O-N 2.71Å; L1021-L1027 HydrophobicContact CB-CD1 4.23Å; L1021-L1027 HydrophobicContact CD2-CD1 4.45Å; L1021-L1027 WeakPolarHBondContact O-CB 3.29Å; L1021-L1027 WeakPolarHBondContact O-CG 3.41Å; L1021-L1027 PolarHBondContact O-N 2.78Å; L1021-F1032 HydrophobicContact CB-CD2 3.97Å; L1021-F1032 HydrophobicContact CB-CE2 4.13Å; L1021-F1032 HydrophobicContact CD1-CD2 4.34Å; L1021-F1032 HydrophobicContact CD1-CE2 4.21Å; L1021-I1039 HydrophobicContact CD1-CD1 3.61Å; L1021-I1039 HydrophobicContact CD1-CG2 4.35Å; L1021-I1039 HydrophobicContact CD2-CD1 4.36Å
1022	V	91	Very high	88.4	Confident	54 Å²	54	55.5 Å²	55.5	33%	0.327	29%	0.288	S	S	.	.	H	α-helix	trans	-89.9	-49.2	175.1	-175.6	0	0	0	0	110.5	T1019 Q1020 H1026 F1032	T1019-V1022 PolarHBondContact O-N 3.4Å; Q1020-V1022 PolarHBondContact O-N 3.23Å; V1022-H1026 WeakPolarHBondContact O-CA 3.26Å; V1022-H1026 PolarHBondContact O-N 2.67Å; V1022-F1032 HydrophobicContact CG2-CB 3.96Å; V1022-F1032 HydrophobicContact CG2-CD1 3.9Å; V1022-F1032 HydrophobicContact CG2-CD2 3.52Å; V1022-F1032 HydrophobicContact CG2-CE1 4.29Å; V1022-F1032 HydrophobicContact CG2-CE2 3.95Å; V1022-F1032 HydrophobicContact CG2-CG 3.49Å; V1022-F1032 VanDerWaalsContact CG2-CG 3.49Å; V1022-F1032 HydrophobicContact CG2-CZ 4.31Å
1023	T	88.6	Confident	89.2	Confident	93 Å²	93	51.2 Å²	51.2	57%	0.571	27%	0.265	S	S	*	.	H	α-helix	trans	-82	-21.7	-169.8	61.5	0	0	0	0	115	T1019 Q1020	T1019-T1023 HydrophobicContact CG2-CG2 4.33Å; T1019-T1023 PolarHBondContact O-N 3.18Å; T1019-T1023 VanDerWaalsContact O-N 3.14Å; T1019-T1023 PolarHBondContact O-OG1 2.98Å; Q1020-T1023 WeakPolarHBondContact CA-OG1 3.31Å; Q1020-T1023 PolarHBondContact O-N 3Å
1024	V	86.3	Confident	90.2	Very high	42 Å²	42	46.6 Å²	46.6	26%	0.255	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-116.7	-41.6	179.2	-177.5	0	0	0	0	111.2	Q1020	Q1020-V1024 HydrophobicContact CB-CB 4.32Å; Q1020-V1024 HydrophobicContact CB-CG2 4Å; Q1020-V1024 HydrophobicContact CG-CG2 3.98Å; Q1020-V1024 WeakPolarHBondContact O-CA 3.28Å; Q1020-V1024 WeakPolarHBondContact O-CB 3.43Å; Q1020-V1024 PolarHBondContact O-N 2.97Å
1025	C	87.2	Confident	90.8	Very high	9 Å²	9	40.7 Å²	40.7	6%	0.061	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.8	0.2	-178.5	-50.7	0	0	0	0	114.6	L1004 L1007 Q1020 L1021 L1027	L1004-C1025 HydrophobicContact CD1-CB 3.5Å; L1004-C1025 VanDerWaalsContact CD1-CB 3.5Å; L1007-C1025 HydrophobicContact CD2-CB 4.35Å; Q1020-C1025 PolarHBondContact O-N 2.92Å; L1021-C1025 CarbonylContact O-C 3.43Å; L1021-C1025 WeakPolarHBondContact O-CB 3.32Å; C1025-L1027 PolarHBondContact O-N 2.83Å; C1025-L1027 VanDerWaalsContact O-N 3.1Å
1026	H	87.8	Confident	91.1	Very high	152 Å²	152	40.6 Å²	40.6	70%	0.704	22%	0.22	S	C	*	.			trans	53	28.4	176.9	-53.4	-64.9	0	0	0	114.9	L1021 V1022 G1028	L1021-H1026 PolarHBondContact O-N 2.71Å; V1022-H1026 WeakPolarHBondContact O-CA 3.26Å; V1022-H1026 PolarHBondContact O-N 2.67Å; H1026-G1028 PolarHBondContact O-N 3.12Å
1027	L	89.9	Confident	91.4	Very high	21 Å²	21	38 Å²	38	11%	0.11	21%	0.209	C	C	.	.			trans	-69.8	128.6	172.2	-62.1	-171.9	0	0	0	109.9	L1004 L1021 C1025 V1031	L1004-L1027 HydrophobicContact CD2-CD1 4.42Å; L1021-L1027 HydrophobicContact CB-CD1 4.23Å; L1021-L1027 HydrophobicContact CD2-CD1 4.45Å; L1021-L1027 WeakPolarHBondContact O-CB 3.29Å; L1021-L1027 WeakPolarHBondContact O-CG 3.41Å; L1021-L1027 PolarHBondContact O-N 2.78Å; C1025-L1027 PolarHBondContact O-N 2.83Å; C1025-L1027 VanDerWaalsContact O-N 3.1Å; L1027-V1031 HydrophobicContact CD1-CG1 4.41Å; L1027-V1031 HydrophobicContact CD2-CG1 4.37Å
1028	G	91.7	Very high	91.7	Very high	21 Å²	21	36.9 Å²	36.9	22%	0.216	20%	0.203	C	C	.	.			trans	-66.8	159.4	177	0	0	0	0	0	113	D288 H1026 R1030 V1031 F1032	D288-G1028 VanDerWaalsContact CG-C 3.47Å; D288-G1028 VanDerWaalsContact CG-CA 3.46Å; D288-G1028 VanDerWaalsContact OD1-CA 3.3Å; D288-G1028 WeakPolarHBondContact OD1-CA 3.33Å; H1026-G1028 PolarHBondContact O-N 3.12Å; G1028-R1030 VanDerWaalsContact C-N 3.33Å; G1028-R1030 PolarHBondContact O-N 2.78Å; G1028-V1031 PolarHBondContact O-N 2.81Å; G1028-F1032 WeakPolarHBondContact O-CB 3.4Å; G1028-F1032 PolarHBondContact O-N 2.86Å
1029	P	93.3	Very high	91.8	Very high	86 Å²	86	36.9 Å²	36.9	56%	0.558	20%	0.202	S	C	*	.	H	α-helix	trans	-53.9	-39.5	-175.6	-29	36.2	0	0	0	115.4	D288 I1033	D288-P1029 VanDerWaalsContact OD2-CD 3.26Å; D288-P1029 WeakPolarHBondContact OD2-CD 3.42Å; D288-P1029 VanDerWaalsContact OD2-N 3.11Å; P1029-I1033 WeakPolarHBondContact O-CB 3.33Å; P1029-I1033 WeakPolarHBondContact O-CD1 3.48Å; P1029-I1033 VanDerWaalsContact O-CG1 3.25Å; P1029-I1033 WeakPolarHBondContact O-CG1 3.42Å; P1029-I1033 PolarHBondContact O-N 3.2Å
1030	R	93.3	Very high	91.9	Very high	93 Å²	93	35.4 Å²	35.4	35%	0.351	19%	0.189	S	C	.	.	H	α-helix	trans	-69.3	-46.4	-179.2	-60.3	-66.1	-176.7	176.3	-2.6	111.1	D288 Q359 G1028 N1034	D288-R1030 WeakPolarHBondContact O-CB 3.34Å; D288-R1030 PolarHBondContact OD1-N 2.93Å; D288-R1030 WeakPolarHBondContact OD2-CB 3.11Å; D288-R1030 WeakPolarHBondContact OD2-CG 3.26Å; D288-R1030 PolarHBondContact OD2-N 2.7Å; Q359-R1030 PolarHBondContact O-NH1 2.97Å; G1028-R1030 VanDerWaalsContact C-N 3.33Å; G1028-R1030 PolarHBondContact O-N 2.78Å; R1030-N1034 PolarHBondContact O-N 3.19Å; R1030-N1034 PolarHBondContact O-ND2 3.4Å
1031	V	94.6	Very high	91.9	Very high	3 Å²	3	34.2 Å²	34.2	2%	0.018	18%	0.183	C	C	.	.	H	α-helix	trans	-64.2	-41.8	176.1	174.3	0	0	0	0	110.7	D288 L996 K1000 L1027 G1028 N1034 C1035	D288-V1031 WeakPolarHBondContact OD1-CG2 3.42Å; D288-V1031 PolarHBondContact OD1-N 3.44Å; L996-V1031 HydrophobicContact CD2-CG1 3.85Å; K1000-V1031 HydrophobicContact CD-CG1 4.5Å; K1000-V1031 HydrophobicContact CD-CG2 4.2Å; L1027-V1031 HydrophobicContact CD1-CG1 4.41Å; L1027-V1031 HydrophobicContact CD2-CG1 4.37Å; G1028-V1031 PolarHBondContact O-N 2.81Å; V1031-N1034 PolarHBondContact O-N 3.36Å; V1031-C1035 PolarHBondContact O-N 2.82Å; V1031-C1035 PolarHBondContact O-SG 3.46Å
1032	F	95.3	Very high	91.7	Very high	32 Å²	32	36.6 Å²	36.6	14%	0.14	20%	0.196	C	C	.	.	H	α-helix	trans	-62.3	-45.3	178.4	174.6	-104.2	0	0	0	113.6	R1018 L1021 V1022 G1028 N1034 C1035 S1036 P1064	R1018-F1032 WeakPolarHBondContact O-CE2 3.38Å; L1021-F1032 HydrophobicContact CB-CD2 3.97Å; L1021-F1032 HydrophobicContact CB-CE2 4.13Å; L1021-F1032 HydrophobicContact CD1-CD2 4.34Å; L1021-F1032 HydrophobicContact CD1-CE2 4.21Å; V1022-F1032 HydrophobicContact CG2-CB 3.96Å; V1022-F1032 HydrophobicContact CG2-CD1 3.9Å; V1022-F1032 HydrophobicContact CG2-CD2 3.52Å; V1022-F1032 HydrophobicContact CG2-CE1 4.29Å; V1022-F1032 HydrophobicContact CG2-CE2 3.95Å; V1022-F1032 HydrophobicContact CG2-CG 3.49Å; V1022-F1032 VanDerWaalsContact CG2-CG 3.49Å; V1022-F1032 HydrophobicContact CG2-CZ 4.31Å; G1028-F1032 WeakPolarHBondContact O-CB 3.4Å; G1028-F1032 PolarHBondContact O-N 2.86Å; F1032-N1034 VanDerWaalsContact C-N 3.3Å; F1032-N1034 PolarHBondContact O-N 2.69Å; F1032-C1035 PolarHBondContact O-N 3.48Å; F1032-S1036 WeakPolarHBondContact O-CB 3.42Å; F1032-S1036 PolarHBondContact O-N 2.91Å; F1032-S1036 PolarHBondContact O-OG 2.73Å; F1032-P1064 HydrophobicContact CZ-CG 4.33Å
1033	I	95.1	Very high	91.3	Very high	53 Å²	53	35 Å²	35	27%	0.272	19%	0.187	S	C	.	.	H	α-helix	trans	-59.8	-44.5	175	-70.8	164.8	0	0	0	109.9	L361 F365 P1029 C1035 H1063	L361-I1033 HydrophobicContact CD2-CG2 3.76Å; F365-I1033 HydrophobicContact CD2-CG2 4.32Å; F365-I1033 VanDerWaalsContact CD2-O 3.24Å; F365-I1033 WeakPolarHBondContact CD2-O 3.45Å; F365-I1033 HydrophobicContact CE1-CG2 4.39Å; F365-I1033 HydrophobicContact CE2-CG2 3.64Å; F365-I1033 WeakPolarHBondContact CE2-O 3.35Å; F365-I1033 HydrophobicContact CZ-CG2 3.68Å; P1029-I1033 WeakPolarHBondContact O-CB 3.33Å; P1029-I1033 WeakPolarHBondContact O-CD1 3.48Å; P1029-I1033 VanDerWaalsContact O-CG1 3.25Å; P1029-I1033 WeakPolarHBondContact O-CG1 3.42Å; P1029-I1033 PolarHBondContact O-N 3.2Å; I1033-C1035 PolarHBondContact O-N 3.27Å; I1033-H1063 PolarHBondContact O-NE2 3.46Å
1034	N	95.1	Very high	90.8	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-65.4	-36.3	179.9	-82.7	-83	0	0	0	113.7	Q360 L361 E362 C994 R1030 V1031 F1032 F1038	Q360-N1034 PolarHBondContact O-ND2 3.36Å; L361-N1034 WeakPolarHBondContact CA-OD1 3.48Å; E362-N1034 PolarHBondContact N-OD1 3.48Å; C994-N1034 VanDerWaalsContact CB-O 3.31Å; C994-N1034 WeakPolarHBondContact CB-O 3.36Å; C994-N1034 CarbonylContact O-C 3.59Å; C994-N1034 PolarHBondContact SG-O 3Å; R1030-N1034 PolarHBondContact O-N 3.19Å; R1030-N1034 PolarHBondContact O-ND2 3.4Å; V1031-N1034 PolarHBondContact O-N 3.36Å; F1032-N1034 VanDerWaalsContact C-N 3.3Å; F1032-N1034 PolarHBondContact O-N 2.69Å; N1034-F1038 VanDerWaalsContact O-CD2 3.3Å; N1034-F1038 WeakPolarHBondContact O-CD2 3.49Å; N1034-F1038 WeakPolarHBondContact O-CE2 3.46Å
1035	C	94.9	Very high	90.2	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-96.5	-32.7	-171.2	74.5	0	0	0	0	115.3	I993 C994 L996 V1031 F1032 I1033 G1037 F1038 I1039	I993-C1035 HydrophobicContact CG2-CB 3.81Å; C994-C1035 WeakPolarHBondContact O-CA 3.21Å; C994-C1035 WeakPolarHBondContact O-CB 2.8Å; C994-C1035 PolarHBondContact O-N 3.02Å; L996-C1035 HydrophobicContact CG-CB 4.35Å; V1031-C1035 PolarHBondContact O-N 2.82Å; V1031-C1035 PolarHBondContact O-SG 3.46Å; F1032-C1035 PolarHBondContact O-N 3.48Å; I1033-C1035 PolarHBondContact O-N 3.27Å; C1035-G1037 PolarHBondContact O-N 3.36Å; C1035-F1038 PolarHBondContact O-N 3.45Å; C1035-I1039 HydrophobicContact CB-CD1 4.01Å; C1035-I1039 PolarHBondContact O-N 3.06Å
1036	S	94.1	Very high	89.7	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	20%	0.2	C	C	.	.	G	3₁₀ helix	trans	-62.2	-42.3	-159.4	58.8	0	0	0	0	114.5	R1018 F1032 F1038 I1039 H1063	R1018-S1036 WeakPolarHBondContact CD-O 3.4Å; R1018-S1036 PolarHBondContact NE-O 2.95Å; F1032-S1036 WeakPolarHBondContact O-CB 3.42Å; F1032-S1036 PolarHBondContact O-N 2.91Å; F1032-S1036 PolarHBondContact O-OG 2.73Å; S1036-F1038 PolarHBondContact O-N 2.94Å; S1036-I1039 PolarHBondContact O-N 2.95Å; S1036-I1039 VanDerWaalsContact O-N 3.17Å; S1036-H1063 PolarHBondContact OG-NE2 2.93Å; S1036-H1063 VanDerWaalsContact OG-NE2 3.08Å
1037	G	92.1	Very high	88.5	Confident	1 Å²	1	31.5 Å²	31.5	1%	0.01	19%	0.193	C	C	.	.	G	3₁₀ helix	trans	-67.3	-13.3	176.6	0	0	0	0	0	115.2	Y369 C1035 Y1136	Y369-G1037 VanDerWaalsContact OH-C 3.3Å; Y369-G1037 PolarHBondContact OH-O 2.88Å; Y369-G1037 VanDerWaalsContact OH-O 3.09Å; C1035-G1037 PolarHBondContact O-N 3.36Å; G1037-Y1136 PolarHBondContact O-OH 2.86Å
1038	F	94.9	Very high	87.2	Confident	2 Å²	2	39.1 Å²	39.1	1%	0.009	23%	0.234	C	C	.	.	G	3₁₀ helix	trans	-97.8	-11	176.3	-54.8	-63.3	0	0	0	113	P364 F368 Y369 S971 G974 L975 I993 C994 N1034 C1035 S1036	P364-F1038 HydrophobicContact CB-CE2 4.48Å; P364-F1038 HydrophobicContact CB-CZ 4.17Å; F368-F1038 HydrophobicContact CB-CE1 3.99Å; F368-F1038 HydrophobicContact CB-CZ 4.01Å; F368-F1038 AromaticContact CD2-CE1 3.87Å; F368-F1038 HydrophobicContact CD2-CE1 3.87Å; F368-F1038 HydrophobicContact CD2-CZ 4.12Å; F368-F1038 AromaticContact CG-CE1 3.88Å; F368-F1038 HydrophobicContact CG-CE1 3.88Å; F368-F1038 HydrophobicContact CG-CZ 4.25Å; Y369-F1038 HydrophobicContact CD2-CZ 4.23Å; Y369-F1038 HydrophobicContact CE2-CD1 4.5Å; Y369-F1038 HydrophobicContact CE2-CD2 4.49Å; Y369-F1038 AromaticContact CE2-CE1 3.82Å; Y369-F1038 HydrophobicContact CE2-CE1 3.82Å; Y369-F1038 AromaticContact CE2-CE2 3.8Å; Y369-F1038 HydrophobicContact CE2-CE2 3.8Å; Y369-F1038 AromaticContact CE2-CZ 3.44Å; Y369-F1038 HydrophobicContact CE2-CZ 3.44Å; Y369-F1038 VanDerWaalsContact CE2-CZ 3.44Å; S971-F1038 WeakPolarHBondContact O-CD1 3.27Å; S971-F1038 WeakPolarHBondContact O-CE1 3.33Å; G974-F1038 VanDerWaalsContact CA-O 3.3Å; G974-F1038 WeakPolarHBondContact CA-O 3.48Å; L975-F1038 PolarHBondContact N-O 3.08Å; I993-F1038 HydrophobicContact CD1-CB 3.89Å; C994-F1038 HydrophobicContact CB-CD2 3.53Å; C994-F1038 HydrophobicContact CB-CE2 3.43Å; C994-F1038 VanDerWaalsContact CB-CE2 3.43Å; C994-F1038 HydrophobicContact CB-CZ 4.43Å; N1034-F1038 VanDerWaalsContact O-CD2 3.3Å; N1034-F1038 WeakPolarHBondContact O-CD2 3.49Å; N1034-F1038 WeakPolarHBondContact O-CE2 3.46Å; C1035-F1038 PolarHBondContact O-N 3.45Å; S1036-F1038 PolarHBondContact O-N 2.94Å
1039	I	93.4	Very high	86	Confident	1 Å²	1	42 Å²	42	1%	0.005	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	111.7	174.2	-67.7	165.3	0	0	0	108.3	L975 I977 L1015 R1018 L1021 C1035 S1036	L975-I1039 CarbonylContact O-C 3.55Å; L975-I1039 WeakPolarHBondContact O-CA 3.48Å; I977-I1039 HydrophobicContact CB-CG2 4.5Å; I977-I1039 HydrophobicContact CD1-CB 4.41Å; I977-I1039 HydrophobicContact CD1-CD1 3.76Å; I977-I1039 HydrophobicContact CD1-CG1 3.88Å; I977-I1039 HydrophobicContact CD1-CG2 3.64Å; I977-I1039 HydrophobicContact CG1-CG1 4.49Å; I977-I1039 HydrophobicContact CG1-CG2 3.94Å; L1015-I1039 HydrophobicContact CD2-CG2 4.36Å; R1018-I1039 VanDerWaalsContact CZ-O 3.25Å; R1018-I1039 PolarHBondContact NE-O 2.99Å; R1018-I1039 PolarHBondContact NH2-O 3.23Å; L1021-I1039 HydrophobicContact CD1-CD1 3.61Å; L1021-I1039 HydrophobicContact CD1-CG2 4.35Å; L1021-I1039 HydrophobicContact CD2-CD1 4.36Å; C1035-I1039 HydrophobicContact CB-CD1 4.01Å; C1035-I1039 PolarHBondContact O-N 3.06Å; S1036-I1039 PolarHBondContact O-N 2.95Å; S1036-I1039 VanDerWaalsContact O-N 3.17Å
1040	K	91	Very high	84.8	Confident	55 Å²	55	39.3 Å²	39.3	24%	0.239	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	146.9	169.9	-179.2	-179.9	177.9	-148.2	0	109.9	L975 D976 D1042 Y1136	L975-K1040 PolarHBondContact O-N 2.99Å; D976-K1040 WeakPolarHBondContact CA-O 3.38Å; D976-K1040 HydrophobicContact CB-CB 4.25Å; D976-K1040 HydrophobicContact CB-CG 4.47Å; K1040-D1042 IonicContact NZ-OD2 2.77Å; K1040-Y1136 HydrophobicContact CB-CD2 3.84Å; K1040-Y1136 HydrophobicContact CB-CE1 4.33Å; K1040-Y1136 HydrophobicContact CB-CE2 3.45Å; K1040-Y1136 VanDerWaalsContact CB-CE2 3.45Å; K1040-Y1136 HydrophobicContact CB-CG 4.46Å; K1040-Y1136 HydrophobicContact CD-CD2 3.73Å; K1040-Y1136 HydrophobicContact CD-CE2 4.26Å; K1040-Y1136 HydrophobicContact CD-CG 4.04Å; K1040-Y1136 HydrophobicContact CG-CD2 3.54Å; K1040-Y1136 HydrophobicContact CG-CE2 3.6Å; K1040-Y1136 HydrophobicContact CG-CG 4.27Å
1041	I	90.4	Very high	83.6	Confident	0 Å²	0	45 Å²	45	0%	0	26%	0.263	C	S	.	.			trans	-123.7	122.9	158	-58.9	176.2	0	0	0	107.7	L1015 R1018 T1043 L1046 D1058 G1059	L1015-I1041 HydrophobicContact CB-CD1 4.47Å; L1015-I1041 HydrophobicContact CD2-CD1 3.71Å; L1015-I1041 HydrophobicContact CD2-CG1 4.1Å; L1015-I1041 HydrophobicContact CG-CD1 3.82Å; L1015-I1041 WeakPolarHBondContact O-CG2 3.36Å; R1018-I1041 HydrophobicContact CG-CD1 4.09Å; I1041-T1043 VanDerWaalsContact C-N 3.33Å; I1041-T1043 PolarHBondContact O-N 2.81Å; I1041-L1046 HydrophobicContact CG2-CD1 3.52Å; I1041-D1058 HydrophobicContact CB-CB 4.19Å; I1041-D1058 HydrophobicContact CD1-CB 4.31Å; I1041-D1058 PolarHBondContact N-O 2.55Å; I1041-D1058 VanDerWaalsContact N-O 3.09Å; I1041-G1059 WeakPolarHBondContact O-CA 3.07Å
1042	D	85	Confident	82.4	Confident	51 Å²	51	46.6 Å²	46.6	27%	0.273	28%	0.277	S	S	.	.			trans	-72.5	86.2	173.2	-163.6	-17.1	0	0	0	112.1	D976 K1040 S1044 S1045	D976-D1042 WeakPolarHBondContact OD2-CB 3.13Å; D976-D1042 PolarHBondContact OD2-N 2.9Å; K1040-D1042 IonicContact NZ-OD2 2.77Å; D1042-S1044 PolarHBondContact O-N 2.86Å; D1042-S1044 WeakPolarHBondContact OD1-CB 3.3Å; D1042-S1044 PolarHBondContact OD1-N 3.29Å; D1042-S1044 VanDerWaalsContact OD1-N 3.16Å; D1042-S1044 PolarHBondContact OD1-OG 2.89Å; D1042-S1045 WeakPolarHBondContact O-CB 3.22Å; D1042-S1045 PolarHBondContact O-N 3.41Å; D1042-S1045 PolarHBondContact O-OG 2.94Å
1043	T	82.6	Confident	81.4	Confident	21 Å²	21	51.2 Å²	51.2	13%	0.129	29%	0.294	C	S	.	.	G	3₁₀ helix	trans	-57.5	-28.2	177.4	53.4	0	0	0	0	113.4	I1041 S1045 L1046 G1047 V1054 D1058	I1041-T1043 VanDerWaalsContact C-N 3.33Å; I1041-T1043 PolarHBondContact O-N 2.81Å; T1043-S1045 PolarHBondContact O-N 2.7Å; T1043-L1046 PolarHBondContact O-N 2.87Å; T1043-L1046 VanDerWaalsContact O-N 3.09Å; T1043-G1047 PolarHBondContact O-N 2.88Å; T1043-V1054 HydrophobicContact CG2-CG1 3.64Å; T1043-D1058 HydrophobicContact CG2-CB 4.44Å
1044	S	78.1	Confident	80.6	Confident	105 Å²	105	50.2 Å²	50.2	73%	0.734	29%	0.291	S	S	*	.	G	3₁₀ helix	trans	-67.1	-22.2	175.3	80.7	0	0	0	0	113.2	D1042	D1042-S1044 PolarHBondContact O-N 2.86Å; D1042-S1044 WeakPolarHBondContact OD1-CB 3.3Å; D1042-S1044 PolarHBondContact OD1-N 3.29Å; D1042-S1044 VanDerWaalsContact OD1-N 3.16Å; D1042-S1044 PolarHBondContact OD1-OG 2.89Å
1045	S	75	Confident	80.2	Confident	58 Å²	58	50.9 Å²	50.9	41%	0.406	29%	0.294	S	S	.	.	G	3₁₀ helix	trans	-86.1	-11.4	174.2	78.7	0	0	0	0	114	D1042 T1043	D1042-S1045 WeakPolarHBondContact O-CB 3.22Å; D1042-S1045 PolarHBondContact O-N 3.41Å; D1042-S1045 PolarHBondContact O-OG 2.94Å; T1043-S1045 PolarHBondContact O-N 2.7Å
1046	L	76.2	Confident	79.8	Confident	3 Å²	3	52.1 Å²	52.1	2%	0.016	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.3	-29.9	-172.8	-71.1	174.1	0	0	0	114.3	E1016 I1041 T1043 D1048 S1049 V1054	E1016-L1046 WeakPolarHBondContact O-CD1 3.42Å; I1041-L1046 HydrophobicContact CG2-CD1 3.52Å; T1043-L1046 PolarHBondContact O-N 2.87Å; T1043-L1046 VanDerWaalsContact O-N 3.09Å; L1046-D1048 VanDerWaalsContact C-N 3.33Å; L1046-D1048 PolarHBondContact O-N 2.72Å; L1046-D1048 VanDerWaalsContact O-N 3.11Å; L1046-S1049 WeakPolarHBondContact CA-OG 3.47Å; L1046-S1049 WeakPolarHBondContact O-CA 3.32Å; L1046-S1049 PolarHBondContact O-N 2.95Å; L1046-S1049 PolarHBondContact O-OG 3.4Å; L1046-V1054 HydrophobicContact CB-CG2 4.25Å
1047	G	61.9	Low	79.7	Confident	55 Å²	55	52.2 Å²	52.2	57%	0.567	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.9	-34.9	-163.4	0	0	0	0	0	117.4	T1043	T1043-G1047 PolarHBondContact O-N 2.88Å
1048	D	63.7	Low	79.6	Confident	182 Å²	182	52.3 Å²	52.3	97%	0.973	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.3	-2.2	177.3	-75	-30.3	0	0	0	113.8	L1046	L1046-D1048 VanDerWaalsContact C-N 3.33Å; L1046-D1048 PolarHBondContact O-N 2.72Å; L1046-D1048 VanDerWaalsContact O-N 3.11Å
1049	S	66.9	Low	79.4	Confident	80 Å²	80	52.4 Å²	52.4	56%	0.559	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120.5	-10.7	-159.2	73.6	0	0	0	0	116.4	L1046	L1046-S1049 WeakPolarHBondContact CA-OG 3.47Å; L1046-S1049 WeakPolarHBondContact O-CA 3.32Å; L1046-S1049 PolarHBondContact O-N 2.95Å; L1046-S1049 PolarHBondContact O-OG 3.4Å
1050	T	68.1	Low	79.3	Confident	31 Å²	31	52.3 Å²	52.3	19%	0.19	30%	0.303	C	S	.	.			trans	-128.9	152.3	178.7	-175.4	0	0	0	0	112.4	E1016 A1052 V1054	E1016-T1050 VanDerWaalsContact CD-OG1 3.27Å; E1016-T1050 VanDerWaalsContact OE1-CB 3.22Å; E1016-T1050 WeakPolarHBondContact OE1-CB 3.49Å; E1016-T1050 PolarHBondContact OE1-OG1 3.25Å; T1050-A1052 HydrophobicContact CG2-CB 4.46Å; T1050-A1052 WeakPolarHBondContact OG1-CB 3.43Å; T1050-A1052 PolarHBondContact OG1-N 2.86Å; T1050-V1054 HydrophobicContact CG2-CG2 3.62Å
1051	E	68.1	Low	79.4	Confident	211 Å²	211	50.5 Å²	50.5	99%	0.986	30%	0.295	S	S	*	.	S	Bend	trans	-91.5	-4.3	168.6	-63	-177.7	179.4	0	0	111.9
1052	A	69.5	Low	79.6	Confident	37 Å²	37	50.7 Å²	50.7	31%	0.306	30%	0.296	S	S	.	.	S	Bend	trans	-78.9	156.2	178.7	0	0	0	0	0	112.5	T1050 V1054	T1050-A1052 HydrophobicContact CG2-CB 4.46Å; T1050-A1052 WeakPolarHBondContact OG1-CB 3.43Å; T1050-A1052 PolarHBondContact OG1-N 2.86Å; A1052-V1054 PolarHBondContact O-N 3.41Å
1053	Y	72.7	Confident	80	Confident	130 Å²	130	48.4 Å²	48.4	51%	0.51	28%	0.283	S	S	.	.			trans	-65.2	116.1	169.3	173.8	-101.6	0	0	0	110	E1055 A1088	Y1053-E1055 HydrophobicContact CD1-CB 4.37Å; Y1053-E1055 HydrophobicContact CE1-CB 3.83Å; Y1053-E1055 HydrophobicContact CE1-CG 4.5Å; Y1053-E1055 PolarHBondContact OH-OE2 3.21Å; Y1053-A1088 HydrophobicContact CE2-CB 4.25Å
1054	V	79.4	Confident	80.5	Confident	32 Å²	32	49.1 Å²	49.1	19%	0.194	29%	0.288	C	S	.	.			trans	-88.5	108.6	174.3	-178.8	0	0	0	0	108.2	T1043 L1046 T1050 A1052 V1056	T1043-V1054 HydrophobicContact CG2-CG1 3.64Å; L1046-V1054 HydrophobicContact CB-CG2 4.25Å; T1050-V1054 HydrophobicContact CG2-CG2 3.62Å; A1052-V1054 PolarHBondContact O-N 3.41Å; V1054-V1056 PolarHBondContact O-N 2.64Å
1055	E	85.6	Confident	81	Confident	14 Å²	14	47.9 Å²	47.9	7%	0.065	27%	0.271	C	S	.	.			trans	-78.1	108.4	175.2	176.4	52.3	-91.5	0	0	109.3	Y1053 L1057 D1058 Y1067 R1071	Y1053-E1055 HydrophobicContact CD1-CB 4.37Å; Y1053-E1055 HydrophobicContact CE1-CB 3.83Å; Y1053-E1055 HydrophobicContact CE1-CG 4.5Å; Y1053-E1055 PolarHBondContact OH-OE2 3.21Å; E1055-L1057 HydrophobicContact CG-CB 4.1Å; E1055-L1057 PolarHBondContact O-N 3.04Å; E1055-L1057 VanDerWaalsContact O-N 3.1Å; E1055-L1057 WeakPolarHBondContact OE1-CG 3.43Å; E1055-L1057 PolarHBondContact OE1-N 3Å; E1055-D1058 WeakPolarHBondContact O-CB 3.5Å; E1055-D1058 PolarHBondContact O-N 3.11Å; E1055-Y1067 HydrophobicContact CG-CD2 3.85Å; E1055-Y1067 HydrophobicContact CG-CE2 3.51Å; E1055-R1071 IonicContact OE2-CZ 2.64Å; E1055-R1071 IonicContact OE2-NH1 3.81Å; E1055-R1071 PolarHBondContact OE2-NH1 3.1Å
1056	V	87.2	Confident	81.8	Confident	25 Å²	25	45.4 Å²	45.4	15%	0.152	25%	0.253	C	S	.	.	G	3₁₀ helix	trans	-60.5	-27	-173.9	-164.2	0	0	0	0	111.5	V1054 D1058 G1059 E1092 L1095	V1054-V1056 PolarHBondContact O-N 2.64Å; V1056-D1058 VanDerWaalsContact C-N 3.27Å; V1056-D1058 PolarHBondContact O-N 3.14Å; V1056-G1059 PolarHBondContact O-N 3.15Å; V1056-G1059 VanDerWaalsContact O-N 3.09Å; V1056-E1092 HydrophobicContact CG2-CG 4.33Å; V1056-L1095 HydrophobicContact CB-CD1 4.43Å; V1056-L1095 HydrophobicContact CG1-CD1 3.43Å; V1056-L1095 VanDerWaalsContact CG1-CD1 3.43Å
1057	L	91.6	Very high	82.6	Confident	3 Å²	3	46.2 Å²	46.2	2%	0.016	26%	0.256	C	S	.	.	G	3₁₀ helix	trans	-66.1	-20.3	175.5	-61.5	174.4	0	0	0	114.3	R1018 E1055 G1059 S1060 V1062 Y1067 A1070 L1091 L1132	R1018-L1057 PolarHBondContact NH1-O 2.87Å; E1055-L1057 HydrophobicContact CG-CB 4.1Å; E1055-L1057 PolarHBondContact O-N 3.04Å; E1055-L1057 VanDerWaalsContact O-N 3.1Å; E1055-L1057 WeakPolarHBondContact OE1-CG 3.43Å; E1055-L1057 PolarHBondContact OE1-N 3Å; L1057-G1059 PolarHBondContact O-N 2.91Å; L1057-S1060 WeakPolarHBondContact O-CB 3.29Å; L1057-S1060 PolarHBondContact O-N 3.03Å; L1057-S1060 PolarHBondContact O-OG 3.41Å; L1057-V1062 HydrophobicContact CD2-CG2 4.43Å; L1057-Y1067 HydrophobicContact CB-CD1 3.96Å; L1057-Y1067 HydrophobicContact CB-CD2 4.44Å; L1057-Y1067 HydrophobicContact CB-CE1 3.64Å; L1057-Y1067 HydrophobicContact CB-CE2 4.17Å; L1057-Y1067 HydrophobicContact CB-CG 4.34Å; L1057-Y1067 HydrophobicContact CD1-CD1 3.68Å; L1057-Y1067 HydrophobicContact CD1-CD2 4.25Å; L1057-Y1067 HydrophobicContact CD1-CE1 4.27Å; L1057-Y1067 HydrophobicContact CD1-CG 3.66Å; L1057-Y1067 HydrophobicContact CG-CD1 4.46Å; L1057-A1070 HydrophobicContact CD1-CB 3.81Å; L1057-A1070 HydrophobicContact CD2-CB 3.92Å; L1057-L1091 HydrophobicContact CD1-CD1 4.03Å; L1057-L1091 HydrophobicContact CD2-CD1 4.27Å; L1057-L1091 HydrophobicContact CD2-CD2 4.02Å; L1057-L1091 HydrophobicContact CG-CD1 3.99Å; L1057-L1132 HydrophobicContact CD2-CD2 3.9Å
1058	D	91.4	Very high	83.9	Confident	3 Å²	3	49.6 Å²	49.6	2%	0.016	26%	0.257	C	S	.	.	G	3₁₀ helix	trans	-65.5	-19.8	171.9	-69.9	-10.6	0	0	0	112	N1017 R1018 I1041 T1043 E1055 V1056 S1060 Y1067	N1017-D1058 WeakPolarHBondContact CA-OD2 3.49Å; N1017-D1058 VanDerWaalsContact CB-OD2 3.29Å; N1017-D1058 WeakPolarHBondContact CB-OD2 3.45Å; R1018-D1058 WeakPolarHBondContact CD-OD1 3.24Å; R1018-D1058 HydrophobicContact CG-CB 4.17Å; R1018-D1058 WeakPolarHBondContact CG-OD1 3.48Å; R1018-D1058 PolarHBondContact N-OD2 3.27Å; I1041-D1058 HydrophobicContact CB-CB 4.19Å; I1041-D1058 HydrophobicContact CD1-CB 4.31Å; I1041-D1058 PolarHBondContact N-O 2.55Å; I1041-D1058 VanDerWaalsContact N-O 3.09Å; T1043-D1058 HydrophobicContact CG2-CB 4.44Å; E1055-D1058 WeakPolarHBondContact O-CB 3.5Å; E1055-D1058 PolarHBondContact O-N 3.11Å; V1056-D1058 VanDerWaalsContact C-N 3.27Å; V1056-D1058 PolarHBondContact O-N 3.14Å; D1058-S1060 PolarHBondContact O-N 2.59Å; D1058-Y1067 WeakPolarHBondContact OD1-CE2 3.45Å; D1058-Y1067 PolarHBondContact OD1-OH 2.89Å
1059	G	89.3	Confident	85.1	Confident	3 Å²	3	42.1 Å²	42.1	3%	0.031	22%	0.215	C	C	.	.	G	3₁₀ helix	trans	-79.1	14.1	168.1	0	0	0	0	0	114.8	I1041 V1056 L1057 L1135 Y1136	I1041-G1059 WeakPolarHBondContact O-CA 3.07Å; V1056-G1059 PolarHBondContact O-N 3.15Å; V1056-G1059 VanDerWaalsContact O-N 3.09Å; L1057-G1059 PolarHBondContact O-N 2.91Å; G1059-L1135 WeakPolarHBondContact O-CB 3.44Å; G1059-Y1136 WeakPolarHBondContact O-CD2 3.43Å
1060	S	92	Very high	86.3	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	19%	0.189	C	C	.	.	S	Bend	trans	-139.3	165.1	-176.3	80.3	0	0	0	0	113.7	R1018 L1057 D1058 V1062 Y1136	R1018-S1060 PolarHBondContact NH1-O 2.79Å; R1018-S1060 PolarHBondContact NH2-O 3.42Å; L1057-S1060 WeakPolarHBondContact O-CB 3.29Å; L1057-S1060 PolarHBondContact O-N 3.03Å; L1057-S1060 PolarHBondContact O-OG 3.41Å; D1058-S1060 PolarHBondContact O-N 2.59Å; S1060-V1062 PolarHBondContact O-N 2.93Å; S1060-V1062 VanDerWaalsContact OG-CB 3.26Å; S1060-V1062 WeakPolarHBondContact OG-CB 3.32Å; S1060-V1062 VanDerWaalsContact OG-CG2 3.3Å; S1060-V1062 WeakPolarHBondContact OG-CG2 3.36Å; S1060-V1062 PolarHBondContact OG-N 3.03Å; S1060-V1062 VanDerWaalsContact OG-N 3.08Å; S1060-Y1136 WeakPolarHBondContact O-CE2 3.4Å
1061	R	93.6	Very high	87.3	Confident	17 Å²	17	39.5 Å²	39.5	6%	0.064	19%	0.19	C	C	.	.	S	Bend	trans	-76.2	7.6	168.1	-59.8	-176.7	-173.9	82.2	7.7	114.3	Y369 E972 V973 H1063 E1131 Y1136 K1137	Y369-R1061 WeakPolarHBondContact CE1-O 3.5Å; E972-R1061 PolarHBondContact O-NE 3.45Å; E972-R1061 PolarHBondContact O-NH2 3.28Å; V973-R1061 PolarHBondContact O-NH2 3.36Å; R1061-H1063 PolarHBondContact O-N 2.97Å; R1061-E1131 HydrophobicContact CB-CG 3.94Å; R1061-E1131 IonicContact CZ-OE1 2.94Å; R1061-E1131 PolarHBondContact N-OE2 3.02Å; R1061-E1131 IonicContact NH1-OE1 3.12Å; R1061-E1131 PolarHBondContact NH1-OE1 3.15Å; R1061-E1131 IonicContact NH1-OE2 2.69Å; R1061-Y1136 HydrophobicContact CB-CE1 4.49Å; R1061-Y1136 HydrophobicContact CG-CD1 3.61Å; R1061-Y1136 HydrophobicContact CG-CE1 3.32Å; R1061-Y1136 HydrophobicContact CG-CG 4.33Å; R1061-Y1136 PolarHBondContact NH1-O 3.18Å; R1061-Y1136 PolarHBondContact NH2-O 3.48Å; R1061-K1137 PolarHBondContact NH1-O 2.66Å; R1061-K1137 PolarHBondContact NH2-O 3.18Å; R1061-K1137 VanDerWaalsContact NH2-O 3.08Å
1062	V	93.7	Very high	88.3	Confident	4 Å²	4	33.7 Å²	33.7	2%	0.024	16%	0.161	C	C	.	.			trans	-63.2	132.6	168.5	-177	0	0	0	0	107.6	R1018 L1057 S1060 T1066 Y1067 A1070 I1128 E1131	R1018-V1062 PolarHBondContact NH1-O 2.59Å; L1057-V1062 HydrophobicContact CD2-CG2 4.43Å; S1060-V1062 PolarHBondContact O-N 2.93Å; S1060-V1062 VanDerWaalsContact OG-CB 3.26Å; S1060-V1062 WeakPolarHBondContact OG-CB 3.32Å; S1060-V1062 VanDerWaalsContact OG-CG2 3.3Å; S1060-V1062 WeakPolarHBondContact OG-CG2 3.36Å; S1060-V1062 PolarHBondContact OG-N 3.03Å; S1060-V1062 VanDerWaalsContact OG-N 3.08Å; V1062-T1066 WeakPolarHBondContact CG1-OG1 3.43Å; V1062-Y1067 HydrophobicContact CB-CE1 4.27Å; V1062-Y1067 HydrophobicContact CG1-CD1 3.77Å; V1062-Y1067 HydrophobicContact CG1-CE1 4.01Å; V1062-Y1067 WeakPolarHBondContact O-CE1 3.38Å; V1062-A1070 HydrophobicContact CG1-CB 4.2Å; V1062-I1128 HydrophobicContact CG1-CG1 4.19Å; V1062-I1128 HydrophobicContact CG2-CB 4.44Å; V1062-I1128 HydrophobicContact CG2-CG1 4.11Å; V1062-I1128 HydrophobicContact CG2-CG2 4.26Å; V1062-E1131 HydrophobicContact CG2-CB 4.3Å
1063	H	94.1	Very high	89.2	Confident	3 Å²	3	32 Å²	32	1%	0.014	15%	0.147	C	C	.	.			trans	-85.7	144.5	179.9	-173.2	-96.9	0	0	0	110.4	F365 Y369 I1033 S1036 R1061 E1065 T1066 Y1067	F365-H1063 AromaticContact CE2-CD2 3.94Å; F365-H1063 AromaticContact CE2-CE1 3.97Å; F365-H1063 AromaticContact CE2-NE2 3.64Å; Y369-H1063 HydrophobicContact CD1-CB 3.85Å; Y369-H1063 HydrophobicContact CE1-CB 3.89Å; Y369-H1063 HydrophobicContact CG-CB 4.32Å; I1033-H1063 PolarHBondContact O-NE2 3.46Å; S1036-H1063 PolarHBondContact OG-NE2 2.93Å; S1036-H1063 VanDerWaalsContact OG-NE2 3.08Å; R1061-H1063 PolarHBondContact O-N 2.97Å; H1063-E1065 WeakPolarHBondContact ND1-CB 3.19Å; H1063-E1065 VanDerWaalsContact ND1-CG 3.32Å; H1063-E1065 WeakPolarHBondContact ND1-CG 3.28Å; H1063-E1065 PolarHBondContact ND1-N 2.62Å; H1063-E1065 VanDerWaalsContact ND1-N 3.12Å; H1063-E1065 PolarHBondContact O-N 3.32Å; H1063-T1066 PolarHBondContact N-OG1 3.4Å; H1063-T1066 WeakPolarHBondContact O-CA 3.27Å; H1063-T1066 PolarHBondContact O-N 3.12Å; H1063-T1066 PolarHBondContact O-OG1 3.17Å; H1063-Y1067 VanDerWaalsContact O-CD1 3.27Å; H1063-Y1067 WeakPolarHBondContact O-CD1 3.4Å
1064	P	92.3	Very high	90	Very high	35 Å²	35	25.8 Å²	25.8	23%	0.227	12%	0.123	C	C	.	.	G	3₁₀ helix	trans	-50	-31.9	176.5	-32.1	37.6	0	0	0	115.3	F1032 T1066 Y1067	F1032-P1064 HydrophobicContact CZ-CG 4.33Å; P1064-T1066 PolarHBondContact O-N 3.38Å; P1064-Y1067 HydrophobicContact CB-CE2 4.37Å; P1064-Y1067 HydrophobicContact CG-CE1 4.36Å; P1064-Y1067 HydrophobicContact CG-CE2 4.34Å; P1064-Y1067 PolarHBondContact O-N 3.14Å
1065	E	90.1	Very high	90.4	Very high	79 Å²	79	25.4 Å²	25.4	37%	0.369	12%	0.119	S	C	.	.	G	3₁₀ helix	trans	-61.4	-11	173.9	88.9	-178.9	175.4	0	0	114.3	R370 H1063	R370-E1065 IonicContact CZ-OE1 3.76Å; R370-E1065 IonicContact CZ-OE2 2.72Å; R370-E1065 IonicContact NE-OE1 2.68Å; R370-E1065 PolarHBondContact NE-OE1 3.35Å; R370-E1065 IonicContact NH2-OE1 3.68Å; R370-E1065 PolarHBondContact NH2-OE1 3.15Å; R370-E1065 IonicContact NH2-OE2 3.43Å; R370-E1065 PolarHBondContact NH2-OE2 3.44Å; H1063-E1065 WeakPolarHBondContact ND1-CB 3.19Å; H1063-E1065 VanDerWaalsContact ND1-CG 3.32Å; H1063-E1065 WeakPolarHBondContact ND1-CG 3.28Å; H1063-E1065 PolarHBondContact ND1-N 2.62Å; H1063-E1065 VanDerWaalsContact ND1-N 3.12Å; H1063-E1065 PolarHBondContact O-N 3.32Å
1066	T	91.5	Very high	90.6	Very high	6 Å²	6	28.1 Å²	28.1	4%	0.037	13%	0.134	C	C	.	.	G	3₁₀ helix	trans	-123.7	2.9	-172.4	65.6	0	0	0	0	114.5	V1062 H1063 P1064 E1068 W1069 A1070 T1124	V1062-T1066 WeakPolarHBondContact CG1-OG1 3.43Å; H1063-T1066 PolarHBondContact N-OG1 3.4Å; H1063-T1066 WeakPolarHBondContact O-CA 3.27Å; H1063-T1066 PolarHBondContact O-N 3.12Å; H1063-T1066 PolarHBondContact O-OG1 3.17Å; P1064-T1066 PolarHBondContact O-N 3.38Å; T1066-E1068 VanDerWaalsContact C-N 3.27Å; T1066-E1068 PolarHBondContact O-N 2.71Å; T1066-W1069 HydrophobicContact CG2-CE3 3.7Å; T1066-W1069 HydrophobicContact CG2-CH2 4.33Å; T1066-W1069 HydrophobicContact CG2-CZ3 3.48Å; T1066-W1069 VanDerWaalsContact CG2-CZ3 3.48Å; T1066-W1069 WeakPolarHBondContact O-CB 3.45Å; T1066-W1069 PolarHBondContact O-N 3.02Å; T1066-A1070 PolarHBondContact O-N 2.66Å; T1066-T1124 HydrophobicContact CG2-CG2 4.1Å
1067	Y	92.2	Very high	90.6	Very high	20 Å²	20	27.5 Å²	27.5	8%	0.078	13%	0.132	C	C	.	.	H	α-helix	trans	-60.8	-32.4	-175	-75.9	4.7	0	0	0	113.7	R1018 E1055 L1057 D1058 V1062 H1063 P1064 W1069 A1070 R1071	R1018-Y1067 WeakPolarHBondContact CD-OH 3.3Å; R1018-Y1067 PolarHBondContact NH1-OH 3.16Å; E1055-Y1067 HydrophobicContact CG-CD2 3.85Å; E1055-Y1067 HydrophobicContact CG-CE2 3.51Å; L1057-Y1067 HydrophobicContact CB-CD1 3.96Å; L1057-Y1067 HydrophobicContact CB-CD2 4.44Å; L1057-Y1067 HydrophobicContact CB-CE1 3.64Å; L1057-Y1067 HydrophobicContact CB-CE2 4.17Å; L1057-Y1067 HydrophobicContact CB-CG 4.34Å; L1057-Y1067 HydrophobicContact CD1-CD1 3.68Å; L1057-Y1067 HydrophobicContact CD1-CD2 4.25Å; L1057-Y1067 HydrophobicContact CD1-CE1 4.27Å; L1057-Y1067 HydrophobicContact CD1-CG 3.66Å; L1057-Y1067 HydrophobicContact CG-CD1 4.46Å; D1058-Y1067 WeakPolarHBondContact OD1-CE2 3.45Å; D1058-Y1067 PolarHBondContact OD1-OH 2.89Å; V1062-Y1067 HydrophobicContact CB-CE1 4.27Å; V1062-Y1067 HydrophobicContact CG1-CD1 3.77Å; V1062-Y1067 HydrophobicContact CG1-CE1 4.01Å; V1062-Y1067 WeakPolarHBondContact O-CE1 3.38Å; H1063-Y1067 VanDerWaalsContact O-CD1 3.27Å; H1063-Y1067 WeakPolarHBondContact O-CD1 3.4Å; P1064-Y1067 HydrophobicContact CB-CE2 4.37Å; P1064-Y1067 HydrophobicContact CG-CE1 4.36Å; P1064-Y1067 HydrophobicContact CG-CE2 4.34Å; P1064-Y1067 PolarHBondContact O-N 3.14Å; Y1067-W1069 VanDerWaalsContact C-N 3.31Å; Y1067-W1069 PolarHBondContact O-N 3.14Å; Y1067-A1070 PolarHBondContact O-N 2.86Å; Y1067-R1071 WeakPolarHBondContact O-CG 3.25Å; Y1067-R1071 PolarHBondContact O-N 3.22Å
1068	E	89.2	Confident	90.2	Very high	126 Å²	126	27.9 Å²	27.9	59%	0.589	13%	0.134	S	C	*	.	H	α-helix	trans	-66.4	-32.4	175.1	-63.3	-169.9	174.7	0	0	113	T1066 K1072	T1066-E1068 VanDerWaalsContact C-N 3.27Å; T1066-E1068 PolarHBondContact O-N 2.71Å; E1068-K1072 WeakPolarHBondContact O-CG 3.2Å; E1068-K1072 PolarHBondContact O-N 3.08Å
1069	W	89.4	Confident	89.8	Confident	25 Å²	25	36.7 Å²	36.7	10%	0.095	18%	0.175	C	C	.	.	H	α-helix	trans	-73.9	-40.5	176.8	-52.6	-23.5	0	0	0	110.8	T1066 Y1067 R1071 K1072 M1073 L1113 F1118 K1121 T1124 I1128	T1066-W1069 HydrophobicContact CG2-CE3 3.7Å; T1066-W1069 HydrophobicContact CG2-CH2 4.33Å; T1066-W1069 HydrophobicContact CG2-CZ3 3.48Å; T1066-W1069 VanDerWaalsContact CG2-CZ3 3.48Å; T1066-W1069 WeakPolarHBondContact O-CB 3.45Å; T1066-W1069 PolarHBondContact O-N 3.02Å; Y1067-W1069 VanDerWaalsContact C-N 3.31Å; Y1067-W1069 PolarHBondContact O-N 3.14Å; W1069-R1071 PolarHBondContact O-N 3.42Å; W1069-K1072 PolarHBondContact O-N 3.03Å; W1069-M1073 WeakPolarHBondContact O-CB 3.47Å; W1069-M1073 VanDerWaalsContact O-CG 3.27Å; W1069-M1073 WeakPolarHBondContact O-CG 3.35Å; W1069-M1073 PolarHBondContact O-N 2.91Å; W1069-L1113 HydrophobicContact CD2-CD1 4.19Å; W1069-L1113 HydrophobicContact CG-CD1 4.27Å; W1069-F1118 HydrophobicContact CZ2-CB 4.35Å; W1069-F1118 HydrophobicContact CZ2-CD1 4.32Å; W1069-F1118 HydrophobicContact CZ2-CG 4.46Å; W1069-K1121 HydrophobicContact CE3-CG 4.44Å; W1069-K1121 HydrophobicContact CH2-CD 3.67Å; W1069-K1121 HydrophobicContact CH2-CG 3.82Å; W1069-K1121 HydrophobicContact CZ2-CG 4.45Å; W1069-K1121 HydrophobicContact CZ3-CB 4.37Å; W1069-K1121 HydrophobicContact CZ3-CD 3.7Å; W1069-K1121 HydrophobicContact CZ3-CG 3.8Å; W1069-T1124 HydrophobicContact CE3-CG2 4.34Å; W1069-T1124 HydrophobicContact CZ3-CG2 4.17Å; W1069-I1128 HydrophobicContact CB-CD1 4.43Å
1070	A	91	Very high	89.4	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-61.9	-41.4	173.3	0	0	0	0	0	112.3	L1057 V1062 T1066 Y1067 A1074 I1128	L1057-A1070 HydrophobicContact CD1-CB 3.81Å; L1057-A1070 HydrophobicContact CD2-CB 3.92Å; V1062-A1070 HydrophobicContact CG1-CB 4.2Å; T1066-A1070 PolarHBondContact O-N 2.66Å; Y1067-A1070 PolarHBondContact O-N 2.86Å; A1070-A1074 PolarHBondContact O-N 3.07Å; A1070-A1074 VanDerWaalsContact O-N 3.11Å; A1070-I1128 HydrophobicContact CB-CG2 3.78Å
1071	R	90.4	Very high	88.5	Confident	57 Å²	57	47.5 Å²	47.5	22%	0.215	23%	0.226	C	C	.	.	H	α-helix	trans	-61.8	-45.4	173	-78.3	-176	-74.5	-102.9	5.9	112.7	E1055 Y1067 W1069 A1074 I1075 P1087 L1091	E1055-R1071 IonicContact OE2-CZ 2.64Å; E1055-R1071 IonicContact OE2-NH1 3.81Å; E1055-R1071 PolarHBondContact OE2-NH1 3.1Å; Y1067-R1071 WeakPolarHBondContact O-CG 3.25Å; Y1067-R1071 PolarHBondContact O-N 3.22Å; W1069-R1071 PolarHBondContact O-N 3.42Å; R1071-A1074 PolarHBondContact O-N 3.08Å; R1071-I1075 PolarHBondContact O-N 2.84Å; R1071-I1075 VanDerWaalsContact O-N 3.13Å; R1071-P1087 HydrophobicContact CB-CB 4.06Å; R1071-P1087 HydrophobicContact CG-CB 4.02Å; R1071-L1091 HydrophobicContact CG-CD1 3.63Å; R1071-L1091 HydrophobicContact CG-CG 4.47Å
1072	K	87.9	Confident	87.3	Confident	89 Å²	89	53.6 Å²	53.6	39%	0.387	26%	0.26	S	S	.	.	H	α-helix	trans	-62.8	-49.6	175.9	-75.8	174.2	176.1	179	0	112	E1068 W1069 A1074 I1075 D1076 F1109	E1068-K1072 WeakPolarHBondContact O-CG 3.2Å; E1068-K1072 PolarHBondContact O-N 3.08Å; W1069-K1072 PolarHBondContact O-N 3.03Å; K1072-A1074 PolarHBondContact O-N 3.48Å; K1072-A1074 VanDerWaalsContact O-N 3.09Å; K1072-I1075 PolarHBondContact O-N 2.85Å; K1072-D1076 PolarHBondContact O-N 2.98Å; K1072-F1109 HydrophobicContact CB-CE2 4.34Å; K1072-F1109 HydrophobicContact CB-CZ 3.92Å
1073	M	89.5	Confident	86.1	Confident	0 Å²	0	62.6 Å²	62.6	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-53.6	-33.5	175.1	-74.2	172.1	58.8	0	0	113	W1069 A1077 L1104 L1106 F1109 L1125 I1128 R1129	W1069-M1073 WeakPolarHBondContact O-CB 3.47Å; W1069-M1073 VanDerWaalsContact O-CG 3.27Å; W1069-M1073 WeakPolarHBondContact O-CG 3.35Å; W1069-M1073 PolarHBondContact O-N 2.91Å; M1073-A1077 WeakPolarHBondContact O-CB 3.42Å; M1073-A1077 PolarHBondContact O-N 2.85Å; M1073-A1077 VanDerWaalsContact O-N 3.07Å; M1073-L1104 HydrophobicContact CB-CD2 4.14Å; M1073-L1104 HydrophobicContact CG-CD2 4.2Å; M1073-L1106 HydrophobicContact CE-CD2 3.83Å; M1073-F1109 HydrophobicContact CG-CE1 4.33Å; M1073-F1109 HydrophobicContact CG-CZ 4.26Å; M1073-L1125 HydrophobicContact CG-CD2 4.23Å; M1073-L1125 HydrophobicContact SD-CB 4.42Å; M1073-L1125 HydrophobicContact SD-CD2 3.47Å; M1073-L1125 WeakPolarHBondContact SD-CD2 3.37Å; M1073-I1128 HydrophobicContact CE-CB 4.16Å; M1073-I1128 HydrophobicContact CE-CG2 3.76Å; M1073-I1128 HydrophobicContact SD-CB 4.09Å; M1073-I1128 HydrophobicContact SD-CD1 4.41Å; M1073-I1128 HydrophobicContact SD-CG2 3.66Å; M1073-R1129 HydrophobicContact CE-CB 4.12Å
1074	A	88.8	Confident	84.6	Confident	0 Å²	0	71.7 Å²	71.7	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-73.9	-38.9	175.6	0	0	0	0	0	113	A1070 R1071 K1072 M1078 A1090 L1091 I1094	A1070-A1074 PolarHBondContact O-N 3.07Å; A1070-A1074 VanDerWaalsContact O-N 3.11Å; R1071-A1074 PolarHBondContact O-N 3.08Å; K1072-A1074 PolarHBondContact O-N 3.48Å; K1072-A1074 VanDerWaalsContact O-N 3.09Å; A1074-M1078 VanDerWaalsContact O-CB 3.26Å; A1074-M1078 WeakPolarHBondContact O-CB 3.38Å; A1074-M1078 WeakPolarHBondContact O-CG 3.42Å; A1074-M1078 PolarHBondContact O-N 3.43Å; A1074-A1090 HydrophobicContact CB-CB 4.23Å; A1074-L1091 HydrophobicContact CB-CD2 3.78Å; A1074-L1091 HydrophobicContact CB-CG 3.98Å; A1074-I1094 HydrophobicContact CB-CB 4.47Å; A1074-I1094 HydrophobicContact CB-CG1 4.1Å
1075	I	88.8	Confident	83.4	Confident	25 Å²	25	71.9 Å²	71.9	13%	0.128	35%	0.345	C	S	.	.	H	α-helix	trans	-64.2	-50.4	173.5	-67.1	167.7	0	0	0	110.3	R1071 K1072 A1077 M1078 E1079 Y1080 T1085 P1087 A1090	R1071-I1075 PolarHBondContact O-N 2.84Å; R1071-I1075 VanDerWaalsContact O-N 3.13Å; K1072-I1075 PolarHBondContact O-N 2.85Å; I1075-A1077 PolarHBondContact O-N 2.86Å; I1075-M1078 WeakPolarHBondContact O-CB 3.49Å; I1075-M1078 PolarHBondContact O-N 3.42Å; I1075-M1078 VanDerWaalsContact O-N 3.08Å; I1075-E1079 PolarHBondContact O-N 3.24Å; I1075-Y1080 PolarHBondContact O-N 3.4Å; I1075-T1085 HydrophobicContact CG1-CG2 4.29Å; I1075-P1087 HydrophobicContact CD1-CB 4.18Å; I1075-A1090 HydrophobicContact CG1-CB 4.13Å
1076	D	88.1	Confident	82.8	Confident	70 Å²	70	73.1 Å²	73.1	37%	0.374	35%	0.354	S	S	.	.	H	α-helix	trans	-58.5	-48.7	179.7	-69.3	29.4	0	0	0	111.7	K1072 M1078 E1079 L1104 F1109	K1072-D1076 PolarHBondContact O-N 2.98Å; D1076-M1078 PolarHBondContact O-N 2.92Å; D1076-E1079 PolarHBondContact O-N 2.87Å; D1076-E1079 VanDerWaalsContact O-N 3.15Å; D1076-L1104 HydrophobicContact CB-CD1 3.79Å; D1076-L1104 HydrophobicContact CB-CD2 4.43Å; D1076-F1109 WeakPolarHBondContact OD2-CD2 3.27Å; D1076-F1109 VanDerWaalsContact OD2-CE2 3.25Å; D1076-F1109 WeakPolarHBondContact OD2-CE2 3.45Å
1077	A	87.5	Confident	82.3	Confident	12 Å²	12	75 Å²	75	10%	0.099	37%	0.366	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-8.3	179	0	0	0	0	0	114	M1073 I1075 I1094 R1100 L1101 L1104	M1073-A1077 WeakPolarHBondContact O-CB 3.42Å; M1073-A1077 PolarHBondContact O-N 2.85Å; M1073-A1077 VanDerWaalsContact O-N 3.07Å; I1075-A1077 PolarHBondContact O-N 2.86Å; A1077-I1094 HydrophobicContact CB-CD1 3.86Å; A1077-R1100 WeakPolarHBondContact O-CB 3.43Å; A1077-L1101 HydrophobicContact CB-CD2 3.91Å; A1077-L1104 HydrophobicContact CB-CD2 4.4Å
1078	M	84.4	Confident	81.7	Confident	12 Å²	12	74.5 Å²	74.5	6%	0.059	37%	0.366	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.7	-6.6	174	-78.3	-60.2	-59.4	0	0	113.6	A1074 I1075 D1076 Y1080 E1093 I1094 R1100	A1074-M1078 VanDerWaalsContact O-CB 3.26Å; A1074-M1078 WeakPolarHBondContact O-CB 3.38Å; A1074-M1078 WeakPolarHBondContact O-CG 3.42Å; A1074-M1078 PolarHBondContact O-N 3.43Å; I1075-M1078 WeakPolarHBondContact O-CB 3.49Å; I1075-M1078 PolarHBondContact O-N 3.42Å; I1075-M1078 VanDerWaalsContact O-N 3.08Å; D1076-M1078 PolarHBondContact O-N 2.92Å; M1078-Y1080 HydrophobicContact CB-CD1 4.5Å; M1078-Y1080 HydrophobicContact CB-CD2 3.36Å; M1078-Y1080 HydrophobicContact CB-CE2 3.7Å; M1078-Y1080 HydrophobicContact CB-CG 3.83Å; M1078-Y1080 HydrophobicContact CE-CD2 4.39Å; M1078-Y1080 HydrophobicContact CE-CE1 4.14Å; M1078-Y1080 HydrophobicContact CE-CE2 3.62Å; M1078-Y1080 VanDerWaalsContact CE-CZ 3.47Å; M1078-Y1080 WeakPolarHBondContact CE-OH 3.04Å; M1078-Y1080 HydrophobicContact CG-CD2 4.03Å; M1078-Y1080 HydrophobicContact CG-CE2 3.93Å; M1078-Y1080 PolarHBondContact O-N 3.49Å; M1078-E1093 HydrophobicContact CE-CB 4.28Å; M1078-E1093 HydrophobicContact CE-CG 3.9Å; M1078-E1093 VanDerWaalsContact CE-OE1 3.28Å; M1078-E1093 WeakPolarHBondContact CE-OE1 3.41Å; M1078-E1093 VanDerWaalsContact CE-OE2 3.27Å; M1078-E1093 WeakPolarHBondContact CE-OE2 3.44Å; M1078-E1093 HydrophobicContact SD-CB 4.4Å; M1078-E1093 HydrophobicContact SD-CG 4.19Å; M1078-I1094 HydrophobicContact CG-CD1 3.89Å; M1078-I1094 HydrophobicContact CG-CG1 3.71Å; M1078-I1094 HydrophobicContact SD-CD1 3.89Å; M1078-I1094 HydrophobicContact SD-CG1 3.99Å; M1078-R1100 PolarHBondContact SD-NH1 3.24Å
1079	E	83.1	Confident	81.4	Confident	187 Å²	187	69.6 Å²	69.6	87%	0.874	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	53	35.3	-170	-58.5	-171.9	161	0	0	112.7	I1075 D1076	I1075-E1079 PolarHBondContact O-N 3.24Å; D1076-E1079 PolarHBondContact O-N 2.87Å; D1076-E1079 VanDerWaalsContact O-N 3.15Å
1080	Y	80.5	Confident	81.2	Confident	88 Å²	88	68.5 Å²	68.5	35%	0.345	35%	0.345	S	S	.	.			trans	-84.4	133.9	-179.9	-80.7	-33.3	0	0	0	112.3	I1075 M1078 D1082 T1085 A1090 E1093	I1075-Y1080 PolarHBondContact O-N 3.4Å; M1078-Y1080 HydrophobicContact CB-CD1 4.5Å; M1078-Y1080 HydrophobicContact CB-CD2 3.36Å; M1078-Y1080 HydrophobicContact CB-CE2 3.7Å; M1078-Y1080 HydrophobicContact CB-CG 3.83Å; M1078-Y1080 HydrophobicContact CE-CD2 4.39Å; M1078-Y1080 HydrophobicContact CE-CE1 4.14Å; M1078-Y1080 HydrophobicContact CE-CE2 3.62Å; M1078-Y1080 VanDerWaalsContact CE-CZ 3.47Å; M1078-Y1080 WeakPolarHBondContact CE-OH 3.04Å; M1078-Y1080 HydrophobicContact CG-CD2 4.03Å; M1078-Y1080 HydrophobicContact CG-CE2 3.93Å; M1078-Y1080 PolarHBondContact O-N 3.49Å; Y1080-D1082 PolarHBondContact O-N 3.05Å; Y1080-T1085 WeakPolarHBondContact CB-OG1 3.33Å; Y1080-T1085 HydrophobicContact CD2-CG2 3.49Å; Y1080-T1085 VanDerWaalsContact CD2-CG2 3.49Å; Y1080-T1085 HydrophobicContact CE2-CG2 4.14Å; Y1080-T1085 HydrophobicContact CG-CG2 3.91Å; Y1080-A1090 HydrophobicContact CD2-CB 4.12Å; Y1080-A1090 HydrophobicContact CE2-CB 4.14Å; Y1080-E1093 PolarHBondContact OH-OE2 3.41Å
1081	D	73.5	Confident	81	Confident	143 Å²	143	68.5 Å²	68.5	77%	0.765	35%	0.346	S	S	*	.			trans	-64.4	131.6	173.3	-72.6	-49.6	0	0	0	110.8	E1083 T1085	D1081-E1083 PolarHBondContact O-N 3.37Å; D1081-T1085 PolarHBondContact O-OG1 3.08Å
1082	D	67.5	Low	80.7	Confident	144 Å²	144	71.1 Å²	71.1	77%	0.77	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.3	-24.6	-173.3	-78.3	-51.4	0	0	0	115	Y1080	Y1080-D1082 PolarHBondContact O-N 3.05Å
1083	E	68.1	Low	80.6	Confident	193 Å²	193	70 Å²	70	90%	0.902	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.4	-17.7	-164.8	-62.6	-166.4	160.6	0	0	115.4	D1081	D1081-E1083 PolarHBondContact O-N 3.37Å
1084	E	62.6	Low	80.6	Confident	194 Å²	194	70 Å²	70	91%	0.907	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-126.1	-0.5	-175.4	-66.8	-161.1	145.6	0	0	115.7
1085	T	67.3	Low	80.5	Confident	40 Å²	40	72.4 Å²	72.4	25%	0.245	37%	0.369	C	S	.	.			trans	-92.6	133.2	-165.8	-62.9	0	0	0	0	114.8	I1075 Y1080 D1081 P1087 A1090	I1075-T1085 HydrophobicContact CG1-CG2 4.29Å; Y1080-T1085 WeakPolarHBondContact CB-OG1 3.33Å; Y1080-T1085 HydrophobicContact CD2-CG2 3.49Å; Y1080-T1085 VanDerWaalsContact CD2-CG2 3.49Å; Y1080-T1085 HydrophobicContact CE2-CG2 4.14Å; Y1080-T1085 HydrophobicContact CG-CG2 3.91Å; D1081-T1085 PolarHBondContact O-OG1 3.08Å; T1085-P1087 WeakPolarHBondContact O-CD 3.43Å; T1085-A1090 HydrophobicContact CG2-CB 4.44Å
1086	N	78.2	Confident	80.3	Confident	105 Å²	105	79 Å²	79	56%	0.561	40%	0.399	S	S	*	.			trans	-79.9	115.5	169.3	174.6	15.5	0	0	0	110.6	A1088 G1089 A1090	N1086-A1088 VanDerWaalsContact C-N 3.26Å; N1086-A1088 PolarHBondContact O-N 2.86Å; N1086-A1088 PolarHBondContact OD1-N 3.26Å; N1086-A1088 VanDerWaalsContact OD1-N 3.15Å; N1086-G1089 PolarHBondContact O-N 3.2Å; N1086-A1090 PolarHBondContact O-N 3.45Å
1087	P	80.3	Confident	80.4	Confident	45 Å²	45	76.7 Å²	76.7	29%	0.292	39%	0.388	S	S	.	.	H	α-helix	trans	-65.6	-24	-176.5	26.4	-35.6	0	0	0	114.2	R1071 I1075 T1085 L1091	R1071-P1087 HydrophobicContact CB-CB 4.06Å; R1071-P1087 HydrophobicContact CG-CB 4.02Å; I1075-P1087 HydrophobicContact CD1-CB 4.18Å; T1085-P1087 WeakPolarHBondContact O-CD 3.43Å; P1087-L1091 PolarHBondContact O-N 2.83Å
1088	A	80	Confident	80.3	Confident	10 Å²	10	77.8 Å²	77.8	8%	0.083	39%	0.394	C	S	.	.	H	α-helix	trans	-69.9	-43.6	175.6	0	0	0	0	0	111.3	Y1053 N1086 A1090 L1091 E1092	Y1053-A1088 HydrophobicContact CE2-CB 4.25Å; N1086-A1088 VanDerWaalsContact C-N 3.26Å; N1086-A1088 PolarHBondContact O-N 2.86Å; N1086-A1088 PolarHBondContact OD1-N 3.26Å; N1086-A1088 VanDerWaalsContact OD1-N 3.15Å; A1088-A1090 VanDerWaalsContact C-N 3.32Å; A1088-A1090 PolarHBondContact O-N 2.93Å; A1088-L1091 WeakPolarHBondContact O-CB 2.91Å; A1088-L1091 PolarHBondContact O-N 3.34Å; A1088-L1091 VanDerWaalsContact O-N 3.17Å; A1088-E1092 WeakPolarHBondContact O-CG 3.17Å; A1088-E1092 PolarHBondContact O-N 3.2Å
1089	G	82.4	Confident	80.5	Confident	23 Å²	23	82 Å²	82	24%	0.237	41%	0.414	C	S	.	.	H	α-helix	trans	-65.6	-34.2	176.1	0	0	0	0	0	113	N1086 L1091 E1092 E1093	N1086-G1089 PolarHBondContact O-N 3.2Å; G1089-L1091 VanDerWaalsContact C-N 3.34Å; G1089-E1092 PolarHBondContact O-N 3.37Å; G1089-E1093 PolarHBondContact O-N 2.91Å
1090	A	85.2	Confident	80.7	Confident	1 Å²	1	76.9 Å²	76.9	1%	0.008	39%	0.387	C	S	.	.	H	α-helix	trans	-63.8	-38.1	172.5	0	0	0	0	0	112.3	A1074 I1075 Y1080 T1085 N1086 A1088 I1094	A1074-A1090 HydrophobicContact CB-CB 4.23Å; I1075-A1090 HydrophobicContact CG1-CB 4.13Å; Y1080-A1090 HydrophobicContact CD2-CB 4.12Å; Y1080-A1090 HydrophobicContact CE2-CB 4.14Å; T1085-A1090 HydrophobicContact CG2-CB 4.44Å; N1086-A1090 PolarHBondContact O-N 3.45Å; A1088-A1090 VanDerWaalsContact C-N 3.32Å; A1088-A1090 PolarHBondContact O-N 2.93Å; A1090-I1094 VanDerWaalsContact O-CB 3.29Å; A1090-I1094 WeakPolarHBondContact O-CB 3.32Å; A1090-I1094 WeakPolarHBondContact O-CG1 3.25Å; A1090-I1094 PolarHBondContact O-N 2.94Å; A1090-I1094 VanDerWaalsContact O-N 3.11Å
1091	L	87	Confident	81	Confident	1 Å²	1	72.7 Å²	72.7	1%	0.005	37%	0.37	C	S	.	.	H	α-helix	trans	-67.1	-42.3	173.1	-80.2	168.3	0	0	0	112.3	L1057 R1071 A1074 P1087 A1088 G1089 I1094 L1095 L1132	L1057-L1091 HydrophobicContact CD1-CD1 4.03Å; L1057-L1091 HydrophobicContact CD2-CD1 4.27Å; L1057-L1091 HydrophobicContact CD2-CD2 4.02Å; L1057-L1091 HydrophobicContact CG-CD1 3.99Å; R1071-L1091 HydrophobicContact CG-CD1 3.63Å; R1071-L1091 HydrophobicContact CG-CG 4.47Å; A1074-L1091 HydrophobicContact CB-CD2 3.78Å; A1074-L1091 HydrophobicContact CB-CG 3.98Å; P1087-L1091 PolarHBondContact O-N 2.83Å; A1088-L1091 WeakPolarHBondContact O-CB 2.91Å; A1088-L1091 PolarHBondContact O-N 3.34Å; A1088-L1091 VanDerWaalsContact O-N 3.17Å; G1089-L1091 VanDerWaalsContact C-N 3.34Å; L1091-I1094 PolarHBondContact O-N 2.71Å; L1091-L1095 VanDerWaalsContact O-CG 3.29Å; L1091-L1095 WeakPolarHBondContact O-CG 3.13Å; L1091-L1095 PolarHBondContact O-N 2.95Å; L1091-L1132 HydrophobicContact CD2-CD1 4.42Å; L1091-L1132 HydrophobicContact CD2-CD2 3.87Å
1092	E	84.3	Confident	81.6	Confident	112 Å²	112	72.7 Å²	72.7	52%	0.523	36%	0.363	S	S	.	.	H	α-helix	trans	-60.2	-49.9	176.5	-70.9	169.5	176	0	0	111.6	V1056 A1088 G1089 I1094 L1095 E1096	V1056-E1092 HydrophobicContact CG2-CG 4.33Å; A1088-E1092 WeakPolarHBondContact O-CG 3.17Å; A1088-E1092 PolarHBondContact O-N 3.2Å; G1089-E1092 PolarHBondContact O-N 3.37Å; E1092-I1094 VanDerWaalsContact C-N 3.33Å; E1092-I1094 PolarHBondContact O-N 2.68Å; E1092-L1095 PolarHBondContact O-N 2.81Å; E1092-L1095 VanDerWaalsContact O-N 3.16Å; E1092-E1096 PolarHBondContact O-N 2.73Å
1093	E	86.1	Confident	82.4	Confident	64 Å²	64	73 Å²	73	30%	0.299	37%	0.365	S	S	.	.	H	α-helix	trans	-66.9	-31.6	179	-167.8	175.3	162.1	0	0	112.7	M1078 Y1080 G1089 L1095 E1096 S1097 R1100	M1078-E1093 HydrophobicContact CE-CB 4.28Å; M1078-E1093 HydrophobicContact CE-CG 3.9Å; M1078-E1093 VanDerWaalsContact CE-OE1 3.28Å; M1078-E1093 WeakPolarHBondContact CE-OE1 3.41Å; M1078-E1093 VanDerWaalsContact CE-OE2 3.27Å; M1078-E1093 WeakPolarHBondContact CE-OE2 3.44Å; M1078-E1093 HydrophobicContact SD-CB 4.4Å; M1078-E1093 HydrophobicContact SD-CG 4.19Å; Y1080-E1093 PolarHBondContact OH-OE2 3.41Å; G1089-E1093 PolarHBondContact O-N 2.91Å; E1093-L1095 VanDerWaalsContact C-N 3.34Å; E1093-E1096 PolarHBondContact O-N 3.24Å; E1093-S1097 WeakPolarHBondContact O-CB 3.34Å; E1093-S1097 PolarHBondContact O-N 3.23Å; E1093-S1097 PolarHBondContact O-OG 3.38Å; E1093-R1100 IonicContact OE1-CZ 2.67Å; E1093-R1100 IonicContact OE1-NH1 3.13Å; E1093-R1100 IonicContact OE1-NH2 2.95Å; E1093-R1100 PolarHBondContact OE1-NH2 3.48Å
1094	I	88.7	Confident	83.3	Confident	0 Å²	0	65.3 Å²	65.3	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-69.5	-30	173.8	-78	-72.1	0	0	0	112.5	A1074 A1077 M1078 A1090 L1091 E1092 S1097 P1098 R1100 L1101	A1074-I1094 HydrophobicContact CB-CB 4.47Å; A1074-I1094 HydrophobicContact CB-CG1 4.1Å; A1077-I1094 HydrophobicContact CB-CD1 3.86Å; M1078-I1094 HydrophobicContact CG-CD1 3.89Å; M1078-I1094 HydrophobicContact CG-CG1 3.71Å; M1078-I1094 HydrophobicContact SD-CD1 3.89Å; M1078-I1094 HydrophobicContact SD-CG1 3.99Å; A1090-I1094 VanDerWaalsContact O-CB 3.29Å; A1090-I1094 WeakPolarHBondContact O-CB 3.32Å; A1090-I1094 WeakPolarHBondContact O-CG1 3.25Å; A1090-I1094 PolarHBondContact O-N 2.94Å; A1090-I1094 VanDerWaalsContact O-N 3.11Å; L1091-I1094 PolarHBondContact O-N 2.71Å; E1092-I1094 VanDerWaalsContact C-N 3.33Å; E1092-I1094 PolarHBondContact O-N 2.68Å; I1094-S1097 CarbonylContact O-C 3.59Å; I1094-S1097 VanDerWaalsContact O-C 3.3Å; I1094-S1097 PolarHBondContact O-N 2.96Å; I1094-P1098 VanDerWaalsContact O-CA 3.22Å; I1094-P1098 WeakPolarHBondContact O-CA 3.29Å; I1094-P1098 VanDerWaalsContact O-N 3.08Å; I1094-R1100 HydrophobicContact CD1-CB 4.11Å; I1094-L1101 HydrophobicContact CD1-CD2 4.39Å; I1094-L1101 HydrophobicContact CD1-CG 4.35Å; I1094-L1101 HydrophobicContact CG2-CD1 3.68Å; I1094-L1101 HydrophobicContact CG2-CD2 4Å; I1094-L1101 HydrophobicContact CG2-CG 3.84Å
1095	L	85.8	Confident	84.6	Confident	51 Å²	51	60.6 Å²	60.6	27%	0.267	31%	0.311	S	S	.	.	H	α-helix	trans	-74.7	-27.2	173.1	-70.2	165.2	0	0	0	112.2	V1056 L1091 E1092 E1093 L1132 L1135	V1056-L1095 HydrophobicContact CB-CD1 4.43Å; V1056-L1095 HydrophobicContact CG1-CD1 3.43Å; V1056-L1095 VanDerWaalsContact CG1-CD1 3.43Å; L1091-L1095 VanDerWaalsContact O-CG 3.29Å; L1091-L1095 WeakPolarHBondContact O-CG 3.13Å; L1091-L1095 PolarHBondContact O-N 2.95Å; E1092-L1095 PolarHBondContact O-N 2.81Å; E1092-L1095 VanDerWaalsContact O-N 3.16Å; E1093-L1095 VanDerWaalsContact C-N 3.34Å; L1095-L1132 HydrophobicContact CD2-CD2 4.43Å; L1095-L1132 WeakPolarHBondContact CD2-O 3.26Å; L1095-L1135 HydrophobicContact CD1-CD1 4.48Å; L1095-L1135 HydrophobicContact CD2-CD1 4.04Å; L1095-L1135 HydrophobicContact CD2-CD2 3.93Å; L1095-L1135 HydrophobicContact CD2-CG 3.93Å
1096	E	86.4	Confident	85.7	Confident	164 Å²	164	58.8 Å²	58.8	77%	0.766	30%	0.3	S	S	*	.	H	α-helix	trans	-76.7	-34.4	167.7	-64.1	-164.7	159.7	0	0	112.9	E1092 E1093 P1098	E1092-E1096 PolarHBondContact O-N 2.73Å; E1093-E1096 PolarHBondContact O-N 3.24Å; E1096-P1098 WeakPolarHBondContact O-CD 3.44Å
1097	S	88.4	Confident	86.2	Confident	21 Å²	21	57.2 Å²	57.2	15%	0.147	29%	0.292	C	S	.	.			trans	-120.2	52.9	-174.8	-50	0	0	0	0	114.2	E1093 I1094 E1099 R1100	E1093-S1097 WeakPolarHBondContact O-CB 3.34Å; E1093-S1097 PolarHBondContact O-N 3.23Å; E1093-S1097 PolarHBondContact O-OG 3.38Å; I1094-S1097 CarbonylContact O-C 3.59Å; I1094-S1097 VanDerWaalsContact O-C 3.3Å; I1094-S1097 PolarHBondContact O-N 2.96Å; S1097-E1099 PolarHBondContact O-N 3.02Å; S1097-R1100 PolarHBondContact O-N 3.48Å
1098	P	86.6	Confident	86.7	Confident	35 Å²	35	57.6 Å²	57.6	23%	0.227	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68	-5.7	-169.2	28.2	-36.8	0	0	0	114.5	I1094 E1096	I1094-P1098 VanDerWaalsContact O-CA 3.22Å; I1094-P1098 WeakPolarHBondContact O-CA 3.29Å; I1094-P1098 VanDerWaalsContact O-N 3.08Å; E1096-P1098 WeakPolarHBondContact O-CD 3.44Å
1099	E	88.5	Confident	87.1	Confident	100 Å²	100	58.4 Å²	58.4	47%	0.467	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-28.4	171.1	66.6	-74.7	171.2	0	0	114.7	S1097 L1101 K1102	S1097-E1099 PolarHBondContact O-N 3.02Å; E1099-L1101 PolarHBondContact O-N 3.5Å; E1099-K1102 HydrophobicContact CB-CD 4.36Å; E1099-K1102 VanDerWaalsContact O-CB 3.29Å; E1099-K1102 WeakPolarHBondContact O-CB 3.28Å; E1099-K1102 WeakPolarHBondContact O-CD 3.35Å; E1099-K1102 WeakPolarHBondContact O-CG 3.45Å; E1099-K1102 PolarHBondContact O-N 2.8Å
1100	R	87.2	Confident	87.4	Confident	80 Å²	80	57.7 Å²	57.7	30%	0.302	29%	0.292	S	S	.	.	G	3₁₀ helix	trans	-62.3	-31.4	-179.2	-55.4	-168.2	-159.6	-173.6	19.1	112.6	A1077 M1078 E1093 I1094 S1097 K1102 D1103	A1077-R1100 WeakPolarHBondContact O-CB 3.43Å; M1078-R1100 PolarHBondContact SD-NH1 3.24Å; E1093-R1100 IonicContact OE1-CZ 2.67Å; E1093-R1100 IonicContact OE1-NH1 3.13Å; E1093-R1100 IonicContact OE1-NH2 2.95Å; E1093-R1100 PolarHBondContact OE1-NH2 3.48Å; I1094-R1100 HydrophobicContact CD1-CB 4.11Å; S1097-R1100 PolarHBondContact O-N 3.48Å; R1100-K1102 PolarHBondContact O-N 3.02Å; R1100-D1103 PolarHBondContact O-N 3.4Å
1101	L	86.6	Confident	87.7	Confident	1 Å²	1	61.9 Å²	61.9	1%	0.005	32%	0.317	C	S	.	.	G	3₁₀ helix	trans	-59.2	-7.1	173.5	-68.9	174.5	0	0	0	114.9	A1077 I1094 E1099 R1129 L1132	A1077-L1101 HydrophobicContact CB-CD2 3.91Å; I1094-L1101 HydrophobicContact CD1-CD2 4.39Å; I1094-L1101 HydrophobicContact CD1-CG 4.35Å; I1094-L1101 HydrophobicContact CG2-CD1 3.68Å; I1094-L1101 HydrophobicContact CG2-CD2 4Å; I1094-L1101 HydrophobicContact CG2-CG 3.84Å; E1099-L1101 PolarHBondContact O-N 3.5Å; L1101-R1129 HydrophobicContact CB-CG 3.99Å; L1101-R1129 VanDerWaalsContact O-CD 3.22Å; L1101-R1129 WeakPolarHBondContact O-CD 3.32Å; L1101-L1132 HydrophobicContact CD1-CB 3.6Å; L1101-L1132 HydrophobicContact CD1-CD1 4.32Å; L1101-L1132 HydrophobicContact CD2-CD1 4.47Å
1102	K	86.3	Confident	87.7	Confident	142 Å²	142	65 Å²	65	62%	0.617	33%	0.332	S	S	*	.	G	3₁₀ helix	trans	-87.5	-22.1	175.7	-62	164.7	-169.1	152.2	0	113.1	E1099 R1100	E1099-K1102 HydrophobicContact CB-CD 4.36Å; E1099-K1102 VanDerWaalsContact O-CB 3.29Å; E1099-K1102 WeakPolarHBondContact O-CB 3.28Å; E1099-K1102 WeakPolarHBondContact O-CD 3.35Å; E1099-K1102 WeakPolarHBondContact O-CG 3.45Å; E1099-K1102 PolarHBondContact O-N 2.8Å; R1100-K1102 PolarHBondContact O-N 3.02Å
1103	D	84.4	Confident	87.9	Confident	150 Å²	150	60 Å²	60	80%	0.802	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.6	-13.1	-177	-60.3	-43	0	0	0	111.9	R1100	R1100-D1103 PolarHBondContact O-N 3.4Å
1104	L	87.6	Confident	87.9	Confident	32 Å²	32	62 Å²	62	17%	0.168	32%	0.318	C	S	.	.	S	Bend	trans	-75.8	124.5	174.2	-175.2	63.8	0	0	0	112.3	M1073 D1076 A1077 L1106	M1073-L1104 HydrophobicContact CB-CD2 4.14Å; M1073-L1104 HydrophobicContact CG-CD2 4.2Å; D1076-L1104 HydrophobicContact CB-CD1 3.79Å; D1076-L1104 HydrophobicContact CB-CD2 4.43Å; A1077-L1104 HydrophobicContact CB-CD2 4.4Å; L1104-L1106 HydrophobicContact CD2-CD2 3.75Å; L1104-L1106 HydrophobicContact CG-CD2 3.98Å; L1104-L1106 PolarHBondContact O-N 3.28Å
1105	D	89.6	Confident	88	Confident	96 Å²	96	71.2 Å²	71.2	51%	0.513	35%	0.353	S	S	.	.			trans	-80.2	94.5	175.3	-169.8	-22.1	0	0	0	111.2	D1107 A1108 F1109	D1105-D1107 VanDerWaalsContact C-N 3.3Å; D1105-D1107 PolarHBondContact O-N 3.38Å; D1105-D1107 PolarHBondContact OD1-N 3.15Å; D1105-A1108 HydrophobicContact CB-CB 4Å; D1105-A1108 PolarHBondContact O-N 2.87Å; D1105-A1108 PolarHBondContact OD1-N 3.13Å; D1105-F1109 PolarHBondContact O-N 2.82Å
1106	L	89.6	Confident	88.1	Confident	2 Å²	2	73.5 Å²	73.5	1%	0.01	36%	0.362	C	S	.	.	H	α-helix	trans	-70.2	-22.9	179	-59	-175.7	0	0	0	113.8	M1073 L1104 A1110 L1125 Y1126 R1129	M1073-L1106 HydrophobicContact CE-CD2 3.83Å; L1104-L1106 HydrophobicContact CD2-CD2 3.75Å; L1104-L1106 HydrophobicContact CG-CD2 3.98Å; L1104-L1106 PolarHBondContact O-N 3.28Å; L1106-A1110 VanDerWaalsContact O-CB 3.28Å; L1106-A1110 WeakPolarHBondContact O-CB 3.38Å; L1106-A1110 PolarHBondContact O-N 3.05Å; L1106-L1125 HydrophobicContact CB-CB 4.38Å; L1106-L1125 HydrophobicContact CD1-CB 4.34Å; L1106-L1125 HydrophobicContact CD2-CB 4.4Å; L1106-Y1126 HydrophobicContact CB-CE1 4.19Å; L1106-Y1126 HydrophobicContact CD1-CD1 3.61Å; L1106-Y1126 HydrophobicContact CD1-CE1 3.75Å; L1106-Y1126 HydrophobicContact CD1-CG 4.19Å; L1106-Y1126 HydrophobicContact CG-CE1 4.42Å; L1106-R1129 HydrophobicContact CD1-CB 3.92Å; L1106-R1129 HydrophobicContact CD1-CG 4.3Å
1107	D	90.2	Very high	88	Confident	72 Å²	72	68.8 Å²	68.8	39%	0.385	36%	0.357	S	S	.	.	H	α-helix	trans	-73.7	-40.1	176.8	-67.9	0.4	0	0	0	109	D1105 A1110 V1111 Y1126 M1708	D1105-D1107 VanDerWaalsContact C-N 3.3Å; D1105-D1107 PolarHBondContact O-N 3.38Å; D1105-D1107 PolarHBondContact OD1-N 3.15Å; D1107-A1110 PolarHBondContact O-N 2.84Å; D1107-V1111 WeakPolarHBondContact O-CG2 3.07Å; D1107-V1111 PolarHBondContact O-N 3.03Å; D1107-Y1126 WeakPolarHBondContact OD1-CE2 3.32Å; D1107-Y1126 PolarHBondContact OD1-OH 2.67Å; D1107-M1708 VanDerWaalsContact OD2-CE 3.31Å; D1107-M1708 WeakPolarHBondContact OD2-CE 3.38Å
1108	A	90.1	Very high	87.7	Confident	53 Å²	53	72.5 Å²	72.5	44%	0.438	37%	0.371	S	S	.	.	H	α-helix	trans	-64.8	-43.6	171.6	0	0	0	0	0	112.5	D1105 A1110 V1111 E1112	D1105-A1108 HydrophobicContact CB-CB 4Å; D1105-A1108 PolarHBondContact O-N 2.87Å; D1105-A1108 PolarHBondContact OD1-N 3.13Å; A1108-A1110 VanDerWaalsContact C-N 3.32Å; A1108-A1110 PolarHBondContact O-N 3.08Å; A1108-V1111 PolarHBondContact O-N 2.9Å; A1108-E1112 PolarHBondContact O-N 3.21Å; A1108-E1112 VanDerWaalsContact O-N 3.14Å
1109	F	88.2	Confident	87.3	Confident	27 Å²	27	72 Å²	72	12%	0.118	37%	0.372	C	S	.	.	H	α-helix	trans	-63.1	-37.6	176.3	-166.5	-83.1	0	0	0	111.9	K1072 M1073 D1076 D1105 E1112 L1113 L1125	K1072-F1109 HydrophobicContact CB-CE2 4.34Å; K1072-F1109 HydrophobicContact CB-CZ 3.92Å; M1073-F1109 HydrophobicContact CG-CE1 4.33Å; M1073-F1109 HydrophobicContact CG-CZ 4.26Å; D1076-F1109 WeakPolarHBondContact OD2-CD2 3.27Å; D1076-F1109 VanDerWaalsContact OD2-CE2 3.25Å; D1076-F1109 WeakPolarHBondContact OD2-CE2 3.45Å; D1105-F1109 PolarHBondContact O-N 2.82Å; F1109-E1112 PolarHBondContact O-N 3.4Å; F1109-L1113 HydrophobicContact CD1-CD1 4.04Å; F1109-L1113 HydrophobicContact CD1-CG 4.1Å; F1109-L1113 HydrophobicContact CE1-CD1 3.81Å; F1109-L1113 HydrophobicContact CE1-CD2 4.31Å; F1109-L1113 HydrophobicContact CE1-CG 3.94Å; F1109-L1113 PolarHBondContact O-N 3.45Å; F1109-L1125 HydrophobicContact CD1-CD1 3.75Å; F1109-L1125 HydrophobicContact CD1-CD2 3.62Å; F1109-L1125 HydrophobicContact CD1-CG 4.35Å; F1109-L1125 HydrophobicContact CE1-CD2 3.68Å
1110	A	89.1	Confident	87	Confident	7 Å²	7	69.2 Å²	69.2	6%	0.058	36%	0.364	C	S	.	.	H	α-helix	trans	-62.1	-42.5	174.6	0	0	0	0	0	112.6	L1106 D1107 A1108 E1112 L1113 E1114 L1125	L1106-A1110 VanDerWaalsContact O-CB 3.28Å; L1106-A1110 WeakPolarHBondContact O-CB 3.38Å; L1106-A1110 PolarHBondContact O-N 3.05Å; D1107-A1110 PolarHBondContact O-N 2.84Å; A1108-A1110 VanDerWaalsContact C-N 3.32Å; A1108-A1110 PolarHBondContact O-N 3.08Å; A1110-E1112 VanDerWaalsContact C-N 3.32Å; A1110-E1112 PolarHBondContact O-N 3.41Å; A1110-L1113 PolarHBondContact O-N 3.47Å; A1110-E1114 WeakPolarHBondContact O-CB 3.23Å; A1110-E1114 PolarHBondContact O-N 3.3Å; A1110-L1125 HydrophobicContact CB-CD1 3.78Å
1111	V	91.3	Very high	87	Confident	90 Å²	90	66.4 Å²	66.4	55%	0.545	35%	0.354	S	S	.	.	H	α-helix	trans	-65.2	-35.6	177.3	170.2	0	0	0	0	111.6	D1107 A1108 E1114 R1115	D1107-V1111 WeakPolarHBondContact O-CG2 3.07Å; D1107-V1111 PolarHBondContact O-N 3.03Å; A1108-V1111 PolarHBondContact O-N 2.9Å; V1111-E1114 PolarHBondContact O-N 3.45Å; V1111-R1115 VanDerWaalsContact O-CB 3.26Å; V1111-R1115 WeakPolarHBondContact O-CB 3.2Å; V1111-R1115 PolarHBondContact O-N 3.27Å
1112	E	87.2	Confident	87.1	Confident	67 Å²	67	68 Å²	68	31%	0.313	37%	0.365	S	S	.	.	H	α-helix	trans	-71.9	-37.9	176	-173.5	56	-149.3	0	0	112.3	A1108 F1109 A1110 R1115 Q1116	A1108-E1112 PolarHBondContact O-N 3.21Å; A1108-E1112 VanDerWaalsContact O-N 3.14Å; F1109-E1112 PolarHBondContact O-N 3.4Å; A1110-E1112 VanDerWaalsContact C-N 3.32Å; A1110-E1112 PolarHBondContact O-N 3.41Å; E1112-R1115 VanDerWaalsContact CD-NH1 3.3Å; E1112-R1115 PolarHBondContact O-N 2.94Å; E1112-R1115 IonicContact OE1-CZ 2.72Å; E1112-R1115 IonicContact OE1-NH1 2.7Å; E1112-R1115 PolarHBondContact OE1-NH1 2.73Å; E1112-R1115 WeakPolarHBondContact OE2-CD 3.46Å; E1112-R1115 IonicContact OE2-CZ 3.3Å; E1112-R1115 IonicContact OE2-NE 2.97Å; E1112-R1115 IonicContact OE2-NH1 3.13Å; E1112-R1115 PolarHBondContact OE2-NH1 2.75Å; E1112-Q1116 WeakPolarHBondContact O-CB 3.46Å; E1112-Q1116 VanDerWaalsContact O-CG 3.28Å; E1112-Q1116 WeakPolarHBondContact O-CG 3.47Å; E1112-Q1116 PolarHBondContact O-N 2.95Å; E1112-Q1116 PolarHBondContact OE1-NE2 3.26Å
1113	L	87.4	Confident	87.3	Confident	5 Å²	5	63.8 Å²	63.8	3%	0.026	35%	0.349	C	S	.	.	H	α-helix	trans	-62.5	-41.4	170	-75	-174.8	0	0	0	112.4	W1069 F1109 A1110 Q1116 G1117 F1118 K1121 L1125	W1069-L1113 HydrophobicContact CD2-CD1 4.19Å; W1069-L1113 HydrophobicContact CG-CD1 4.27Å; F1109-L1113 HydrophobicContact CD1-CD1 4.04Å; F1109-L1113 HydrophobicContact CD1-CG 4.1Å; F1109-L1113 HydrophobicContact CE1-CD1 3.81Å; F1109-L1113 HydrophobicContact CE1-CD2 4.31Å; F1109-L1113 HydrophobicContact CE1-CG 3.94Å; F1109-L1113 PolarHBondContact O-N 3.45Å; A1110-L1113 PolarHBondContact O-N 3.47Å; L1113-Q1116 PolarHBondContact O-N 2.93Å; L1113-G1117 PolarHBondContact O-N 2.87Å; L1113-F1118 HydrophobicContact CB-CB 4.42Å; L1113-F1118 HydrophobicContact CD2-CD2 3.96Å; L1113-F1118 PolarHBondContact O-N 3.19Å; L1113-K1121 HydrophobicContact CD1-CB 4.09Å; L1113-K1121 HydrophobicContact CD1-CG 4.24Å; L1113-L1125 HydrophobicContact CD1-CD1 4.31Å; L1113-L1125 HydrophobicContact CD1-CD2 4.26Å
1114	E	87.7	Confident	87.7	Confident	106 Å²	106	57.3 Å²	57.3	50%	0.495	32%	0.315	S	S	.	.	H	α-helix	trans	-63.2	-45.4	176.4	-178.4	165.3	-127	0	0	111.2	A1110 V1111 Q1116 G1117	A1110-E1114 WeakPolarHBondContact O-CB 3.23Å; A1110-E1114 PolarHBondContact O-N 3.3Å; V1111-E1114 PolarHBondContact O-N 3.45Å; E1114-Q1116 VanDerWaalsContact C-N 3.25Å; E1114-Q1116 PolarHBondContact O-N 2.95Å; E1114-G1117 PolarHBondContact O-N 3.16Å
1115	R	90.4	Very high	87.9	Confident	195 Å²	195	55.8 Å²	55.8	74%	0.736	31%	0.307	S	S	*	.	H	α-helix	trans	-60.4	-30.8	173.5	175.2	179.5	164.3	-132.9	-9.1	113.3	V1111 E1112 G1117	V1111-R1115 VanDerWaalsContact O-CB 3.26Å; V1111-R1115 WeakPolarHBondContact O-CB 3.2Å; V1111-R1115 PolarHBondContact O-N 3.27Å; E1112-R1115 VanDerWaalsContact CD-NH1 3.3Å; E1112-R1115 PolarHBondContact O-N 2.94Å; E1112-R1115 IonicContact OE1-CZ 2.72Å; E1112-R1115 IonicContact OE1-NH1 2.7Å; E1112-R1115 PolarHBondContact OE1-NH1 2.73Å; E1112-R1115 WeakPolarHBondContact OE2-CD 3.46Å; E1112-R1115 IonicContact OE2-CZ 3.3Å; E1112-R1115 IonicContact OE2-NE 2.97Å; E1112-R1115 IonicContact OE2-NH1 3.13Å; E1112-R1115 PolarHBondContact OE2-NH1 2.75Å; R1115-G1117 VanDerWaalsContact C-N 3.26Å
1116	Q	88.3	Confident	88.1	Confident	98 Å²	98	52.9 Å²	52.9	46%	0.458	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.7	-2.7	174	-71.3	173.4	25.9	0	0	113.5	E1112 L1113 E1114 F1118	E1112-Q1116 WeakPolarHBondContact O-CB 3.46Å; E1112-Q1116 VanDerWaalsContact O-CG 3.28Å; E1112-Q1116 WeakPolarHBondContact O-CG 3.47Å; E1112-Q1116 PolarHBondContact O-N 2.95Å; E1112-Q1116 PolarHBondContact OE1-NE2 3.26Å; L1113-Q1116 PolarHBondContact O-N 2.93Å; E1114-Q1116 VanDerWaalsContact C-N 3.25Å; E1114-Q1116 PolarHBondContact O-N 2.95Å; Q1116-F1118 HydrophobicContact CB-CD2 3.81Å; Q1116-F1118 HydrophobicContact CB-CE2 3.83Å
1117	G	84	Confident	88.2	Confident	65 Å²	65	55.1 Å²	55.1	67%	0.67	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	92.8	5.2	175.7	0	0	0	0	0	115.1	L1113 E1114 R1115 G1119	L1113-G1117 PolarHBondContact O-N 2.87Å; E1114-G1117 PolarHBondContact O-N 3.16Å; R1115-G1117 VanDerWaalsContact C-N 3.26Å; G1117-G1119 PolarHBondContact O-N 2.96Å
1118	F	81	Confident	88.3	Confident	99 Å²	99	51.9 Å²	51.9	43%	0.434	28%	0.284	S	S	.	.	S	Bend	trans	-78.6	-8.3	175.1	-59.8	-73.8	0	0	0	113	W1069 L1113 Q1116 K1121	W1069-F1118 HydrophobicContact CZ2-CB 4.35Å; W1069-F1118 HydrophobicContact CZ2-CD1 4.32Å; W1069-F1118 HydrophobicContact CZ2-CG 4.46Å; L1113-F1118 HydrophobicContact CB-CB 4.42Å; L1113-F1118 HydrophobicContact CD2-CD2 3.96Å; L1113-F1118 PolarHBondContact O-N 3.19Å; Q1116-F1118 HydrophobicContact CB-CD2 3.81Å; Q1116-F1118 HydrophobicContact CB-CE2 3.83Å; F1118-K1121 WeakPolarHBondContact O-CE 3.32Å
1119	G	79.5	Confident	88.4	Confident	24 Å²	24	51.4 Å²	51.4	25%	0.247	27%	0.27	C	S	.	.			trans	74	177.1	-174.3	0	0	0	0	0	113.1	G1117 K1121	G1117-G1119 PolarHBondContact O-N 2.96Å; G1119-K1121 PolarHBondContact O-N 3.48Å
1120	S	81.8	Confident	88.6	Confident	43 Å²	43	53 Å²	53	30%	0.301	28%	0.28	S	S	.	.			trans	-54.8	130.3	171.1	178.3	0	0	0	0	111.3	E372	E372-S1120 WeakPolarHBondContact CG-O 3.21Å; E372-S1120 PolarHBondContact OE2-OG 3.32Å
1121	K	86.3	Confident	88.7	Confident	21 Å²	21	53.1 Å²	53.1	9%	0.091	28%	0.279	C	S	.	.			trans	-130.7	21.8	172.5	-59.3	-61.8	163.9	-169.8	0	112.2	E372 Y373 W1069 L1113 F1118 G1119 I1123 T1124 L1125	E372-K1121 WeakPolarHBondContact OE1-CA 3.44Å; Y373-K1121 PolarHBondContact OH-NZ 2.77Å; Y373-K1121 VanDerWaalsContact OH-NZ 3.14Å; W1069-K1121 HydrophobicContact CE3-CG 4.44Å; W1069-K1121 HydrophobicContact CH2-CD 3.67Å; W1069-K1121 HydrophobicContact CH2-CG 3.82Å; W1069-K1121 HydrophobicContact CZ2-CG 4.45Å; W1069-K1121 HydrophobicContact CZ3-CB 4.37Å; W1069-K1121 HydrophobicContact CZ3-CD 3.7Å; W1069-K1121 HydrophobicContact CZ3-CG 3.8Å; L1113-K1121 HydrophobicContact CD1-CB 4.09Å; L1113-K1121 HydrophobicContact CD1-CG 4.24Å; F1118-K1121 WeakPolarHBondContact O-CE 3.32Å; G1119-K1121 PolarHBondContact O-N 3.48Å; K1121-I1123 PolarHBondContact O-N 2.89Å; K1121-T1124 WeakPolarHBondContact O-CB 3.43Å; K1121-T1124 PolarHBondContact O-N 2.8Å; K1121-T1124 VanDerWaalsContact O-N 3.15Å; K1121-L1125 HydrophobicContact CB-CD1 4.48Å; K1121-L1125 HydrophobicContact CB-CG 4.44Å; K1121-L1125 VanDerWaalsContact O-CG 3.27Å; K1121-L1125 WeakPolarHBondContact O-CG 3.4Å; K1121-L1125 PolarHBondContact O-N 3.45Å
1122	S	89.1	Confident	88.7	Confident	35 Å²	35	49 Å²	49	25%	0.245	25%	0.254	C	S	.	.	H	α-helix	trans	-50	-54.4	-174.3	61.9	0	0	0	0	113.4	E372 L1125 Y1126	E372-S1122 PolarHBondContact OE1-N 3.49Å; E372-S1122 VanDerWaalsContact OE1-N 3.14Å; E372-S1122 PolarHBondContact OE2-N 3.06Å; E372-S1122 VanDerWaalsContact OE2-N 3.16Å; E372-S1122 PolarHBondContact OE2-OG 2.93Å; S1122-L1125 PolarHBondContact O-N 3.39Å; S1122-Y1126 WeakPolarHBondContact O-CD2 3.49Å; S1122-Y1126 PolarHBondContact O-N 3.07Å; S1122-Y1126 VanDerWaalsContact O-N 3.17Å
1123	I	91.6	Very high	88.8	Confident	53 Å²	53	48.3 Å²	48.3	27%	0.272	26%	0.257	S	S	.	.	H	α-helix	trans	-66.3	-43	179.5	-48.1	179.2	0	0	0	109.9	K371 E372 K375 K1121 L1125 Y1126 D1127	K371-I1123 HydrophobicContact CB-CB 4.39Å; K371-I1123 HydrophobicContact CB-CD1 4.2Å; K371-I1123 HydrophobicContact CB-CG2 4.03Å; K371-I1123 HydrophobicContact CD-CG2 3.82Å; E372-I1123 VanDerWaalsContact OE1-CA 3.32Å; E372-I1123 WeakPolarHBondContact OE1-CA 3.47Å; E372-I1123 VanDerWaalsContact OE1-CB 3.23Å; E372-I1123 WeakPolarHBondContact OE1-CB 3.33Å; E372-I1123 PolarHBondContact OE1-N 3.37Å; K375-I1123 HydrophobicContact CB-CD1 4.46Å; K1121-I1123 PolarHBondContact O-N 2.89Å; I1123-L1125 VanDerWaalsContact C-N 3.32Å; I1123-L1125 PolarHBondContact O-N 2.91Å; I1123-Y1126 PolarHBondContact O-N 3.21Å; I1123-Y1126 VanDerWaalsContact O-N 3.15Å; I1123-D1127 PolarHBondContact O-N 3.2Å
1124	T	91.7	Very high	88.8	Confident	14 Å²	14	50.9 Å²	50.9	9%	0.086	28%	0.275	C	S	.	.	H	α-helix	trans	-57.9	-42.4	177.3	-57.1	0	0	0	0	112.1	E372 T1066 W1069 K1121 D1127 I1128	E372-T1124 PolarHBondContact OE1-N 2.93Å; E372-T1124 VanDerWaalsContact OE1-N 3.12Å; T1066-T1124 HydrophobicContact CG2-CG2 4.1Å; W1069-T1124 HydrophobicContact CE3-CG2 4.34Å; W1069-T1124 HydrophobicContact CZ3-CG2 4.17Å; K1121-T1124 WeakPolarHBondContact O-CB 3.43Å; K1121-T1124 PolarHBondContact O-N 2.8Å; K1121-T1124 VanDerWaalsContact O-N 3.15Å; T1124-D1127 PolarHBondContact O-N 3.04Å; T1124-I1128 HydrophobicContact CG2-CD1 4.06Å; T1124-I1128 VanDerWaalsContact O-CG1 3.28Å; T1124-I1128 WeakPolarHBondContact O-CG1 3.46Å; T1124-I1128 PolarHBondContact O-N 2.67Å
1125	L	92.4	Very high	88.9	Confident	0 Å²	0	49 Å²	49	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-66.3	-39.6	176.4	-64.6	162.2	0	0	0	111.6	M1073 L1106 F1109 A1110 L1113 K1121 S1122 I1123 I1128 R1129	M1073-L1125 HydrophobicContact CG-CD2 4.23Å; M1073-L1125 HydrophobicContact SD-CB 4.42Å; M1073-L1125 HydrophobicContact SD-CD2 3.47Å; M1073-L1125 WeakPolarHBondContact SD-CD2 3.37Å; L1106-L1125 HydrophobicContact CB-CB 4.38Å; L1106-L1125 HydrophobicContact CD1-CB 4.34Å; L1106-L1125 HydrophobicContact CD2-CB 4.4Å; F1109-L1125 HydrophobicContact CD1-CD1 3.75Å; F1109-L1125 HydrophobicContact CD1-CD2 3.62Å; F1109-L1125 HydrophobicContact CD1-CG 4.35Å; F1109-L1125 HydrophobicContact CE1-CD2 3.68Å; A1110-L1125 HydrophobicContact CB-CD1 3.78Å; L1113-L1125 HydrophobicContact CD1-CD1 4.31Å; L1113-L1125 HydrophobicContact CD1-CD2 4.26Å; K1121-L1125 HydrophobicContact CB-CD1 4.48Å; K1121-L1125 HydrophobicContact CB-CG 4.44Å; K1121-L1125 VanDerWaalsContact O-CG 3.27Å; K1121-L1125 WeakPolarHBondContact O-CG 3.4Å; K1121-L1125 PolarHBondContact O-N 3.45Å; S1122-L1125 PolarHBondContact O-N 3.39Å; I1123-L1125 VanDerWaalsContact C-N 3.32Å; I1123-L1125 PolarHBondContact O-N 2.91Å; L1125-I1128 PolarHBondContact O-N 2.98Å; L1125-R1129 WeakPolarHBondContact O-CB 3.39Å; L1125-R1129 PolarHBondContact O-N 2.99Å
1126	Y	92.8	Very high	88.8	Confident	34 Å²	34	40.8 Å²	40.8	13%	0.133	24%	0.237	C	C	.	.	H	α-helix	trans	-64.1	-37.8	172.7	-77.3	-62.8	0	0	0	112.6	L1106 D1107 S1122 I1123 N1130 M1708	L1106-Y1126 HydrophobicContact CB-CE1 4.19Å; L1106-Y1126 HydrophobicContact CD1-CD1 3.61Å; L1106-Y1126 HydrophobicContact CD1-CE1 3.75Å; L1106-Y1126 HydrophobicContact CD1-CG 4.19Å; L1106-Y1126 HydrophobicContact CG-CE1 4.42Å; D1107-Y1126 WeakPolarHBondContact OD1-CE2 3.32Å; D1107-Y1126 PolarHBondContact OD1-OH 2.67Å; S1122-Y1126 WeakPolarHBondContact O-CD2 3.49Å; S1122-Y1126 PolarHBondContact O-N 3.07Å; S1122-Y1126 VanDerWaalsContact O-N 3.17Å; I1123-Y1126 PolarHBondContact O-N 3.21Å; I1123-Y1126 VanDerWaalsContact O-N 3.15Å; Y1126-N1130 WeakPolarHBondContact O-CB 3.46Å; Y1126-N1130 PolarHBondContact O-N 3.01Å; Y1126-N1130 VanDerWaalsContact O-N 3.08Å; Y1126-N1130 PolarHBondContact O-ND2 2.83Å; Y1126-N1130 PolarHBondContact O-OD1 3.41Å; Y1126-M1708 VanDerWaalsContact OH-CE 3.26Å; Y1126-M1708 WeakPolarHBondContact OH-CE 3.47Å
1127	D	91.9	Very high	88.8	Confident	49 Å²	49	41.1 Å²	41.1	26%	0.262	24%	0.237	S	C	.	.	H	α-helix	trans	-64.5	-47.4	173.2	-71.6	-58.1	0	0	0	111.5	K371 I1123 T1124 R1129 N1130 E1131	K371-D1127 WeakPolarHBondContact CD-OD2 3.48Å; K371-D1127 WeakPolarHBondContact CE-OD2 3.43Å; K371-D1127 IonicContact NZ-OD1 3.78Å; K371-D1127 PolarHBondContact NZ-OD1 3.46Å; K371-D1127 IonicContact NZ-OD2 2.76Å; K371-D1127 PolarHBondContact NZ-OD2 2.67Å; I1123-D1127 PolarHBondContact O-N 3.2Å; T1124-D1127 PolarHBondContact O-N 3.04Å; D1127-R1129 VanDerWaalsContact C-N 3.34Å; D1127-R1129 PolarHBondContact O-N 3.3Å; D1127-N1130 WeakPolarHBondContact O-CB 3.02Å; D1127-N1130 PolarHBondContact O-N 2.65Å; D1127-N1130 VanDerWaalsContact O-N 3.09Å; D1127-E1131 PolarHBondContact O-N 3.43Å
1128	I	92.9	Very high	89.1	Confident	5 Å²	5	40.2 Å²	40.2	3%	0.026	22%	0.216	C	C	.	.	H	α-helix	trans	-56.4	-47.8	175.6	-68.6	165.1	0	0	0	110.3	V1062 W1069 A1070 M1073 T1124 L1125 N1130 E1131 L1132	V1062-I1128 HydrophobicContact CG1-CG1 4.19Å; V1062-I1128 HydrophobicContact CG2-CB 4.44Å; V1062-I1128 HydrophobicContact CG2-CG1 4.11Å; V1062-I1128 HydrophobicContact CG2-CG2 4.26Å; W1069-I1128 HydrophobicContact CB-CD1 4.43Å; A1070-I1128 HydrophobicContact CB-CG2 3.78Å; M1073-I1128 HydrophobicContact CE-CB 4.16Å; M1073-I1128 HydrophobicContact CE-CG2 3.76Å; M1073-I1128 HydrophobicContact SD-CB 4.09Å; M1073-I1128 HydrophobicContact SD-CD1 4.41Å; M1073-I1128 HydrophobicContact SD-CG2 3.66Å; T1124-I1128 HydrophobicContact CG2-CD1 4.06Å; T1124-I1128 VanDerWaalsContact O-CG1 3.28Å; T1124-I1128 WeakPolarHBondContact O-CG1 3.46Å; T1124-I1128 PolarHBondContact O-N 2.67Å; L1125-I1128 PolarHBondContact O-N 2.98Å; I1128-N1130 VanDerWaalsContact C-N 3.28Å; I1128-N1130 PolarHBondContact O-N 2.71Å; I1128-E1131 PolarHBondContact O-N 3.43Å; I1128-L1132 HydrophobicContact CG2-CD1 3.87Å; I1128-L1132 HydrophobicContact CG2-CG 4.26Å; I1128-L1132 WeakPolarHBondContact O-CB 3.27Å; I1128-L1132 WeakPolarHBondContact O-CG 3.33Å; I1128-L1132 PolarHBondContact O-N 2.94Å
1129	R	92.8	Very high	89.5	Confident	43 Å²	43	40.3 Å²	40.3	16%	0.162	22%	0.215	C	C	.	.	H	α-helix	trans	-57.4	-40.6	176.5	-168.6	-166.7	61	-177.5	2.4	112.1	M1073 L1101 L1106 L1125 D1127 S1133 Q1709	M1073-R1129 HydrophobicContact CE-CB 4.12Å; L1101-R1129 HydrophobicContact CB-CG 3.99Å; L1101-R1129 VanDerWaalsContact O-CD 3.22Å; L1101-R1129 WeakPolarHBondContact O-CD 3.32Å; L1106-R1129 HydrophobicContact CD1-CB 3.92Å; L1106-R1129 HydrophobicContact CD1-CG 4.3Å; L1125-R1129 WeakPolarHBondContact O-CB 3.39Å; L1125-R1129 PolarHBondContact O-N 2.99Å; D1127-R1129 VanDerWaalsContact C-N 3.34Å; D1127-R1129 PolarHBondContact O-N 3.3Å; R1129-S1133 WeakPolarHBondContact O-CB 3.25Å; R1129-S1133 PolarHBondContact O-N 2.95Å; R1129-S1133 PolarHBondContact O-OG 3.08Å; R1129-Q1709 VanDerWaalsContact NH2-OE1 3.09Å
1130	N	91.5	Very high	90.2	Very high	61 Å²	61	39.8 Å²	39.8	33%	0.326	21%	0.205	S	C	.	.	H	α-helix	trans	-70.5	-37.5	-178.9	-66.6	-26	0	0	0	112.3	Y1126 D1127 I1128 S1133 C1134	Y1126-N1130 WeakPolarHBondContact O-CB 3.46Å; Y1126-N1130 PolarHBondContact O-N 3.01Å; Y1126-N1130 VanDerWaalsContact O-N 3.08Å; Y1126-N1130 PolarHBondContact O-ND2 2.83Å; Y1126-N1130 PolarHBondContact O-OD1 3.41Å; D1127-N1130 WeakPolarHBondContact O-CB 3.02Å; D1127-N1130 PolarHBondContact O-N 2.65Å; D1127-N1130 VanDerWaalsContact O-N 3.09Å; I1128-N1130 VanDerWaalsContact C-N 3.28Å; I1128-N1130 PolarHBondContact O-N 2.71Å; N1130-S1133 PolarHBondContact O-N 3.18Å; N1130-C1134 PolarHBondContact O-N 3.45Å
1131	E	92.1	Very high	90.8	Very high	8 Å²	8	40.7 Å²	40.7	4%	0.037	21%	0.209	C	C	.	.	H	α-helix	trans	-72.5	-43.1	175.4	-72.8	-70.7	136.9	0	0	112	R1061 V1062 D1127 I1128 S1133 C1134 L1135 Y1136	R1061-E1131 HydrophobicContact CB-CG 3.94Å; R1061-E1131 IonicContact CZ-OE1 2.94Å; R1061-E1131 PolarHBondContact N-OE2 3.02Å; R1061-E1131 IonicContact NH1-OE1 3.12Å; R1061-E1131 PolarHBondContact NH1-OE1 3.15Å; R1061-E1131 IonicContact NH1-OE2 2.69Å; V1062-E1131 HydrophobicContact CG2-CB 4.3Å; D1127-E1131 PolarHBondContact O-N 3.43Å; I1128-E1131 PolarHBondContact O-N 3.43Å; E1131-S1133 PolarHBondContact O-N 3.38Å; E1131-C1134 CarbonylContact O-C 3.49Å; E1131-C1134 PolarHBondContact O-N 3.12Å; E1131-L1135 WeakPolarHBondContact O-CA 3.48Å; E1131-L1135 PolarHBondContact O-N 2.83Å; E1131-Y1136 WeakPolarHBondContact OE2-CA 3.48Å; E1131-Y1136 PolarHBondContact OE2-N 2.89Å
1132	L	90.9	Very high	91.2	Very high	3 Å²	3	43.7 Å²	43.7	2%	0.016	23%	0.23	C	C	.	.	H	α-helix	trans	-62.2	-28.4	171.6	-67.7	177.4	0	0	0	112.2	L1057 L1091 L1095 L1101 I1128 C1134	L1057-L1132 HydrophobicContact CD2-CD2 3.9Å; L1091-L1132 HydrophobicContact CD2-CD1 4.42Å; L1091-L1132 HydrophobicContact CD2-CD2 3.87Å; L1095-L1132 HydrophobicContact CD2-CD2 4.43Å; L1095-L1132 WeakPolarHBondContact CD2-O 3.26Å; L1101-L1132 HydrophobicContact CD1-CB 3.6Å; L1101-L1132 HydrophobicContact CD1-CD1 4.32Å; L1101-L1132 HydrophobicContact CD2-CD1 4.47Å; I1128-L1132 HydrophobicContact CG2-CD1 3.87Å; I1128-L1132 HydrophobicContact CG2-CG 4.26Å; I1128-L1132 WeakPolarHBondContact O-CB 3.27Å; I1128-L1132 WeakPolarHBondContact O-CG 3.33Å; I1128-L1132 PolarHBondContact O-N 2.94Å; L1132-C1134 VanDerWaalsContact C-N 3.34Å
1133	S	89.7	Confident	91.4	Very high	53 Å²	53	44.4 Å²	44.4	37%	0.371	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74	-21.6	172.6	-60.9	0	0	0	0	113.9	R1129 N1130 E1131	R1129-S1133 WeakPolarHBondContact O-CB 3.25Å; R1129-S1133 PolarHBondContact O-N 2.95Å; R1129-S1133 PolarHBondContact O-OG 3.08Å; N1130-S1133 PolarHBondContact O-N 3.18Å; E1131-S1133 PolarHBondContact O-N 3.38Å
1134	C	86.6	Confident	91.4	Very high	59 Å²	59	47 Å²	47	40%	0.399	25%	0.247	S	C	.	.	S	Bend	trans	-169.5	89.4	-177.5	-168.5	0	0	0	0	111	N1130 E1131 L1132 Y1136 K1137	N1130-C1134 PolarHBondContact O-N 3.45Å; E1131-C1134 CarbonylContact O-C 3.49Å; E1131-C1134 PolarHBondContact O-N 3.12Å; L1132-C1134 VanDerWaalsContact C-N 3.34Å; C1134-Y1136 PolarHBondContact O-N 2.96Å; C1134-K1137 HydrophobicContact CB-CB 4.15Å; C1134-K1137 HydrophobicContact CB-CD 4.06Å; C1134-K1137 WeakPolarHBondContact O-CB 3.26Å; C1134-K1137 PolarHBondContact O-N 3.33Å
1135	L	88.8	Confident	91.3	Very high	66 Å²	66	51 Å²	51	35%	0.346	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.8	127	-175.2	-66.9	175.8	0	0	0	113.5	G1059 L1095 E1131 K1137	G1059-L1135 WeakPolarHBondContact O-CB 3.44Å; L1095-L1135 HydrophobicContact CD1-CD1 4.48Å; L1095-L1135 HydrophobicContact CD2-CD1 4.04Å; L1095-L1135 HydrophobicContact CD2-CD2 3.93Å; L1095-L1135 HydrophobicContact CD2-CG 3.93Å; E1131-L1135 WeakPolarHBondContact O-CA 3.48Å; E1131-L1135 PolarHBondContact O-N 2.83Å; L1135-K1137 PolarHBondContact O-N 3.01Å
1136	Y	89.1	Confident	91.3	Very high	24 Å²	24	52.8 Å²	52.8	9%	0.094	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	52.5	22.2	177.4	-101.6	-68.8	0	0	0	115.8	R1018 G1037 K1040 G1059 S1060 R1061 E1131 C1134 D1138	R1018-Y1136 PolarHBondContact NH2-OH 3.13Å; G1037-Y1136 PolarHBondContact O-OH 2.86Å; K1040-Y1136 HydrophobicContact CB-CD2 3.84Å; K1040-Y1136 HydrophobicContact CB-CE1 4.33Å; K1040-Y1136 HydrophobicContact CB-CE2 3.45Å; K1040-Y1136 VanDerWaalsContact CB-CE2 3.45Å; K1040-Y1136 HydrophobicContact CB-CG 4.46Å; K1040-Y1136 HydrophobicContact CD-CD2 3.73Å; K1040-Y1136 HydrophobicContact CD-CE2 4.26Å; K1040-Y1136 HydrophobicContact CD-CG 4.04Å; K1040-Y1136 HydrophobicContact CG-CD2 3.54Å; K1040-Y1136 HydrophobicContact CG-CE2 3.6Å; K1040-Y1136 HydrophobicContact CG-CG 4.27Å; G1059-Y1136 WeakPolarHBondContact O-CD2 3.43Å; S1060-Y1136 WeakPolarHBondContact O-CE2 3.4Å; R1061-Y1136 HydrophobicContact CB-CE1 4.49Å; R1061-Y1136 HydrophobicContact CG-CD1 3.61Å; R1061-Y1136 HydrophobicContact CG-CE1 3.32Å; R1061-Y1136 HydrophobicContact CG-CG 4.33Å; R1061-Y1136 PolarHBondContact NH1-O 3.18Å; R1061-Y1136 PolarHBondContact NH2-O 3.48Å; E1131-Y1136 WeakPolarHBondContact OE2-CA 3.48Å; E1131-Y1136 PolarHBondContact OE2-N 2.89Å; C1134-Y1136 PolarHBondContact O-N 2.96Å; Y1136-D1138 PolarHBondContact O-N 3.3Å
1137	K	89.5	Confident	91.2	Very high	105 Å²	105	53.3 Å²	53.3	46%	0.457	28%	0.283	S	S	.	.			trans	-41.6	125.8	-179.4	-179.2	175.7	-177.2	173.5	0	113.3	R1061 C1134 L1135 Y1139	R1061-K1137 PolarHBondContact NH1-O 2.66Å; R1061-K1137 PolarHBondContact NH2-O 3.18Å; R1061-K1137 VanDerWaalsContact NH2-O 3.08Å; C1134-K1137 HydrophobicContact CB-CB 4.15Å; C1134-K1137 HydrophobicContact CB-CD 4.06Å; C1134-K1137 WeakPolarHBondContact O-CB 3.26Å; C1134-K1137 PolarHBondContact O-N 3.33Å; L1135-K1137 PolarHBondContact O-N 3.01Å; K1137-Y1139 HydrophobicContact CD-CE1 4.21Å; K1137-Y1139 VanDerWaalsContact O-CD2 3.26Å; K1137-Y1139 WeakPolarHBondContact O-CD2 3.47Å; K1137-Y1139 WeakPolarHBondContact O-CE2 3.46Å; K1137-Y1139 PolarHBondContact O-N 3.05Å
1138	D	89.1	Confident	91.2	Very high	45 Å²	45	53.1 Å²	53.1	24%	0.241	29%	0.289	C	S	.	.			trans	-70.4	121.5	175.2	-166.4	-13	0	0	0	110.4	Y1136 R1140	Y1136-D1138 PolarHBondContact O-N 3.3Å; D1138-R1140 WeakPolarHBondContact OD1-CB 3.44Å; D1138-R1140 VanDerWaalsContact OD1-CG 3.3Å; D1138-R1140 WeakPolarHBondContact OD1-CG 3.48Å; D1138-R1140 PolarHBondContact OD1-N 3.14Å; D1138-R1140 IonicContact OD1-NE 3.4Å; D1138-R1140 PolarHBondContact OD1-NE 3.45Å; D1138-R1140 VanDerWaalsContact OD1-NE 3.08Å; D1138-R1140 IonicContact OD2-CZ 2.76Å; D1138-R1140 VanDerWaalsContact OD2-CZ 3.29Å; D1138-R1140 IonicContact OD2-NE 3.16Å; D1138-R1140 PolarHBondContact OD2-NE 3.02Å; D1138-R1140 IonicContact OD2-NH2 2.69Å; D1138-R1140 PolarHBondContact OD2-NH2 3.33Å
1139	Y	89.7	Confident	91	Very high	102 Å²	102	57.8 Å²	57.8	40%	0.4	31%	0.31	S	S	.	.			trans	-92.2	-6.4	-179.9	-68.1	-72.2	0	0	0	113.4	K1137	K1137-Y1139 HydrophobicContact CD-CE1 4.21Å; K1137-Y1139 VanDerWaalsContact O-CD2 3.26Å; K1137-Y1139 WeakPolarHBondContact O-CD2 3.47Å; K1137-Y1139 WeakPolarHBondContact O-CE2 3.46Å; K1137-Y1139 PolarHBondContact O-N 3.05Å
1140	R	94.2	Very high	90.9	Very high	13 Å²	13	60.9 Å²	60.9	5%	0.049	33%	0.327	C	S	.	.	S	Bend	trans	-60.4	159.4	178.4	-70.9	-179.8	-66.5	179.7	-6.7	112.6	L759 K760 A762 D926 V973 D1138 P1142	L759-R1140 WeakPolarHBondContact O-CD 3.29Å; K760-R1140 WeakPolarHBondContact O-CB 3.14Å; A762-R1140 HydrophobicContact CB-CB 3.76Å; D926-R1140 VanDerWaalsContact CG-NH1 3.32Å; D926-R1140 IonicContact OD1-CZ 2.73Å; D926-R1140 IonicContact OD1-NH1 3.45Å; D926-R1140 PolarHBondContact OD1-NH1 2.97Å; D926-R1140 IonicContact OD1-NH2 2.8Å; D926-R1140 IonicContact OD2-CZ 2.62Å; D926-R1140 IonicContact OD2-NH1 3.43Å; D926-R1140 PolarHBondContact OD2-NH1 3.18Å; D926-R1140 VanDerWaalsContact OD2-NH1 3.11Å; D926-R1140 IonicContact OD2-NH2 3.19Å; D926-R1140 PolarHBondContact OD2-NH2 3.42Å; V973-R1140 HydrophobicContact CG2-CG 4.23Å; D1138-R1140 WeakPolarHBondContact OD1-CB 3.44Å; D1138-R1140 VanDerWaalsContact OD1-CG 3.3Å; D1138-R1140 WeakPolarHBondContact OD1-CG 3.48Å; D1138-R1140 PolarHBondContact OD1-N 3.14Å; D1138-R1140 IonicContact OD1-NE 3.4Å; D1138-R1140 PolarHBondContact OD1-NE 3.45Å; D1138-R1140 VanDerWaalsContact OD1-NE 3.08Å; D1138-R1140 IonicContact OD2-CZ 2.76Å; D1138-R1140 VanDerWaalsContact OD2-CZ 3.29Å; D1138-R1140 IonicContact OD2-NE 3.16Å; D1138-R1140 PolarHBondContact OD2-NE 3.02Å; D1138-R1140 IonicContact OD2-NH2 2.69Å; D1138-R1140 PolarHBondContact OD2-NH2 3.33Å; R1140-P1142 WeakPolarHBondContact O-CD 3.4Å
1141	T	94.5	Very high	90.9	Very high	61 Å²	61	59.8 Å²	59.8	37%	0.374	32%	0.321	S	S	.	.	B	Isolated β-bridge	trans	-71.8	124.4	-179.4	-51.5	0	0	0	0	109.5	K760 V761 A762	K760-T1141 WeakPolarHBondContact O-CB 3.27Å; K760-T1141 PolarHBondContact O-N 2.92Å; V761-T1141 WeakPolarHBondContact CA-O 3.43Å; A762-T1141 PolarHBondContact N-O 3.46Å
1142	P	93.9	Very high	90.9	Very high	84 Å²	84	59.8 Å²	59.8	55%	0.545	32%	0.32	S	S	.	.	P	Polyproline II helix	trans	-56.2	141.3	173.6	-25.1	34.9	0	0	0	111.7	R1140 T1144	R1140-P1142 WeakPolarHBondContact O-CD 3.4Å; P1142-T1144 PolarHBondContact O-N 2.95Å
1143	Y	93.4	Very high	90.8	Very high	51 Å²	51	62 Å²	62	20%	0.2	33%	0.332	C	S	.	.	P	Polyproline II helix	trans	-53.8	135.9	178.4	174.2	-95.8	0	0	0	112.6	V761 Y764 E887 M924	V761-Y1143 HydrophobicContact CG1-CD2 4.29Å; Y764-Y1143 AromaticContact CD2-CD1 3.78Å; Y764-Y1143 HydrophobicContact CD2-CD1 3.78Å; Y764-Y1143 HydrophobicContact CD2-CG 4.33Å; Y764-Y1143 HydrophobicContact CE2-CD1 4.15Å; E887-Y1143 HydrophobicContact CG-CE1 4.33Å; M924-Y1143 HydrophobicContact CE-CD1 4.31Å; M924-Y1143 HydrophobicContact CE-CD2 3.54Å; M924-Y1143 HydrophobicContact CE-CE2 3.8Å; M924-Y1143 HydrophobicContact CE-CG 3.8Å; M924-Y1143 HydrophobicContact SD-CE2 4.44Å
1144	T	91.8	Very high	90.9	Very high	108 Å²	108	61.1 Å²	61.1	66%	0.663	32%	0.323	S	S	*	.			trans	-119	137.4	174.3	51.8	0	0	0	0	109.9	P1142	P1142-T1144 PolarHBondContact O-N 2.95Å
1145	K	90.8	Very high	91.1	Very high	97 Å²	97	58.7 Å²	58.7	42%	0.422	31%	0.306	S	S	.	.	P	Polyproline II helix	trans	-60.3	145.4	174.8	-52.5	-169.2	-178	-146	0	110.8	E885 E887	E885-K1145 IonicContact OE1-NZ 3.26Å; E885-K1145 PolarHBondContact OE1-NZ 3.27Å; E885-K1145 IonicContact OE2-NZ 2.73Å; E885-K1145 PolarHBondContact OE2-NZ 3.32Å; E887-K1145 VanDerWaalsContact OE1-CD 3.29Å; E887-K1145 WeakPolarHBondContact OE1-CD 3.44Å; E887-K1145 WeakPolarHBondContact OE1-CE 3.46Å; E887-K1145 IonicContact OE1-NZ 3.1Å; E887-K1145 PolarHBondContact OE1-NZ 3.24Å
1146	P	90.8	Very high	91.2	Very high	38 Å²	38	56.6 Å²	56.6	25%	0.247	30%	0.295	C	S	.	.	P	Polyproline II helix	trans	-58	142.3	176.2	-22.4	32.4	0	0	0	112.4	E1150 M1154	P1146-E1150 HydrophobicContact CB-CB 4.23Å; P1146-M1154 HydrophobicContact CB-CE 3.7Å; P1146-M1154 HydrophobicContact CG-CE 3.68Å
1147	S	92.2	Very high	91.2	Very high	44 Å²	44	60.3 Å²	60.3	31%	0.308	31%	0.312	S	S	.	.	P	Polyproline II helix	trans	-67.1	166.3	167.1	64	0	0	0	0	111.8	E1149 E1150 L1151	S1147-E1149 PolarHBondContact O-N 3.18Å; S1147-E1150 VanDerWaalsContact CB-OE2 3.24Å; S1147-E1150 WeakPolarHBondContact CB-OE2 3.45Å; S1147-E1150 PolarHBondContact N-OE2 3.15Å; S1147-E1150 PolarHBondContact O-N 2.93Å; S1147-E1150 WeakPolarHBondContact OG-CG 3.45Å; S1147-E1150 PolarHBondContact OG-N 3.05Å; S1147-E1150 PolarHBondContact OG-OE2 3.44Å; S1147-L1151 VanDerWaalsContact O-CB 3.22Å; S1147-L1151 WeakPolarHBondContact O-CB 3.44Å; S1147-L1151 PolarHBondContact O-N 3.02Å
1148	A	91.1	Very high	91	Very high	46 Å²	46	57.1 Å²	57.1	38%	0.38	30%	0.299	S	S	.	.	H	α-helix	trans	-61.7	-28.7	175	0	0	0	0	0	112.7	F1152 I1276	A1148-F1152 WeakPolarHBondContact O-CB 3.17Å; A1148-F1152 PolarHBondContact O-N 3.39Å; A1148-I1276 HydrophobicContact CB-CG2 4.44Å; A1148-I1276 VanDerWaalsContact O-CG2 3.29Å; A1148-I1276 WeakPolarHBondContact O-CG2 3.35Å
1149	E	89.6	Confident	90.7	Very high	103 Å²	103	58.3 Å²	58.3	48%	0.481	31%	0.308	S	S	.	.	H	α-helix	trans	-73.5	-51.7	177.3	-56.3	-177.9	147	0	0	110.3	S1147 L1151 F1152 D1153 I1276	S1147-E1149 PolarHBondContact O-N 3.18Å; E1149-L1151 VanDerWaalsContact C-N 3.29Å; E1149-L1151 PolarHBondContact O-N 2.92Å; E1149-F1152 WeakPolarHBondContact O-CA 3.39Å; E1149-F1152 WeakPolarHBondContact O-CB 3.31Å; E1149-F1152 PolarHBondContact O-N 2.86Å; E1149-D1153 PolarHBondContact O-N 3.04Å; E1149-I1276 HydrophobicContact CG-CD1 4.08Å
1150	E	90.1	Very high	90.3	Very high	108 Å²	108	56.4 Å²	56.4	51%	0.505	31%	0.308	S	S	.	.	H	α-helix	trans	-61.2	-37.4	175.4	-68.1	159.9	128.9	0	0	112.1	P1146 S1147 F1152 M1154	P1146-E1150 HydrophobicContact CB-CB 4.23Å; S1147-E1150 VanDerWaalsContact CB-OE2 3.24Å; S1147-E1150 WeakPolarHBondContact CB-OE2 3.45Å; S1147-E1150 PolarHBondContact N-OE2 3.15Å; S1147-E1150 PolarHBondContact O-N 2.93Å; S1147-E1150 WeakPolarHBondContact OG-CG 3.45Å; S1147-E1150 PolarHBondContact OG-N 3.05Å; S1147-E1150 PolarHBondContact OG-OE2 3.44Å; E1150-F1152 VanDerWaalsContact C-N 3.3Å; E1150-F1152 PolarHBondContact O-N 2.7Å; E1150-M1154 VanDerWaalsContact O-CB 3.3Å; E1150-M1154 WeakPolarHBondContact O-CB 3.16Å; E1150-M1154 VanDerWaalsContact O-CG 3.23Å; E1150-M1154 WeakPolarHBondContact O-CG 3.3Å; E1150-M1154 PolarHBondContact O-N 3.42Å
1151	L	91.8	Very high	89.3	Confident	38 Å²	38	60.9 Å²	60.9	20%	0.199	33%	0.333	C	S	.	.	H	α-helix	trans	-69.1	-27.5	174.8	-172	64.2	0	0	0	112.4	I888 S1147 E1149 M1154 L1155	I888-L1151 HydrophobicContact CB-CD1 3.98Å; I888-L1151 HydrophobicContact CD1-CD1 4.24Å; I888-L1151 HydrophobicContact CG2-CD1 3.73Å; S1147-L1151 VanDerWaalsContact O-CB 3.22Å; S1147-L1151 WeakPolarHBondContact O-CB 3.44Å; S1147-L1151 PolarHBondContact O-N 3.02Å; E1149-L1151 VanDerWaalsContact C-N 3.29Å; E1149-L1151 PolarHBondContact O-N 2.92Å; L1151-M1154 HydrophobicContact CD1-CE 4.28Å; L1151-L1155 HydrophobicContact CD1-CD1 3.65Å; L1151-L1155 HydrophobicContact CD1-CG 4.04Å; L1151-L1155 HydrophobicContact CG-CD1 3.86Å; L1151-L1155 HydrophobicContact CG-CG 4.48Å; L1151-L1155 VanDerWaalsContact O-CB 3.31Å; L1151-L1155 WeakPolarHBondContact O-CB 3.23Å; L1151-L1155 WeakPolarHBondContact O-CD1 3.36Å; L1151-L1155 WeakPolarHBondContact O-CG 3.47Å; L1151-L1155 PolarHBondContact O-N 3.4Å
1152	F	91.5	Very high	88.7	Confident	7 Å²	7	59.5 Å²	59.5	3%	0.031	33%	0.326	C	S	.	.	H	α-helix	trans	-71.4	-53.3	172.8	-179.5	-85.1	0	0	0	110.7	A1148 E1149 E1150 M1154 L1155 T1156 F1163 L1240 I1274 I1276 F1279	A1148-F1152 WeakPolarHBondContact O-CB 3.17Å; A1148-F1152 PolarHBondContact O-N 3.39Å; E1149-F1152 WeakPolarHBondContact O-CA 3.39Å; E1149-F1152 WeakPolarHBondContact O-CB 3.31Å; E1149-F1152 PolarHBondContact O-N 2.86Å; E1150-F1152 VanDerWaalsContact C-N 3.3Å; E1150-F1152 PolarHBondContact O-N 2.7Å; F1152-M1154 PolarHBondContact O-N 2.91Å; F1152-L1155 PolarHBondContact O-N 2.99Å; F1152-T1156 HydrophobicContact CD1-CG2 4.39Å; F1152-T1156 HydrophobicContact CD2-CG2 4.39Å; F1152-T1156 HydrophobicContact CE1-CG2 4.21Å; F1152-T1156 HydrophobicContact CE2-CG2 4.22Å; F1152-T1156 HydrophobicContact CG-CG2 4.47Å; F1152-T1156 HydrophobicContact CZ-CG2 4.13Å; F1152-T1156 WeakPolarHBondContact O-CB 3.44Å; F1152-T1156 WeakPolarHBondContact O-CG2 3.43Å; F1152-T1156 PolarHBondContact O-N 3.09Å; F1152-T1156 PolarHBondContact O-OG1 3.08Å; F1152-F1163 HydrophobicContact CE1-CD1 4.13Å; F1152-F1163 HydrophobicContact CZ-CD1 4.18Å; F1152-F1163 HydrophobicContact CZ-CE1 4.13Å; F1152-L1240 HydrophobicContact CE2-CD1 4.22Å; F1152-L1240 HydrophobicContact CE2-CD2 4.3Å; F1152-L1240 HydrophobicContact CZ-CD1 3.73Å; F1152-I1274 HydrophobicContact CE2-CG2 4.16Å; F1152-I1274 HydrophobicContact CZ-CG2 3.86Å; F1152-I1276 HydrophobicContact CB-CG2 3.67Å; F1152-I1276 HydrophobicContact CD2-CG2 4.06Å; F1152-I1276 HydrophobicContact CG-CG2 4.02Å; F1152-F1279 HydrophobicContact CB-CE1 4.19Å; F1152-F1279 HydrophobicContact CB-CZ 4.09Å; F1152-F1279 AromaticContact CD2-CD1 3.74Å; F1152-F1279 HydrophobicContact CD2-CD1 3.74Å; F1152-F1279 HydrophobicContact CD2-CD2 4.45Å; F1152-F1279 AromaticContact CD2-CE1 3.83Å; F1152-F1279 HydrophobicContact CD2-CE1 3.83Å; F1152-F1279 HydrophobicContact CD2-CE2 4.5Å; F1152-F1279 HydrophobicContact CD2-CG 4.06Å; F1152-F1279 HydrophobicContact CD2-CZ 4.21Å; F1152-F1279 HydrophobicContact CE2-CD1 4.18Å; F1152-F1279 HydrophobicContact CE2-CG 4.44Å; F1152-F1279 HydrophobicContact CG-CE1 4.26Å
1153	D	89.8	Confident	88.3	Confident	49 Å²	49	56.1 Å²	56.1	26%	0.262	30%	0.302	S	S	.	.	H	α-helix	trans	-56.5	-49.5	178.7	-69	-0.4	0	0	0	111	E1149 L1155 T1156 K1157 E1158	E1149-D1153 PolarHBondContact O-N 3.04Å; D1153-L1155 VanDerWaalsContact C-N 3.32Å; D1153-L1155 PolarHBondContact O-N 3.32Å; D1153-T1156 PolarHBondContact O-N 3.28Å; D1153-K1157 WeakPolarHBondContact O-CA 3.32Å; D1153-K1157 PolarHBondContact O-N 3.18Å; D1153-E1158 WeakPolarHBondContact CA-O 3.37Å; D1153-E1158 WeakPolarHBondContact CB-O 3.42Å
1154	M	90.5	Very high	88	Confident	36 Å²	36	56.7 Å²	56.7	18%	0.177	31%	0.305	C	S	.	.	H	α-helix	trans	-61.4	-32.9	179.9	-75.6	-170.4	-60.2	0	0	114.5	A856 D890 P1146 E1150 L1151 F1152 K1157	A856-M1154 HydrophobicContact CB-CB 3.96Å; A856-M1154 HydrophobicContact CB-SD 4.47Å; A856-M1154 VanDerWaalsContact O-O 3.08Å; D890-M1154 HydrophobicContact CB-SD 3.82Å; D890-M1154 PolarHBondContact N-SD 2.98Å; D890-M1154 VanDerWaalsContact N-SD 3.44Å; P1146-M1154 HydrophobicContact CB-CE 3.7Å; P1146-M1154 HydrophobicContact CG-CE 3.68Å; E1150-M1154 VanDerWaalsContact O-CB 3.3Å; E1150-M1154 WeakPolarHBondContact O-CB 3.16Å; E1150-M1154 VanDerWaalsContact O-CG 3.23Å; E1150-M1154 WeakPolarHBondContact O-CG 3.3Å; E1150-M1154 PolarHBondContact O-N 3.42Å; L1151-M1154 HydrophobicContact CD1-CE 4.28Å; F1152-M1154 PolarHBondContact O-N 2.91Å; M1154-K1157 WeakPolarHBondContact O-CD 3.25Å; M1154-K1157 WeakPolarHBondContact O-CE 3.41Å; M1154-K1157 PolarHBondContact O-NZ 3.47Å; M1154-K1157 VanDerWaalsContact O-NZ 3.13Å
1155	L	91.9	Very high	87.9	Confident	8 Å²	8	55.1 Å²	55.1	4%	0.042	30%	0.295	C	S	.	.	H	α-helix	trans	-98.7	-13.1	-175	-63.3	-179.3	0	0	0	114.4	A856 S858 A861 Q862 I888 L1151 F1152 D1153 F1279	A856-L1155 HydrophobicContact CB-CD2 3.68Å; S858-L1155 WeakPolarHBondContact O-CD2 3.5Å; A861-L1155 HydrophobicContact CB-CD2 3.83Å; Q862-L1155 HydrophobicContact CG-CD1 3.85Å; I888-L1155 HydrophobicContact CG2-CD2 3.98Å; L1151-L1155 HydrophobicContact CD1-CD1 3.65Å; L1151-L1155 HydrophobicContact CD1-CG 4.04Å; L1151-L1155 HydrophobicContact CG-CD1 3.86Å; L1151-L1155 HydrophobicContact CG-CG 4.48Å; L1151-L1155 VanDerWaalsContact O-CB 3.31Å; L1151-L1155 WeakPolarHBondContact O-CB 3.23Å; L1151-L1155 WeakPolarHBondContact O-CD1 3.36Å; L1151-L1155 WeakPolarHBondContact O-CG 3.47Å; L1151-L1155 PolarHBondContact O-N 3.4Å; F1152-L1155 PolarHBondContact O-N 2.99Å; D1153-L1155 VanDerWaalsContact C-N 3.32Å; D1153-L1155 PolarHBondContact O-N 3.32Å; L1155-F1279 HydrophobicContact CB-CE1 4Å; L1155-F1279 HydrophobicContact CD1-CE1 4.33Å; L1155-F1279 HydrophobicContact CD1-CZ 4.14Å
1156	T	90.6	Very high	87.7	Confident	21 Å²	21	50.6 Å²	50.6	13%	0.129	28%	0.275	C	S	.	.	H	α-helix	trans	-100.3	-16.3	170.6	57.4	0	0	0	0	112.5	F1152 D1153 E1158 L1240 F1279	F1152-T1156 HydrophobicContact CD1-CG2 4.39Å; F1152-T1156 HydrophobicContact CD2-CG2 4.39Å; F1152-T1156 HydrophobicContact CE1-CG2 4.21Å; F1152-T1156 HydrophobicContact CE2-CG2 4.22Å; F1152-T1156 HydrophobicContact CG-CG2 4.47Å; F1152-T1156 HydrophobicContact CZ-CG2 4.13Å; F1152-T1156 WeakPolarHBondContact O-CB 3.44Å; F1152-T1156 WeakPolarHBondContact O-CG2 3.43Å; F1152-T1156 PolarHBondContact O-N 3.09Å; F1152-T1156 PolarHBondContact O-OG1 3.08Å; D1153-T1156 PolarHBondContact O-N 3.28Å; T1156-E1158 PolarHBondContact O-N 3.36Å; T1156-E1158 PolarHBondContact OG1-N 3.37Å; T1156-L1240 HydrophobicContact CG2-CD1 4.18Å; T1156-L1240 HydrophobicContact CG2-CD2 3.94Å; T1156-L1240 HydrophobicContact CG2-CG 4.26Å; T1156-F1279 HydrophobicContact CG2-CD1 4.1Å; T1156-F1279 HydrophobicContact CG2-CE1 4.26Å
1157	K	88.7	Confident	87.5	Confident	102 Å²	102	51 Å²	51	44%	0.443	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.6	29.9	-170.2	-54.3	-58.9	-173.8	-169.9	0	112.6	A856 N891 D1153 M1154	A856-K1157 VanDerWaalsContact O-CE 3.3Å; A856-K1157 WeakPolarHBondContact O-CE 3.29Å; A856-K1157 PolarHBondContact O-NZ 2.78Å; N891-K1157 PolarHBondContact OD1-NZ 2.85Å; D1153-K1157 WeakPolarHBondContact O-CA 3.32Å; D1153-K1157 PolarHBondContact O-N 3.18Å; M1154-K1157 WeakPolarHBondContact O-CD 3.25Å; M1154-K1157 WeakPolarHBondContact O-CE 3.41Å; M1154-K1157 PolarHBondContact O-NZ 3.47Å; M1154-K1157 VanDerWaalsContact O-NZ 3.13Å
1158	E	86.1	Confident	87.3	Confident	39 Å²	39	50.1 Å²	50.1	18%	0.182	27%	0.267	C	S	.	.			trans	-103.7	166.3	173.4	-66.2	-84.2	-156	0	0	110.2	D1153 T1156 S1162 F1163 N1238	D1153-E1158 WeakPolarHBondContact CA-O 3.37Å; D1153-E1158 WeakPolarHBondContact CB-O 3.42Å; T1156-E1158 PolarHBondContact O-N 3.36Å; T1156-E1158 PolarHBondContact OG1-N 3.37Å; E1158-S1162 VanDerWaalsContact OE2-CB 3.28Å; E1158-S1162 WeakPolarHBondContact OE2-CB 3.5Å; E1158-S1162 PolarHBondContact OE2-OG 3.09Å; E1158-F1163 HydrophobicContact CB-CB 3.77Å; E1158-F1163 HydrophobicContact CB-CG 4.44Å; E1158-F1163 HydrophobicContact CG-CB 3.96Å; E1158-F1163 HydrophobicContact CG-CD2 4.43Å; E1158-F1163 HydrophobicContact CG-CG 4.24Å; E1158-F1163 WeakPolarHBondContact OE1-CD2 3.33Å; E1158-N1238 HydrophobicContact CG-CB 4.42Å; E1158-N1238 PolarHBondContact OE1-ND2 2.85Å
1159	T	82.5	Confident	87.2	Confident	70 Å²	70	49.1 Å²	49.1	43%	0.429	26%	0.256	S	S	.	.			trans	-128.6	163.9	173.7	61.5	0	0	0	0	109.8	D1161 S1162 F1163	T1159-D1161 PolarHBondContact O-N 3.26Å; T1159-D1161 VanDerWaalsContact O-N 3.13Å; T1159-S1162 PolarHBondContact N-OG 2.82Å; T1159-S1162 PolarHBondContact O-N 3.46Å; T1159-S1162 PolarHBondContact O-OG 3.48Å; T1159-S1162 PolarHBondContact OG1-N 2.77Å; T1159-S1162 PolarHBondContact OG1-OG 3.47Å; T1159-F1163 PolarHBondContact O-N 2.81Å
1160	P	79.7	Confident	87.3	Confident	61 Å²	61	46.2 Å²	46.2	40%	0.396	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.8	-28.5	174.3	-28.7	37.2	0	0	0	114.2
1161	D	74.8	Confident	87.5	Confident	107 Å²	107	41 Å²	41	57%	0.572	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.3	-34.3	175.8	-64	-47.5	0	0	0	112.6	T1159 Y1164	T1159-D1161 PolarHBondContact O-N 3.26Å; T1159-D1161 VanDerWaalsContact O-N 3.13Å; D1161-Y1164 WeakPolarHBondContact O-CD1 3.33Å; D1161-Y1164 WeakPolarHBondContact O-CE1 3.48Å
1162	S	80.3	Confident	87.7	Confident	33 Å²	33	42.3 Å²	42.3	23%	0.231	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83	-26	178	70.1	0	0	0	0	113.4	E1158 T1159 K1167	E1158-S1162 VanDerWaalsContact OE2-CB 3.28Å; E1158-S1162 WeakPolarHBondContact OE2-CB 3.5Å; E1158-S1162 PolarHBondContact OE2-OG 3.09Å; T1159-S1162 PolarHBondContact N-OG 2.82Å; T1159-S1162 PolarHBondContact O-N 3.46Å; T1159-S1162 PolarHBondContact O-OG 3.48Å; T1159-S1162 PolarHBondContact OG1-N 2.77Å; T1159-S1162 PolarHBondContact OG1-OG 3.47Å; S1162-K1167 WeakPolarHBondContact O-CD 3.37Å; S1162-K1167 WeakPolarHBondContact O-CE 3.44Å; S1162-K1167 PolarHBondContact O-NZ 3.4Å
1163	F	86.3	Confident	87.8	Confident	12 Å²	12	42 Å²	42	5%	0.053	23%	0.225	C	C	.	.	S	Bend	trans	-139.6	77.4	-173	-160.1	-98.2	0	0	0	114.1	F1152 E1158 T1159 L1236 N1238 L1240 I1271 I1274 V1281	F1152-F1163 HydrophobicContact CE1-CD1 4.13Å; F1152-F1163 HydrophobicContact CZ-CD1 4.18Å; F1152-F1163 HydrophobicContact CZ-CE1 4.13Å; E1158-F1163 HydrophobicContact CB-CB 3.77Å; E1158-F1163 HydrophobicContact CB-CG 4.44Å; E1158-F1163 HydrophobicContact CG-CB 3.96Å; E1158-F1163 HydrophobicContact CG-CD2 4.43Å; E1158-F1163 HydrophobicContact CG-CG 4.24Å; E1158-F1163 WeakPolarHBondContact OE1-CD2 3.33Å; T1159-F1163 PolarHBondContact O-N 2.81Å; F1163-L1236 HydrophobicContact CE2-CD1 4.4Å; F1163-L1236 HydrophobicContact CZ-CD1 4.02Å; F1163-N1238 WeakPolarHBondContact CD2-ND2 3.47Å; F1163-N1238 WeakPolarHBondContact CE2-ND2 3.43Å; F1163-L1240 HydrophobicContact CE1-CD1 3.82Å; F1163-L1240 HydrophobicContact CE2-CD1 4.48Å; F1163-L1240 HydrophobicContact CZ-CD1 3.79Å; F1163-I1271 HydrophobicContact CD2-CD1 4.17Å; F1163-I1271 HydrophobicContact CE1-CD1 4.13Å; F1163-I1271 HydrophobicContact CE2-CD1 3.55Å; F1163-I1271 HydrophobicContact CZ-CD1 3.51Å; F1163-I1274 HydrophobicContact CD1-CD1 3.65Å; F1163-I1274 HydrophobicContact CD1-CG1 4.39Å; F1163-I1274 HydrophobicContact CE1-CD1 3.69Å; F1163-I1274 HydrophobicContact CE1-CG1 3.92Å; F1163-I1274 HydrophobicContact CE1-CG2 4.43Å; F1163-I1274 WeakPolarHBondContact O-CD1 3.44Å; F1163-V1281 HydrophobicContact CE1-CG2 4.21Å; F1163-V1281 HydrophobicContact CZ-CG2 3.99Å
1164	Y	87.1	Confident	88	Confident	64 Å²	64	42.4 Å²	42.4	25%	0.251	23%	0.23	S	C	.	.			trans	-110.6	158.6	-178.8	56.8	-91	0	0	0	114.7	D1161 G1166 K1167	D1161-Y1164 WeakPolarHBondContact O-CD1 3.33Å; D1161-Y1164 WeakPolarHBondContact O-CE1 3.48Å; Y1164-G1166 PolarHBondContact O-N 2.82Å; Y1164-K1167 HydrophobicContact CD1-CB 4.35Å; Y1164-K1167 HydrophobicContact CD1-CD 4.46Å; Y1164-K1167 HydrophobicContact CD2-CB 4.03Å; Y1164-K1167 HydrophobicContact CE1-CB 4.1Å; Y1164-K1167 HydrophobicContact CE1-CD 4.02Å; Y1164-K1167 HydrophobicContact CE1-CG 4.21Å; Y1164-K1167 HydrophobicContact CE2-CB 3.76Å; Y1164-K1167 HydrophobicContact CE2-CG 4.48Å; Y1164-K1167 HydrophobicContact CG-CB 4.31Å; Y1164-K1167 WeakPolarHBondContact O-CB 3.38Å; Y1164-K1167 PolarHBondContact O-N 2.93Å; Y1164-K1167 VanDerWaalsContact O-N 3.13Å
1165	V	89.9	Confident	88	Confident	75 Å²	75	41 Å²	41	46%	0.455	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.5	118	169.6	170.9	0	0	0	0	109.8	I1271 I1272 I1274	V1165-I1271 HydrophobicContact CG2-CG2 4.48Å; V1165-I1272 WeakPolarHBondContact CG1-O 3.42Å; V1165-I1274 HydrophobicContact CG2-CB 4.44Å; V1165-I1274 HydrophobicContact CG2-CD1 4.09Å; V1165-I1274 HydrophobicContact CG2-CG1 3.96Å
1166	G	86.6	Confident	88	Confident	1 Å²	1	42 Å²	42	1%	0.01	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	109.8	-13.2	-175.9	0	0	0	0	0	114.7	Y1164 R1270 I1271	Y1164-G1166 PolarHBondContact O-N 2.82Å; G1166-R1270 VanDerWaalsContact O-CD 3.3Å; G1166-R1270 WeakPolarHBondContact O-CD 3.38Å; G1166-R1270 WeakPolarHBondContact O-CG 3.49Å; G1166-R1270 PolarHBondContact O-NH1 2.83Å; G1166-I1271 VanDerWaalsContact CA-O 3.31Å; G1166-I1271 WeakPolarHBondContact CA-O 3.43Å; G1166-I1271 PolarHBondContact N-O 3.16Å
1167	K	86.5	Confident	87.9	Confident	46 Å²	46	42.6 Å²	42.6	20%	0.2	23%	0.233	C	C	.	.			trans	-63.4	140	176.2	-167.8	171.9	174.2	170.8	0	111.2	N636 S1162 Y1164 V1169 R1270 I1271	N636-K1167 WeakPolarHBondContact OD1-CE 3.37Å; S1162-K1167 WeakPolarHBondContact O-CD 3.37Å; S1162-K1167 WeakPolarHBondContact O-CE 3.44Å; S1162-K1167 PolarHBondContact O-NZ 3.4Å; Y1164-K1167 HydrophobicContact CD1-CB 4.35Å; Y1164-K1167 HydrophobicContact CD1-CD 4.46Å; Y1164-K1167 HydrophobicContact CD2-CB 4.03Å; Y1164-K1167 HydrophobicContact CE1-CB 4.1Å; Y1164-K1167 HydrophobicContact CE1-CD 4.02Å; Y1164-K1167 HydrophobicContact CE1-CG 4.21Å; Y1164-K1167 HydrophobicContact CE2-CB 3.76Å; Y1164-K1167 HydrophobicContact CE2-CG 4.48Å; Y1164-K1167 HydrophobicContact CG-CB 4.31Å; Y1164-K1167 WeakPolarHBondContact O-CB 3.38Å; Y1164-K1167 PolarHBondContact O-N 2.93Å; Y1164-K1167 VanDerWaalsContact O-N 3.13Å; K1167-V1169 HydrophobicContact CB-CG1 4.47Å; K1167-V1169 HydrophobicContact CD-CG1 4.11Å; K1167-V1169 HydrophobicContact CG-CG1 3.96Å; K1167-R1270 WeakPolarHBondContact O-CA 3.43Å; K1167-I1271 HydrophobicContact CB-CD1 4.46Å; K1167-I1271 PolarHBondContact O-N 2.94Å
1168	C	88	Confident	87.7	Confident	27 Å²	27	41.6 Å²	41.6	18%	0.182	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	125.7	169.9	-171.8	0	0	0	0	109.2
1169	V	89.1	Confident	87.4	Confident	25 Å²	25	48.4 Å²	48.4	15%	0.152	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	157.4	-172.4	-69.2	0	0	0	0	110.9	K1167 L1236 V1269 I1271	K1167-V1169 HydrophobicContact CB-CG1 4.47Å; K1167-V1169 HydrophobicContact CD-CG1 4.11Å; K1167-V1169 HydrophobicContact CG-CG1 3.96Å; V1169-L1236 HydrophobicContact CB-CD2 4.18Å; V1169-L1236 HydrophobicContact CG2-CD2 3.39Å; V1169-V1269 HydrophobicContact CG2-CG2 3.76Å; V1169-V1269 PolarHBondContact N-O 3.13Å; V1169-V1269 PolarHBondContact O-N 2.83Å; V1169-I1271 HydrophobicContact CG1-CD1 4.42Å; V1169-I1271 HydrophobicContact CG2-CD1 4.1Å; V1169-I1271 HydrophobicContact CG2-CG1 3.92Å
1170	T	92.5	Very high	87.1	Confident	41 Å²	41	53.6 Å²	53.6	25%	0.252	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	142.4	172.1	24.8	0	0	0	0	110.9	E1237 M1266	T1170-E1237 WeakPolarHBondContact CB-OE1 3.36Å; T1170-E1237 PolarHBondContact OG1-OE1 2.86Å; T1170-E1237 PolarHBondContact OG1-OE2 3.04Å; T1170-M1266 HydrophobicContact CG2-CE 4.5Å
1171	A	93.7	Very high	86.6	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	137.9	177	0	0	0	0	0	112.2	V1234 R1235 L1236 I1267 V1269	A1171-V1234 HydrophobicContact CB-CB 3.92Å; A1171-V1234 HydrophobicContact CB-CG2 3.84Å; A1171-R1235 CarbonylContact C-O 3.51Å; A1171-R1235 VanDerWaalsContact CA-O 3.29Å; A1171-R1235 WeakPolarHBondContact CA-O 3.48Å; A1171-L1236 HydrophobicContact CB-CD2 4.23Å; A1171-I1267 PolarHBondContact N-O 3.33Å; A1171-I1267 WeakPolarHBondContact O-CG1 3.46Å; A1171-I1267 PolarHBondContact O-N 3.3Å; A1171-V1269 HydrophobicContact CB-CG1 4.14Å; A1171-V1269 HydrophobicContact CB-CG2 3.88Å
1172	M	95.6	Very high	86.6	Confident	64 Å²	64	53.2 Å²	53.2	32%	0.315	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	129.6	175.2	-176.2	174.1	52	0	0	110.7	T1174 V1234 R1235 M1266	M1172-T1174 PolarHBondContact O-N 3.35Å; M1172-V1234 CarbonylContact O-C 3.46Å; M1172-V1234 WeakPolarHBondContact O-CA 3.24Å; M1172-V1234 WeakPolarHBondContact O-CB 3.45Å; M1172-R1235 PolarHBondContact N-O 2.88Å; M1172-R1235 PolarHBondContact O-N 2.96Å; M1172-M1266 HydrophobicContact CB-SD 3.62Å; M1172-M1266 HydrophobicContact CG-SD 4.28Å
1173	V	94.5	Very high	86.1	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	116.7	172.9	175.8	0	0	0	0	110.8	V1232 V1234 V1261 R1262 S1264 Q1265 I1267	V1173-V1232 HydrophobicContact CB-CG1 4.41Å; V1173-V1232 HydrophobicContact CG1-CG1 3.54Å; V1173-V1232 HydrophobicContact CG2-CG1 4.14Å; V1173-V1234 HydrophobicContact CG2-CG1 4.28Å; V1173-V1261 HydrophobicContact CG1-CG2 4.46Å; V1173-V1261 HydrophobicContact CG2-CB 4.18Å; V1173-V1261 HydrophobicContact CG2-CG2 4.13Å; V1173-R1262 VanDerWaalsContact CB-O 3.28Å; V1173-R1262 WeakPolarHBondContact CB-O 3.19Å; V1173-R1262 WeakPolarHBondContact CG1-O 3.28Å; V1173-S1264 PolarHBondContact O-N 3.43Å; V1173-Q1265 PolarHBondContact N-O 2.83Å; V1173-I1267 HydrophobicContact CG2-CD1 3.73Å; V1173-I1267 HydrophobicContact CG2-CG1 4.06Å; V1173-I1267 HydrophobicContact CG2-CG2 4.47Å
1174	T	93.2	Very high	85.5	Confident	58 Å²	58	59.3 Å²	59.3	36%	0.356	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	-17.5	-179.1	55.4	0	0	0	0	113.7	M1172 R1233 R1235	M1172-T1174 PolarHBondContact O-N 3.35Å; T1174-R1233 PolarHBondContact N-O 2.88Å; T1174-R1233 WeakPolarHBondContact OG1-CB 3.4Å; T1174-R1233 PolarHBondContact OG1-O 2.62Å; T1174-R1235 HydrophobicContact CG2-CB 3.67Å
1175	G	91.3	Very high	84.8	Confident	7 Å²	7	60.8 Å²	60.8	7%	0.072	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	151.2	166.7	169.1	0	0	0	0	0	114.8	R1233	G1175-R1233 PolarHBondContact N-O 2.93Å; G1175-R1233 WeakPolarHBondContact O-CB 3.14Å; G1175-R1233 PolarHBondContact O-N 3.31Å
1176	F	90.9	Very high	83.9	Confident	28 Å²	28	59.7 Å²	59.7	12%	0.123	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	167.7	-174.9	-52.5	-67.7	0	0	0	112.9	Y1178 V1232 R1233 P1257 E1258 V1261 V1263	F1176-Y1178 HydrophobicContact CB-CD2 4.48Å; F1176-Y1178 HydrophobicContact CB-CE2 3.71Å; F1176-V1232 HydrophobicContact CD1-CG1 4.3Å; F1176-V1232 HydrophobicContact CD1-CG2 4.09Å; F1176-V1232 HydrophobicContact CE1-CG1 4.21Å; F1176-V1232 HydrophobicContact CE1-CG2 4.2Å; F1176-R1233 PolarHBondContact O-NH2 3.27Å; F1176-R1233 VanDerWaalsContact O-NH2 3.15Å; F1176-P1257 HydrophobicContact CD1-CB 3.78Å; F1176-P1257 HydrophobicContact CD1-CG 3.61Å; F1176-P1257 HydrophobicContact CE1-CB 3.89Å; F1176-P1257 HydrophobicContact CE1-CG 4.13Å; F1176-P1257 HydrophobicContact CG-CG 4.24Å; F1176-E1258 HydrophobicContact CD2-CG 3.77Å; F1176-E1258 HydrophobicContact CE1-CG 4.26Å; F1176-E1258 HydrophobicContact CE2-CG 3.42Å; F1176-E1258 VanDerWaalsContact CE2-CG 3.42Å; F1176-E1258 HydrophobicContact CG-CG 4.35Å; F1176-E1258 HydrophobicContact CZ-CG 3.7Å; F1176-V1261 HydrophobicContact CE1-CG2 3.93Å; F1176-V1261 HydrophobicContact CZ-CG2 4.42Å; F1176-V1261 WeakPolarHBondContact CZ-O 3.44Å; F1176-V1263 HydrophobicContact CD2-CG2 4.34Å; F1176-V1263 HydrophobicContact CE2-CG2 3.68Å; F1176-V1263 HydrophobicContact CZ-CG2 4.27Å
1177	T	88.2	Confident	83.1	Confident	34 Å²	34	66.6 Å²	66.6	21%	0.209	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	136.9	173.3	60.5	0	0	0	0	110	S1230 G1231 R1233 F1243	T1177-S1230 PolarHBondContact O-N 3.04Å; T1177-G1231 PolarHBondContact N-O 3.24Å; T1177-G1231 PolarHBondContact OG1-N 3.19Å; T1177-G1231 PolarHBondContact OG1-O 3.24Å; T1177-R1233 HydrophobicContact CG2-CG 3.82Å; T1177-F1243 HydrophobicContact CG2-CE2 4.05Å; T1177-F1243 WeakPolarHBondContact OG1-CE2 3.44Å
1178	Y	85.2	Confident	82.5	Confident	82 Å²	82	69 Å²	69	32%	0.322	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	141.7	-176.6	-60.9	-93	0	0	0	110.3	F1176 P1226 P1229 E1258	F1176-Y1178 HydrophobicContact CB-CD2 4.48Å; F1176-Y1178 HydrophobicContact CB-CE2 3.71Å; Y1178-P1226 VanDerWaalsContact CB-O 3.25Å; Y1178-P1226 WeakPolarHBondContact CB-O 3.3Å; Y1178-P1226 HydrophobicContact CD1-CB 4.05Å; Y1178-P1226 HydrophobicContact CD1-CG 4.27Å; Y1178-P1226 HydrophobicContact CD2-CB 4.23Å; Y1178-P1226 HydrophobicContact CG-CB 3.87Å; Y1178-P1229 HydrophobicContact CD1-CB 3.8Å; Y1178-P1229 HydrophobicContact CE1-CB 3.75Å; Y1178-P1229 HydrophobicContact CE1-CG 4.42Å; Y1178-E1258 PolarHBondContact OH-OE1 3.08Å
1179	R	80.5	Confident	81.7	Confident	181 Å²	181	68.2 Å²	68.2	68%	0.683	35%	0.35	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.6	105	176.9	-118.1	-175.1	-171.7	-155.7	3.8	108.3	G1227 Q1228	R1179-G1227 CarbonylContact O-C 3.5Å; R1179-G1227 VanDerWaalsContact O-CA 3.27Å; R1179-G1227 WeakPolarHBondContact O-CA 3.39Å; R1179-Q1228 PolarHBondContact N-O 2.81Å; R1179-Q1228 PolarHBondContact O-N 3Å
1180	R	75.2	Confident	81.3	Confident	179 Å²	179	73.4 Å²	73.4	68%	0.675	38%	0.377	S	S	*	.	P	Polyproline II helix	trans	-58.6	139	173.8	-70.4	-176.8	175.6	-179.5	-2.6	110.4
1181	P	69	Low	80.7	Confident	24 Å²	24	72 Å²	72	16%	0.156	37%	0.368	C	S	.	.	P	Polyproline II helix	trans	-63.4	151.7	173.2	29.1	-35.7	0	0	0	110.9	Q1185 L1186 F1204	P1181-Q1185 HydrophobicContact CB-CB 4.35Å; P1181-L1186 HydrophobicContact CB-CD2 4.16Å; P1181-L1186 HydrophobicContact CB-CG 4.25Å; P1181-L1186 HydrophobicContact CG-CD2 3.68Å; P1181-L1186 HydrophobicContact CG-CG 4.16Å; P1181-F1204 HydrophobicContact CB-CD1 3.82Å; P1181-F1204 HydrophobicContact CB-CD2 4.15Å; P1181-F1204 HydrophobicContact CB-CE1 3.85Å; P1181-F1204 HydrophobicContact CB-CE2 4.19Å; P1181-F1204 HydrophobicContact CB-CG 3.98Å; P1181-F1204 HydrophobicContact CB-CZ 4.04Å; P1181-F1204 HydrophobicContact CG-CD1 4.38Å; P1181-F1204 HydrophobicContact CG-CD2 3.91Å; P1181-F1204 HydrophobicContact CG-CE2 4.21Å; P1181-F1204 HydrophobicContact CG-CG 4.01Å
1182	Q	74.5	Confident	80.1	Confident	136 Å²	136	75.9 Å²	75.9	64%	0.636	39%	0.392	S	S	*	.	P	Polyproline II helix	trans	-91	162.7	173.8	-66.1	-179.7	-22.2	0	0	110.8	D1184 Q1185 L1186	Q1182-D1184 PolarHBondContact O-N 2.88Å; Q1182-Q1185 HydrophobicContact CB-CG 4.4Å; Q1182-Q1185 WeakPolarHBondContact O-CA 3.04Å; Q1182-Q1185 VanDerWaalsContact O-CB 3.29Å; Q1182-Q1185 WeakPolarHBondContact O-CB 3.25Å; Q1182-Q1185 PolarHBondContact O-N 3.03Å; Q1182-L1186 PolarHBondContact O-N 3.26Å; Q1182-L1186 VanDerWaalsContact O-N 3.11Å
1183	G	70.1	Confident	79.4	Confident	43 Å²	43	78.5 Å²	78.5	44%	0.443	40%	0.399	S	S	.	.	H	α-helix	trans	-49.2	-54.9	-176.4	0	0	0	0	0	113.4	Q1185 L1186 D1187	G1183-Q1185 PolarHBondContact O-N 2.94Å; G1183-L1186 WeakPolarHBondContact O-CA 3.42Å; G1183-L1186 WeakPolarHBondContact O-CB 3.25Å; G1183-L1186 PolarHBondContact O-N 3.35Å; G1183-D1187 PolarHBondContact O-N 3.18Å; G1183-D1187 VanDerWaalsContact O-N 3.08Å
1184	D	74.7	Confident	78.6	Confident	131 Å²	131	80.5 Å²	80.5	70%	0.701	41%	0.409	S	S	*	.	H	α-helix	trans	-54.5	-26.5	178.2	-45.2	12.6	0	0	0	113.4	Q1182 S1188	Q1182-D1184 PolarHBondContact O-N 2.88Å; D1184-S1188 WeakPolarHBondContact O-CB 3.18Å; D1184-S1188 PolarHBondContact O-OG 3.47Å
1185	Q	71.4	Confident	77.7	Confident	94 Å²	94	85.7 Å²	85.7	44%	0.439	44%	0.435	S	S	.	.	H	α-helix	trans	-84.1	-35.2	178.2	-56.9	177.9	-26.5	0	0	111.7	P1181 Q1182 G1183 S1188 A1189 F1204	P1181-Q1185 HydrophobicContact CB-CB 4.35Å; Q1182-Q1185 HydrophobicContact CB-CG 4.4Å; Q1182-Q1185 WeakPolarHBondContact O-CA 3.04Å; Q1182-Q1185 VanDerWaalsContact O-CB 3.29Å; Q1182-Q1185 WeakPolarHBondContact O-CB 3.25Å; Q1182-Q1185 PolarHBondContact O-N 3.03Å; G1183-Q1185 PolarHBondContact O-N 2.94Å; Q1185-S1188 CarbonylContact O-C 3.59Å; Q1185-S1188 PolarHBondContact O-N 3.32Å; Q1185-A1189 PolarHBondContact O-N 2.76Å; Q1185-A1189 VanDerWaalsContact O-N 3.09Å; Q1185-F1204 HydrophobicContact CB-CE1 4.22Å; Q1185-F1204 HydrophobicContact CB-CZ 4.49Å; Q1185-F1204 WeakPolarHBondContact O-CZ 3.22Å
1186	L	70.5	Confident	76.8	Confident	53 Å²	53	90.5 Å²	90.5	28%	0.277	47%	0.467	S	S	.	.	H	α-helix	trans	-65	-44.1	174.4	-67.5	165.6	0	0	0	110.9	P1181 Q1182 G1183 S1188 A1189 F1204 F1220	P1181-L1186 HydrophobicContact CB-CD2 4.16Å; P1181-L1186 HydrophobicContact CB-CG 4.25Å; P1181-L1186 HydrophobicContact CG-CD2 3.68Å; P1181-L1186 HydrophobicContact CG-CG 4.16Å; Q1182-L1186 PolarHBondContact O-N 3.26Å; Q1182-L1186 VanDerWaalsContact O-N 3.11Å; G1183-L1186 WeakPolarHBondContact O-CA 3.42Å; G1183-L1186 WeakPolarHBondContact O-CB 3.25Å; G1183-L1186 PolarHBondContact O-N 3.35Å; L1186-S1188 PolarHBondContact O-N 2.75Å; L1186-A1189 WeakPolarHBondContact O-CB 3.48Å; L1186-A1189 PolarHBondContact O-N 3.14Å; L1186-F1204 HydrophobicContact CD2-CD2 4.48Å; L1186-F1204 HydrophobicContact CD2-CE2 3.82Å; L1186-F1204 HydrophobicContact CD2-CZ 4.36Å; L1186-F1220 HydrophobicContact CD2-CB 4.01Å; L1186-F1220 HydrophobicContact CD2-CD1 4.3Å; L1186-F1220 HydrophobicContact CD2-CG 4.08Å
1187	D	71.1	Confident	76.2	Confident	145 Å²	145	92.8 Å²	92.8	78%	0.775	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-24.8	173.3	-67.7	-22.2	0	0	0	112.6	G1183	G1183-D1187 PolarHBondContact O-N 3.18Å; G1183-D1187 VanDerWaalsContact O-N 3.08Å
1188	S	72.8	Confident	75.6	Confident	98 Å²	98	97.5 Å²	97.5	69%	0.685	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.3	5.3	177	-57.1	0	0	0	0	113.3	D1184 Q1185 L1186 N1190	D1184-S1188 WeakPolarHBondContact O-CB 3.18Å; D1184-S1188 PolarHBondContact O-OG 3.47Å; Q1185-S1188 CarbonylContact O-C 3.59Å; Q1185-S1188 PolarHBondContact O-N 3.32Å; L1186-S1188 PolarHBondContact O-N 2.75Å; S1188-N1190 PolarHBondContact O-N 2.9Å
1189	A	71.1	Confident	75.5	Confident	10 Å²	10	94.1 Å²	94.1	8%	0.083	49%	0.489	C	S	.	.			trans	-70.3	125.8	-175.4	0	0	0	0	0	111.2	Q1185 L1186 P1203 F1204 W1217 F1220	Q1185-A1189 PolarHBondContact O-N 2.76Å; Q1185-A1189 VanDerWaalsContact O-N 3.09Å; L1186-A1189 WeakPolarHBondContact O-CB 3.48Å; L1186-A1189 PolarHBondContact O-N 3.14Å; A1189-P1203 HydrophobicContact CB-CG 4.22Å; A1189-F1204 HydrophobicContact CB-CE2 3.8Å; A1189-F1204 HydrophobicContact CB-CZ 3.73Å; A1189-W1217 HydrophobicContact CB-CH2 4.17Å; A1189-W1217 HydrophobicContact CB-CZ3 4.41Å; A1189-W1217 WeakPolarHBondContact O-CH2 3.11Å; A1189-F1220 HydrophobicContact CB-CD2 4.44Å; A1189-F1220 HydrophobicContact CB-CE2 3.59Å; A1189-F1220 HydrophobicContact CB-CZ 3.74Å
1190	N	81.2	Confident	75.7	Confident	134 Å²	134	88.3 Å²	88.3	72%	0.717	47%	0.467	S	S	*	.			trans	-122.8	91.1	176.7	-136.7	-13.3	0	0	0	108.6	S1188 V1192	S1188-N1190 PolarHBondContact O-N 2.9Å; N1190-V1192 PolarHBondContact O-N 3.35Å
1191	P	80.1	Confident	76.1	Confident	11 Å²	11	81.4 Å²	81.4	7%	0.071	44%	0.442	C	S	.	.	P	Polyproline II helix	trans	-55.6	135.4	175.9	-28	37.6	0	0	0	111.7	W1200 L1213 V1216 W1217 F1220	P1191-W1200 HydrophobicContact CB-CE3 3.99Å; P1191-L1213 HydrophobicContact CB-CD1 3.64Å; P1191-L1213 HydrophobicContact CG-CD1 3.72Å; P1191-V1216 HydrophobicContact CB-CB 4.27Å; P1191-V1216 HydrophobicContact CB-CG1 3.98Å; P1191-V1216 HydrophobicContact CB-CG2 4.36Å; P1191-V1216 HydrophobicContact CG-CB 4.15Å; P1191-V1216 HydrophobicContact CG-CG1 3.78Å; P1191-W1217 HydrophobicContact CG-CZ2 4.23Å; P1191-F1220 HydrophobicContact CG-CE2 4.38Å; P1191-F1220 HydrophobicContact CG-CZ 4.29Å
1192	V	80.2	Confident	76.8	Confident	82 Å²	82	80.3 Å²	80.3	50%	0.497	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	126.9	-177.8	179.9	0	0	0	0	108.9	N1190 Q1201	N1190-V1192 PolarHBondContact O-N 3.35Å; V1192-Q1201 PolarHBondContact N-O 3.24Å; V1192-Q1201 PolarHBondContact O-N 3.21Å
1193	R	82	Confident	76.9	Confident	119 Å²	119	75.8 Å²	75.8	45%	0.449	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	137.1	171.1	-157.1	177.8	-173.1	-151	-7.3	109.8	E1198 S1199 W1200	R1193-E1198 VanDerWaalsContact CZ-O 3.23Å; R1193-E1198 IonicContact CZ-OE2 2.69Å; R1193-E1198 PolarHBondContact NE-O 2.94Å; R1193-E1198 IonicContact NH1-OE2 2.89Å; R1193-E1198 PolarHBondContact NH2-O 2.82Å; R1193-E1198 IonicContact NH2-OE2 2.58Å; R1193-E1198 PolarHBondContact NH2-OE2 2.73Å; R1193-S1199 WeakPolarHBondContact CA-O 3.38Å; R1193-S1199 VanDerWaalsContact CG-O 3.32Å; R1193-S1199 WeakPolarHBondContact CG-O 3.12Å; R1193-W1200 HydrophobicContact CB-CD2 3.99Å; R1193-W1200 HydrophobicContact CB-CE3 3.88Å; R1193-W1200 HydrophobicContact CB-CH2 4.2Å; R1193-W1200 HydrophobicContact CB-CZ2 4.27Å; R1193-W1200 HydrophobicContact CB-CZ3 4Å; R1193-W1200 HydrophobicContact CG-CD2 4.07Å; R1193-W1200 HydrophobicContact CG-CE3 4.48Å; R1193-W1200 HydrophobicContact CG-CG 4.42Å; R1193-W1200 HydrophobicContact CG-CZ2 4.3Å
1194	L	76.8	Confident	77.4	Confident	41 Å²	41	75.1 Å²	75.1	22%	0.215	40%	0.402	C	S	.	.	P	Polyproline II helix	trans	-100.3	120.8	-179	-71.6	168.1	0	0	0	110.8	S1196 N1197 E1198 S1199 Q1201 D1208	L1194-S1196 PolarHBondContact O-N 3.3Å; L1194-S1196 VanDerWaalsContact O-N 3.13Å; L1194-N1197 WeakPolarHBondContact CB-OD1 3.46Å; L1194-N1197 PolarHBondContact O-N 3.08Å; L1194-E1198 WeakPolarHBondContact O-CA 3.26Å; L1194-E1198 PolarHBondContact O-N 2.87Å; L1194-S1199 PolarHBondContact N-O 2.68Å; L1194-Q1201 HydrophobicContact CD1-CB 4Å; L1194-Q1201 HydrophobicContact CG-CB 4.29Å; L1194-D1208 HydrophobicContact CD1-CB 3.56Å
1195	D	73.7	Confident	77.5	Confident	168 Å²	168	69.9 Å²	69.9	90%	0.898	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-16.8	-178.7	-61.2	-40.4	0	0	0	113.6
1196	S	73.9	Confident	77.6	Confident	108 Å²	108	67.8 Å²	67.8	76%	0.755	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79	-26.6	-176	41.3	0	0	0	0	115.2	L1194	L1194-S1196 PolarHBondContact O-N 3.3Å; L1194-S1196 VanDerWaalsContact O-N 3.13Å
1197	N	77	Confident	77.9	Confident	76 Å²	76	69.4 Å²	69.4	41%	0.406	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-145.6	5	-167.9	49.2	-23.8	0	0	0	112.8	L1194 S1199	L1194-N1197 WeakPolarHBondContact CB-OD1 3.46Å; L1194-N1197 PolarHBondContact O-N 3.08Å; N1197-S1199 PolarHBondContact ND2-OG 3.03Å; N1197-S1199 VanDerWaalsContact ND2-OG 3.08Å; N1197-S1199 PolarHBondContact O-N 2.9Å
1198	E	76.2	Confident	78.3	Confident	133 Å²	133	66.1 Å²	66.1	62%	0.621	35%	0.353	S	S	*	.	S	Bend	trans	60	-1.5	-179.8	-78.6	-153.2	-142.4	0	0	116.4	R1193 L1194	R1193-E1198 VanDerWaalsContact CZ-O 3.23Å; R1193-E1198 IonicContact CZ-OE2 2.69Å; R1193-E1198 PolarHBondContact NE-O 2.94Å; R1193-E1198 IonicContact NH1-OE2 2.89Å; R1193-E1198 PolarHBondContact NH2-O 2.82Å; R1193-E1198 IonicContact NH2-OE2 2.58Å; R1193-E1198 PolarHBondContact NH2-OE2 2.73Å; L1194-E1198 WeakPolarHBondContact O-CA 3.26Å; L1194-E1198 PolarHBondContact O-N 2.87Å
1199	S	83.3	Confident	78.6	Confident	11 Å²	11	65.8 Å²	65.8	8%	0.077	34%	0.343	C	S	.	.			trans	-81.3	170.7	177.5	65.4	0	0	0	0	112.7	R1193 L1194 N1197 D1208 F1210	R1193-S1199 WeakPolarHBondContact CA-O 3.38Å; R1193-S1199 VanDerWaalsContact CG-O 3.32Å; R1193-S1199 WeakPolarHBondContact CG-O 3.12Å; L1194-S1199 PolarHBondContact N-O 2.68Å; N1197-S1199 PolarHBondContact ND2-OG 3.03Å; N1197-S1199 VanDerWaalsContact ND2-OG 3.08Å; N1197-S1199 PolarHBondContact O-N 2.9Å; S1199-D1208 VanDerWaalsContact CB-O 3.3Å; S1199-D1208 WeakPolarHBondContact CB-O 3.43Å; S1199-D1208 PolarHBondContact OG-O 2.93Å; S1199-F1210 WeakPolarHBondContact CA-O 3.27Å; S1199-F1210 WeakPolarHBondContact CB-O 3.41Å
1200	W	85.1	Confident	79.2	Confident	59 Å²	59	66.2 Å²	66.2	22%	0.223	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	144.9	174	-63	82.3	0	0	0	110.7	P1191 R1193 F1210 L1213 V1216	P1191-W1200 HydrophobicContact CB-CE3 3.99Å; R1193-W1200 HydrophobicContact CB-CD2 3.99Å; R1193-W1200 HydrophobicContact CB-CE3 3.88Å; R1193-W1200 HydrophobicContact CB-CH2 4.2Å; R1193-W1200 HydrophobicContact CB-CZ2 4.27Å; R1193-W1200 HydrophobicContact CB-CZ3 4Å; R1193-W1200 HydrophobicContact CG-CD2 4.07Å; R1193-W1200 HydrophobicContact CG-CE3 4.48Å; R1193-W1200 HydrophobicContact CG-CG 4.42Å; R1193-W1200 HydrophobicContact CG-CZ2 4.3Å; W1200-F1210 HydrophobicContact CB-CB 4.36Å; W1200-F1210 PolarHBondContact N-O 2.89Å; W1200-F1210 WeakPolarHBondContact O-CD2 3.42Å; W1200-L1213 VanDerWaalsContact CD1-N 3.33Å; W1200-L1213 HydrophobicContact CD2-CB 4.02Å; W1200-L1213 HydrophobicContact CD2-CD1 4.13Å; W1200-L1213 HydrophobicContact CE3-CB 4.49Å; W1200-L1213 HydrophobicContact CE3-CD1 3.8Å; W1200-L1213 HydrophobicContact CG-CB 4.43Å; W1200-L1213 HydrophobicContact CH2-CB 4.42Å; W1200-L1213 HydrophobicContact CH2-CD1 4.35Å; W1200-L1213 HydrophobicContact CH2-CD2 4.12Å; W1200-L1213 HydrophobicContact CZ2-CB 3.96Å; W1200-L1213 HydrophobicContact CZ2-CD2 4.36Å; W1200-L1213 HydrophobicContact CZ3-CD1 3.92Å; W1200-L1213 HydrophobicContact CZ3-CD2 4.45Å; W1200-V1216 HydrophobicContact CB-CG2 3.54Å; W1200-V1216 HydrophobicContact CG-CG2 4.46Å
1201	Q	83.6	Confident	79.2	Confident	34 Å²	34	64 Å²	64	16%	0.159	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	131.6	176.2	-178.6	166.8	75.7	0	0	111	V1192 L1194 H1206 K1207 D1208	V1192-Q1201 PolarHBondContact N-O 3.24Å; V1192-Q1201 PolarHBondContact O-N 3.21Å; L1194-Q1201 HydrophobicContact CD1-CB 4Å; L1194-Q1201 HydrophobicContact CG-CB 4.29Å; Q1201-H1206 PolarHBondContact NE2-O 2.76Å; Q1201-K1207 CarbonylContact C-O 3.46Å; Q1201-K1207 VanDerWaalsContact CA-O 3.3Å; Q1201-K1207 WeakPolarHBondContact CA-O 3.36Å; Q1201-D1208 HydrophobicContact CB-CB 4.47Å
1202	C	82.3	Confident	79.3	Confident	0 Å²	0	68.8 Å²	68.8	0%	0	36%	0.358	C	S	.	.			trans	-66.4	124.2	169.8	173	0	0	0	0	110.2	F1204 C1205 H1206 K1207 F1210 V1216	C1202-F1204 PolarHBondContact O-N 2.76Å; C1202-C1205 PolarHBondContact SG-SG 2.73Å; C1202-H1206 VanDerWaalsContact O-CA 3.27Å; C1202-H1206 WeakPolarHBondContact O-CA 3.48Å; C1202-H1206 PolarHBondContact O-N 2.77Å; C1202-K1207 PolarHBondContact N-O 3.48Å; C1202-F1210 HydrophobicContact CB-CE2 3.76Å; C1202-F1210 HydrophobicContact CB-CZ 4.48Å; C1202-V1216 HydrophobicContact CB-CG1 4.21Å
1203	P	78.4	Confident	79.3	Confident	41 Å²	41	67.9 Å²	67.9	27%	0.266	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69	-17.3	-176.4	27.7	-34.5	0	0	0	113.7	A1189 H1206 F1220	A1189-P1203 HydrophobicContact CB-CG 4.22Å; P1203-H1206 PolarHBondContact O-CE1 3.11Å; P1203-F1220 HydrophobicContact CG-CE1 4.41Å; P1203-F1220 HydrophobicContact CG-CZ 3.99Å
1204	F	79.5	Confident	79.4	Confident	30 Å²	30	65 Å²	65	13%	0.132	35%	0.348	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.8	-52.2	-176.6	-52.2	-62.9	0	0	0	113.6	P1181 Q1185 L1186 A1189 C1202 F1220 Q1228	P1181-F1204 HydrophobicContact CB-CD1 3.82Å; P1181-F1204 HydrophobicContact CB-CD2 4.15Å; P1181-F1204 HydrophobicContact CB-CE1 3.85Å; P1181-F1204 HydrophobicContact CB-CE2 4.19Å; P1181-F1204 HydrophobicContact CB-CG 3.98Å; P1181-F1204 HydrophobicContact CB-CZ 4.04Å; P1181-F1204 HydrophobicContact CG-CD1 4.38Å; P1181-F1204 HydrophobicContact CG-CD2 3.91Å; P1181-F1204 HydrophobicContact CG-CE2 4.21Å; P1181-F1204 HydrophobicContact CG-CG 4.01Å; Q1185-F1204 HydrophobicContact CB-CE1 4.22Å; Q1185-F1204 HydrophobicContact CB-CZ 4.49Å; Q1185-F1204 WeakPolarHBondContact O-CZ 3.22Å; L1186-F1204 HydrophobicContact CD2-CD2 4.48Å; L1186-F1204 HydrophobicContact CD2-CE2 3.82Å; L1186-F1204 HydrophobicContact CD2-CZ 4.36Å; A1189-F1204 HydrophobicContact CB-CE2 3.8Å; A1189-F1204 HydrophobicContact CB-CZ 3.73Å; C1202-F1204 PolarHBondContact O-N 2.76Å; F1204-F1220 HydrophobicContact CD2-CD1 4.03Å; F1204-F1220 AromaticContact CD2-CE1 3.56Å; F1204-F1220 HydrophobicContact CD2-CE1 3.56Å; F1204-F1220 HydrophobicContact CD2-CZ 4.27Å; F1204-F1220 HydrophobicContact CE2-CD1 4.03Å; F1204-F1220 AromaticContact CE2-CE1 3.57Å; F1204-F1220 HydrophobicContact CE2-CE1 3.57Å; F1204-F1220 AromaticContact CE2-CZ 3.9Å; F1204-F1220 HydrophobicContact CE2-CZ 3.9Å; F1204-Q1228 WeakPolarHBondContact O-CA 3.46Å; F1204-Q1228 PolarHBondContact O-N 2.99Å
1205	C	77.7	Confident	79.7	Confident	20 Å²	20	66.6 Å²	66.6	14%	0.135	35%	0.354	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.7	-3.1	-177.2	70.7	0	0	0	0	113.8	C1202 K1207 H1219 P1226 G1227	C1202-C1205 PolarHBondContact SG-SG 2.73Å; C1205-K1207 PolarHBondContact O-N 3.26Å; C1205-H1219 PolarHBondContact SG-NE2 3.13Å; C1205-P1226 HydrophobicContact CB-CG 3.86Å; C1205-G1227 WeakPolarHBondContact CA-O 3.37Å; C1205-G1227 WeakPolarHBondContact CB-O 3.37Å
1206	H	74	Confident	80	Confident	50 Å²	50	58.6 Å²	58.6	23%	0.231	31%	0.311	C	S	.	.			trans	60.3	6.9	179.8	-57.9	-44.1	0	0	0	117	Q1201 C1202 P1203 D1208	Q1201-H1206 PolarHBondContact NE2-O 2.76Å; C1202-H1206 VanDerWaalsContact O-CA 3.27Å; C1202-H1206 WeakPolarHBondContact O-CA 3.48Å; C1202-H1206 PolarHBondContact O-N 2.77Å; P1203-H1206 PolarHBondContact O-CE1 3.11Å; H1206-D1208 PolarHBondContact O-N 3.27Å
1207	K	76.7	Confident	80.3	Confident	87 Å²	87	57.9 Å²	57.9	38%	0.378	29%	0.292	S	S	.	.			trans	-50.8	130.2	163.5	-90.7	177.9	148.2	-84.5	0	111.5	Q1201 C1202 C1205 D1209 F1210	Q1201-K1207 CarbonylContact C-O 3.46Å; Q1201-K1207 VanDerWaalsContact CA-O 3.3Å; Q1201-K1207 WeakPolarHBondContact CA-O 3.36Å; C1202-K1207 PolarHBondContact N-O 3.48Å; C1205-K1207 PolarHBondContact O-N 3.26Å; K1207-D1209 VanDerWaalsContact CB-OD1 3.31Å; K1207-D1209 WeakPolarHBondContact CB-OD1 3.45Å; K1207-D1209 WeakPolarHBondContact CG-OD1 3.45Å; K1207-D1209 VanDerWaalsContact NZ-CG 3.29Å; K1207-D1209 IonicContact NZ-OD1 2.71Å; K1207-D1209 PolarHBondContact NZ-OD1 2.78Å; K1207-D1209 VanDerWaalsContact NZ-OD1 3.12Å; K1207-D1209 IonicContact NZ-OD2 3.41Å; K1207-D1209 PolarHBondContact NZ-OD2 2.74Å; K1207-F1210 HydrophobicContact CB-CE2 3.63Å; K1207-F1210 HydrophobicContact CB-CZ 4.09Å; K1207-F1210 HydrophobicContact CD-CZ 4.41Å; K1207-F1210 WeakPolarHBondContact O-CE2 3.35Å
1208	D	78.9	Confident	80.5	Confident	76 Å²	76	59 Å²	59	41%	0.406	30%	0.298	S	S	.	.			trans	-118.7	16.1	-175.6	59.8	-24.5	0	0	0	112.9	L1194 S1199 Q1201 H1206 F1210	L1194-D1208 HydrophobicContact CD1-CB 3.56Å; S1199-D1208 VanDerWaalsContact CB-O 3.3Å; S1199-D1208 WeakPolarHBondContact CB-O 3.43Å; S1199-D1208 PolarHBondContact OG-O 2.93Å; Q1201-D1208 HydrophobicContact CB-CB 4.47Å; H1206-D1208 PolarHBondContact O-N 3.27Å; D1208-F1210 PolarHBondContact O-N 3.14Å
1209	D	79.4	Confident	80.8	Confident	91 Å²	91	53.3 Å²	53.3	49%	0.487	27%	0.272	S	S	.	.			trans	-89.9	15.3	-175.2	55.6	-30.1	0	0	0	114.8	K1207 P1211	K1207-D1209 VanDerWaalsContact CB-OD1 3.31Å; K1207-D1209 WeakPolarHBondContact CB-OD1 3.45Å; K1207-D1209 WeakPolarHBondContact CG-OD1 3.45Å; K1207-D1209 VanDerWaalsContact NZ-CG 3.29Å; K1207-D1209 IonicContact NZ-OD1 2.71Å; K1207-D1209 PolarHBondContact NZ-OD1 2.78Å; K1207-D1209 VanDerWaalsContact NZ-OD1 3.12Å; K1207-D1209 IonicContact NZ-OD2 3.41Å; K1207-D1209 PolarHBondContact NZ-OD2 2.74Å; D1209-P1211 WeakPolarHBondContact O-CD 3.48Å
1210	F	82.9	Confident	80.4	Confident	19 Å²	19	53.3 Å²	53.3	8%	0.083	27%	0.27	C	S	.	.	B	Isolated β-bridge	trans	-100.8	98.9	-176	-52.8	-76	0	0	0	112.7	S1199 W1200 C1202 K1207 D1208 E1212 E1215 V1216 H1219	S1199-F1210 WeakPolarHBondContact CA-O 3.27Å; S1199-F1210 WeakPolarHBondContact CB-O 3.41Å; W1200-F1210 HydrophobicContact CB-CB 4.36Å; W1200-F1210 PolarHBondContact N-O 2.89Å; W1200-F1210 WeakPolarHBondContact O-CD2 3.42Å; C1202-F1210 HydrophobicContact CB-CE2 3.76Å; C1202-F1210 HydrophobicContact CB-CZ 4.48Å; K1207-F1210 HydrophobicContact CB-CE2 3.63Å; K1207-F1210 HydrophobicContact CB-CZ 4.09Å; K1207-F1210 HydrophobicContact CD-CZ 4.41Å; K1207-F1210 WeakPolarHBondContact O-CE2 3.35Å; D1208-F1210 PolarHBondContact O-N 3.14Å; F1210-E1212 VanDerWaalsContact C-N 3.29Å; F1210-E1212 PolarHBondContact O-N 3.13Å; F1210-E1215 HydrophobicContact CB-CB 4.31Å; F1210-E1215 HydrophobicContact CD1-CB 3.91Å; F1210-V1216 HydrophobicContact CB-CG2 3.7Å; F1210-V1216 HydrophobicContact CD2-CG2 3.89Å; F1210-V1216 HydrophobicContact CG-CG2 3.79Å; F1210-H1219 HydrophobicContact CE1-CB 3.66Å; F1210-H1219 AromaticContact CE1-CG 3.77Å; F1210-H1219 HydrophobicContact CZ-CB 3.79Å; F1210-H1219 AromaticContact CZ-CD2 3.6Å; F1210-H1219 AromaticContact CZ-CE1 3.94Å; F1210-H1219 AromaticContact CZ-CG 3.43Å; F1210-H1219 VanDerWaalsContact CZ-CG 3.43Å; F1210-H1219 AromaticContact CZ-ND1 3.67Å; F1210-H1219 AromaticContact CZ-NE2 3.93Å
1211	P	81.9	Confident	79.9	Confident	88 Å²	88	56.4 Å²	56.4	57%	0.571	29%	0.291	S	S	*	.	S	Bend	trans	-59.1	-33.2	173.8	19.8	-32.1	0	0	0	114.2	D1209 E1215	D1209-P1211 WeakPolarHBondContact O-CD 3.48Å; P1211-E1215 WeakPolarHBondContact CD-OE2 3.47Å; P1211-E1215 VanDerWaalsContact CG-OE2 3.23Å; P1211-E1215 WeakPolarHBondContact CG-OE2 3.28Å
1212	E	81.9	Confident	79.5	Confident	112 Å²	112	58.4 Å²	58.4	52%	0.523	31%	0.313	S	S	.	.	S	Bend	trans	-111	145.5	177	-72.9	-163.9	-169.5	0	0	114.2	F1210 S1214 E1215	F1210-E1212 VanDerWaalsContact C-N 3.29Å; F1210-E1212 PolarHBondContact O-N 3.13Å; E1212-S1214 PolarHBondContact O-N 3.01Å; E1212-S1214 WeakPolarHBondContact OE2-CB 3.45Å; E1212-S1214 PolarHBondContact OE2-OG 3.45Å; E1212-E1215 HydrophobicContact CB-CG 4.16Å; E1212-E1215 PolarHBondContact N-OE2 3.21Å; E1212-E1215 WeakPolarHBondContact O-CB 3.42Å; E1212-E1215 PolarHBondContact O-N 2.84Å
1213	L	81.2	Confident	78.9	Confident	63 Å²	63	64.2 Å²	64.2	33%	0.33	34%	0.344	S	S	.	.	H	α-helix	trans	-55.3	-38	168.5	178.5	57.7	0	0	0	111.2	P1191 W1200 E1215 V1216 W1217	P1191-L1213 HydrophobicContact CB-CD1 3.64Å; P1191-L1213 HydrophobicContact CG-CD1 3.72Å; W1200-L1213 VanDerWaalsContact CD1-N 3.33Å; W1200-L1213 HydrophobicContact CD2-CB 4.02Å; W1200-L1213 HydrophobicContact CD2-CD1 4.13Å; W1200-L1213 HydrophobicContact CE3-CB 4.49Å; W1200-L1213 HydrophobicContact CE3-CD1 3.8Å; W1200-L1213 HydrophobicContact CG-CB 4.43Å; W1200-L1213 HydrophobicContact CH2-CB 4.42Å; W1200-L1213 HydrophobicContact CH2-CD1 4.35Å; W1200-L1213 HydrophobicContact CH2-CD2 4.12Å; W1200-L1213 HydrophobicContact CZ2-CB 3.96Å; W1200-L1213 HydrophobicContact CZ2-CD2 4.36Å; W1200-L1213 HydrophobicContact CZ3-CD1 3.92Å; W1200-L1213 HydrophobicContact CZ3-CD2 4.45Å; L1213-E1215 PolarHBondContact O-N 3.32Å; L1213-V1216 PolarHBondContact O-N 3.36Å; L1213-V1216 VanDerWaalsContact O-N 3.12Å; L1213-W1217 PolarHBondContact O-N 3.39Å
1214	S	82.1	Confident	78.8	Confident	58 Å²	58	65 Å²	65	41%	0.406	36%	0.355	S	S	.	.	H	α-helix	trans	-46.9	-41	173	-39.3	0	0	0	0	112.6	E1212 N1218	E1212-S1214 PolarHBondContact O-N 3.01Å; E1212-S1214 WeakPolarHBondContact OE2-CB 3.45Å; E1212-S1214 PolarHBondContact OE2-OG 3.45Å; S1214-N1218 VanDerWaalsContact O-CG 3.31Å; S1214-N1218 PolarHBondContact O-N 3.5Å; S1214-N1218 PolarHBondContact O-ND2 3.19Å
1215	E	83.2	Confident	78.7	Confident	74 Å²	74	64 Å²	64	35%	0.346	35%	0.352	S	S	.	.	H	α-helix	trans	-78.9	-27.9	-174.9	-63.3	170.7	156	0	0	112.3	F1210 P1211 E1212 L1213 N1218 H1219	F1210-E1215 HydrophobicContact CB-CB 4.31Å; F1210-E1215 HydrophobicContact CD1-CB 3.91Å; P1211-E1215 WeakPolarHBondContact CD-OE2 3.47Å; P1211-E1215 VanDerWaalsContact CG-OE2 3.23Å; P1211-E1215 WeakPolarHBondContact CG-OE2 3.28Å; E1212-E1215 HydrophobicContact CB-CG 4.16Å; E1212-E1215 PolarHBondContact N-OE2 3.21Å; E1212-E1215 WeakPolarHBondContact O-CB 3.42Å; E1212-E1215 PolarHBondContact O-N 2.84Å; L1213-E1215 PolarHBondContact O-N 3.32Å; E1215-N1218 PolarHBondContact O-N 3.02Å; E1215-H1219 VanDerWaalsContact O-CB 3.24Å; E1215-H1219 WeakPolarHBondContact O-CB 3.26Å; E1215-H1219 PolarHBondContact O-N 2.88Å
1216	V	80.1	Confident	78.5	Confident	0 Å²	0	65.4 Å²	65.4	0%	0	36%	0.36	C	S	.	.	H	α-helix	trans	-67.9	-39.5	172.6	-166.4	0	0	0	0	110.8	P1191 W1200 C1202 F1210 L1213 H1219 F1220	P1191-V1216 HydrophobicContact CB-CB 4.27Å; P1191-V1216 HydrophobicContact CB-CG1 3.98Å; P1191-V1216 HydrophobicContact CB-CG2 4.36Å; P1191-V1216 HydrophobicContact CG-CB 4.15Å; P1191-V1216 HydrophobicContact CG-CG1 3.78Å; W1200-V1216 HydrophobicContact CB-CG2 3.54Å; W1200-V1216 HydrophobicContact CG-CG2 4.46Å; C1202-V1216 HydrophobicContact CB-CG1 4.21Å; F1210-V1216 HydrophobicContact CB-CG2 3.7Å; F1210-V1216 HydrophobicContact CD2-CG2 3.89Å; F1210-V1216 HydrophobicContact CG-CG2 3.79Å; L1213-V1216 PolarHBondContact O-N 3.36Å; L1213-V1216 VanDerWaalsContact O-N 3.12Å; V1216-H1219 WeakPolarHBondContact O-CB 2.94Å; V1216-H1219 PolarHBondContact O-N 2.9Å; V1216-F1220 HydrophobicContact CG1-CE1 3.99Å; V1216-F1220 HydrophobicContact CG1-CE2 4.29Å; V1216-F1220 HydrophobicContact CG1-CZ 3.69Å; V1216-F1220 WeakPolarHBondContact O-CG 3.33Å; V1216-F1220 PolarHBondContact O-N 2.81Å; V1216-F1220 VanDerWaalsContact O-N 3.16Å
1217	W	80.4	Confident	78.7	Confident	93 Å²	93	63 Å²	63	35%	0.352	35%	0.349	S	S	.	.	H	α-helix	trans	-67.2	-44.9	173.2	-66.1	102.7	0	0	0	111.5	A1189 P1191 L1213 H1219 F1220 D1221	A1189-W1217 HydrophobicContact CB-CH2 4.17Å; A1189-W1217 HydrophobicContact CB-CZ3 4.41Å; A1189-W1217 WeakPolarHBondContact O-CH2 3.11Å; P1191-W1217 HydrophobicContact CG-CZ2 4.23Å; L1213-W1217 PolarHBondContact O-N 3.39Å; W1217-H1219 PolarHBondContact O-N 3.33Å; W1217-F1220 HydrophobicContact CD2-CD2 4.1Å; W1217-F1220 HydrophobicContact CD2-CE2 4.04Å; W1217-F1220 AromaticContact CE3-CD2 3.49Å; W1217-F1220 HydrophobicContact CE3-CD2 3.49Å; W1217-F1220 VanDerWaalsContact CE3-CD2 3.49Å; W1217-F1220 AromaticContact CE3-CE2 3.68Å; W1217-F1220 HydrophobicContact CE3-CE2 3.68Å; W1217-F1220 HydrophobicContact CH2-CE2 4.19Å; W1217-F1220 AromaticContact CZ3-CD2 3.82Å; W1217-F1220 HydrophobicContact CZ3-CD2 3.82Å; W1217-F1220 AromaticContact CZ3-CE2 3.76Å; W1217-F1220 HydrophobicContact CZ3-CE2 3.76Å; W1217-F1220 WeakPolarHBondContact O-CA 3.47Å; W1217-F1220 WeakPolarHBondContact O-CB 3.22Å; W1217-F1220 PolarHBondContact O-N 3.18Å; W1217-D1221 PolarHBondContact O-N 2.9Å
1218	N	82.7	Confident	79	Confident	99 Å²	99	64.4 Å²	64.4	53%	0.529	36%	0.357	S	S	.	.	H	α-helix	trans	-57.4	-34.7	171.4	-71	-33.9	0	0	0	112.6	S1214 E1215 F1220 D1221 A1222	S1214-N1218 VanDerWaalsContact O-CG 3.31Å; S1214-N1218 PolarHBondContact O-N 3.5Å; S1214-N1218 PolarHBondContact O-ND2 3.19Å; E1215-N1218 PolarHBondContact O-N 3.02Å; N1218-F1220 VanDerWaalsContact C-N 3.32Å; N1218-D1221 PolarHBondContact O-N 3.28Å; N1218-A1222 WeakPolarHBondContact O-CB 3.29Å; N1218-A1222 PolarHBondContact O-N 3.35Å
1219	H	81.5	Confident	79.1	Confident	15 Å²	15	61.1 Å²	61.1	7%	0.069	34%	0.34	C	S	.	.	H	α-helix	trans	-68.5	-29.2	176.9	177.3	74.1	0	0	0	113.1	C1205 F1210 E1215 V1216 W1217 A1224 C1225	C1205-H1219 PolarHBondContact SG-NE2 3.13Å; F1210-H1219 HydrophobicContact CE1-CB 3.66Å; F1210-H1219 AromaticContact CE1-CG 3.77Å; F1210-H1219 HydrophobicContact CZ-CB 3.79Å; F1210-H1219 AromaticContact CZ-CD2 3.6Å; F1210-H1219 AromaticContact CZ-CE1 3.94Å; F1210-H1219 AromaticContact CZ-CG 3.43Å; F1210-H1219 VanDerWaalsContact CZ-CG 3.43Å; F1210-H1219 AromaticContact CZ-ND1 3.67Å; F1210-H1219 AromaticContact CZ-NE2 3.93Å; E1215-H1219 VanDerWaalsContact O-CB 3.24Å; E1215-H1219 WeakPolarHBondContact O-CB 3.26Å; E1215-H1219 PolarHBondContact O-N 2.88Å; V1216-H1219 WeakPolarHBondContact O-CB 2.94Å; V1216-H1219 PolarHBondContact O-N 2.9Å; W1217-H1219 PolarHBondContact O-N 3.33Å; H1219-A1224 VanDerWaalsContact CE1-C 3.5Å; H1219-A1224 PolarHBondContact CE1-O 2.8Å; H1219-A1224 VanDerWaalsContact CE1-O 3.26Å; H1219-A1224 PolarHBondContact O-N 3.15Å; H1219-C1225 VanDerWaalsContact CE1-CA 3.45Å; H1219-C1225 WeakPolarHBondContact CE1-CA 3.22Å; H1219-C1225 VanDerWaalsContact NE2-CA 3.35Å; H1219-C1225 WeakPolarHBondContact NE2-CA 3.43Å; H1219-C1225 WeakPolarHBondContact NE2-CB 3.28Å; H1219-C1225 PolarHBondContact O-N 3.26Å
1220	F	74	Confident	79.5	Confident	11 Å²	11	58.1 Å²	58.1	5%	0.048	33%	0.326	C	S	.	.	H	α-helix	trans	-71.9	-59.6	166.5	-53.2	-30.2	0	0	0	110.8	L1186 A1189 P1191 P1203 F1204 V1216 W1217 N1218 A1222 N1223	L1186-F1220 HydrophobicContact CD2-CB 4.01Å; L1186-F1220 HydrophobicContact CD2-CD1 4.3Å; L1186-F1220 HydrophobicContact CD2-CG 4.08Å; A1189-F1220 HydrophobicContact CB-CD2 4.44Å; A1189-F1220 HydrophobicContact CB-CE2 3.59Å; A1189-F1220 HydrophobicContact CB-CZ 3.74Å; P1191-F1220 HydrophobicContact CG-CE2 4.38Å; P1191-F1220 HydrophobicContact CG-CZ 4.29Å; P1203-F1220 HydrophobicContact CG-CE1 4.41Å; P1203-F1220 HydrophobicContact CG-CZ 3.99Å; F1204-F1220 HydrophobicContact CD2-CD1 4.03Å; F1204-F1220 AromaticContact CD2-CE1 3.56Å; F1204-F1220 HydrophobicContact CD2-CE1 3.56Å; F1204-F1220 HydrophobicContact CD2-CZ 4.27Å; F1204-F1220 HydrophobicContact CE2-CD1 4.03Å; F1204-F1220 AromaticContact CE2-CE1 3.57Å; F1204-F1220 HydrophobicContact CE2-CE1 3.57Å; F1204-F1220 AromaticContact CE2-CZ 3.9Å; F1204-F1220 HydrophobicContact CE2-CZ 3.9Å; V1216-F1220 HydrophobicContact CG1-CE1 3.99Å; V1216-F1220 HydrophobicContact CG1-CE2 4.29Å; V1216-F1220 HydrophobicContact CG1-CZ 3.69Å; V1216-F1220 WeakPolarHBondContact O-CG 3.33Å; V1216-F1220 PolarHBondContact O-N 2.81Å; V1216-F1220 VanDerWaalsContact O-N 3.16Å; W1217-F1220 HydrophobicContact CD2-CD2 4.1Å; W1217-F1220 HydrophobicContact CD2-CE2 4.04Å; W1217-F1220 AromaticContact CE3-CD2 3.49Å; W1217-F1220 HydrophobicContact CE3-CD2 3.49Å; W1217-F1220 VanDerWaalsContact CE3-CD2 3.49Å; W1217-F1220 AromaticContact CE3-CE2 3.68Å; W1217-F1220 HydrophobicContact CE3-CE2 3.68Å; W1217-F1220 HydrophobicContact CH2-CE2 4.19Å; W1217-F1220 AromaticContact CZ3-CD2 3.82Å; W1217-F1220 HydrophobicContact CZ3-CD2 3.82Å; W1217-F1220 AromaticContact CZ3-CE2 3.76Å; W1217-F1220 HydrophobicContact CZ3-CE2 3.76Å; W1217-F1220 WeakPolarHBondContact O-CA 3.47Å; W1217-F1220 WeakPolarHBondContact O-CB 3.22Å; W1217-F1220 PolarHBondContact O-N 3.18Å; N1218-F1220 VanDerWaalsContact C-N 3.32Å; F1220-A1222 VanDerWaalsContact C-N 3.33Å; F1220-A1222 PolarHBondContact O-N 3.33Å; F1220-N1223 WeakPolarHBondContact O-CA 3.49Å; F1220-N1223 PolarHBondContact O-N 3.08Å
1221	D	75	Confident	79.8	Confident	123 Å²	123	57.2 Å²	57.2	66%	0.658	32%	0.322	S	S	*	.	H	α-helix	trans	-65.2	-32.8	-167.5	-67.6	-16	0	0	0	113.1	W1217 N1218 N1223	W1217-D1221 PolarHBondContact O-N 2.9Å; N1218-D1221 PolarHBondContact O-N 3.28Å; D1221-N1223 PolarHBondContact O-N 3.49Å
1222	A	76	Confident	80.4	Confident	76 Å²	76	53 Å²	53	63%	0.628	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.3	4.6	175.4	0	0	0	0	0	113.9	N1218 F1220 A1224	N1218-A1222 WeakPolarHBondContact O-CB 3.29Å; N1218-A1222 PolarHBondContact O-N 3.35Å; F1220-A1222 VanDerWaalsContact C-N 3.33Å; F1220-A1222 PolarHBondContact O-N 3.33Å; A1222-A1224 HydrophobicContact CB-CB 4.35Å; A1222-A1224 PolarHBondContact O-N 3.41Å; A1222-A1224 VanDerWaalsContact O-N 3.13Å
1223	N	69.7	Low	81	Confident	122 Å²	122	53.7 Å²	53.7	65%	0.652	29%	0.292	S	S	*	.	S	Bend	trans	54.3	21.9	-168.3	-71.2	-66.2	0	0	0	113.9	F1220 D1221 C1225	F1220-N1223 WeakPolarHBondContact O-CA 3.49Å; F1220-N1223 PolarHBondContact O-N 3.08Å; D1221-N1223 PolarHBondContact O-N 3.49Å; N1223-C1225 VanDerWaalsContact C-N 3.25Å; N1223-C1225 PolarHBondContact O-N 2.81Å
1224	A	76.2	Confident	81.7	Confident	59 Å²	59	50.8 Å²	50.8	49%	0.488	28%	0.277	S	S	.	.			trans	-75.5	-15.6	-178.4	0	0	0	0	0	112.8	H1219 A1222 P1226	H1219-A1224 VanDerWaalsContact CE1-C 3.5Å; H1219-A1224 PolarHBondContact CE1-O 2.8Å; H1219-A1224 VanDerWaalsContact CE1-O 3.26Å; H1219-A1224 PolarHBondContact O-N 3.15Å; A1222-A1224 HydrophobicContact CB-CB 4.35Å; A1222-A1224 PolarHBondContact O-N 3.41Å; A1222-A1224 VanDerWaalsContact O-N 3.13Å; A1224-P1226 WeakPolarHBondContact O-CD 3.49Å
1225	C	76.7	Confident	82.2	Confident	9 Å²	9	54.5 Å²	54.5	6%	0.061	28%	0.282	C	S	.	.			trans	-73.7	116.5	173.8	-174.6	0	0	0	0	111.7	H1219 N1223 G1227	H1219-C1225 VanDerWaalsContact CE1-CA 3.45Å; H1219-C1225 WeakPolarHBondContact CE1-CA 3.22Å; H1219-C1225 VanDerWaalsContact NE2-CA 3.35Å; H1219-C1225 WeakPolarHBondContact NE2-CA 3.43Å; H1219-C1225 WeakPolarHBondContact NE2-CB 3.28Å; H1219-C1225 PolarHBondContact O-N 3.26Å; N1223-C1225 VanDerWaalsContact C-N 3.25Å; N1223-C1225 PolarHBondContact O-N 2.81Å; C1225-G1227 PolarHBondContact O-N 3.29Å; C1225-G1227 PolarHBondContact SG-N 3.08Å
1226	P	73.2	Confident	82.7	Confident	48 Å²	48	51.2 Å²	51.2	31%	0.312	27%	0.267	S	S	.	.			trans	-66.2	-23.3	171.8	29.5	-35.1	0	0	0	111.6	Y1178 C1205 A1224	Y1178-P1226 VanDerWaalsContact CB-O 3.25Å; Y1178-P1226 WeakPolarHBondContact CB-O 3.3Å; Y1178-P1226 HydrophobicContact CD1-CB 4.05Å; Y1178-P1226 HydrophobicContact CD1-CG 4.27Å; Y1178-P1226 HydrophobicContact CD2-CB 4.23Å; Y1178-P1226 HydrophobicContact CG-CB 3.87Å; C1205-P1226 HydrophobicContact CB-CG 3.86Å; A1224-P1226 WeakPolarHBondContact O-CD 3.49Å
1227	G	79.6	Confident	82.9	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	30%	0.298	C	S	.	.			trans	92.4	-164.5	-175.9	0	0	0	0	0	112.8	R1179 C1205 C1225	R1179-G1227 CarbonylContact O-C 3.5Å; R1179-G1227 VanDerWaalsContact O-CA 3.27Å; R1179-G1227 WeakPolarHBondContact O-CA 3.39Å; C1205-G1227 WeakPolarHBondContact CA-O 3.37Å; C1205-G1227 WeakPolarHBondContact CB-O 3.37Å; C1225-G1227 PolarHBondContact O-N 3.29Å; C1225-G1227 PolarHBondContact SG-N 3.08Å
1228	Q	81.8	Confident	83.1	Confident	116 Å²	116	55.6 Å²	55.6	54%	0.542	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	127	-175.7	-169.3	178.1	35.6	0	0	110.7	R1179 F1204 S1230	R1179-Q1228 PolarHBondContact N-O 2.81Å; R1179-Q1228 PolarHBondContact O-N 3Å; F1204-Q1228 WeakPolarHBondContact O-CA 3.46Å; F1204-Q1228 PolarHBondContact O-N 2.99Å; Q1228-S1230 PolarHBondContact O-N 2.92Å
1229	P	82.6	Confident	83.2	Confident	8 Å²	8	52.8 Å²	52.8	5%	0.052	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.7	128	177.4	23.5	-31.8	0	0	0	110.8	Y1178 I1246 R1255 P1257	Y1178-P1229 HydrophobicContact CD1-CB 3.8Å; Y1178-P1229 HydrophobicContact CE1-CB 3.75Å; Y1178-P1229 HydrophobicContact CE1-CG 4.42Å; P1229-I1246 HydrophobicContact CB-CD1 4.03Å; P1229-I1246 HydrophobicContact CG-CD1 3.89Å; P1229-I1246 WeakPolarHBondContact O-CD1 3.34Å; P1229-R1255 WeakPolarHBondContact CG-O 3.16Å; P1229-P1257 HydrophobicContact CB-CG 4.03Å
1230	S	86.4	Confident	83.6	Confident	28 Å²	28	52.4 Å²	52.4	20%	0.196	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	-25.1	-173.8	-165.7	0	0	0	0	113	T1177 Q1228 I1246	T1177-S1230 PolarHBondContact O-N 3.04Å; Q1228-S1230 PolarHBondContact O-N 2.92Å; S1230-I1246 PolarHBondContact O-N 3.43Å
1231	G	90.5	Very high	84.5	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	162.7	179.1	-177.1	0	0	0	0	0	113.8	T1177 I1244	T1177-G1231 PolarHBondContact N-O 3.24Å; T1177-G1231 PolarHBondContact OG1-N 3.19Å; T1177-G1231 PolarHBondContact OG1-O 3.24Å; G1231-I1244 CarbonylContact C-O 3.58Å; G1231-I1244 WeakPolarHBondContact CA-O 3.3Å
1232	V	93.3	Very high	85.3	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	129.6	-176.7	-171	0	0	0	0	108.7	V1173 F1176 V1234 I1244 L1249 P1257 V1261	V1173-V1232 HydrophobicContact CB-CG1 4.41Å; V1173-V1232 HydrophobicContact CG1-CG1 3.54Å; V1173-V1232 HydrophobicContact CG2-CG1 4.14Å; F1176-V1232 HydrophobicContact CD1-CG1 4.3Å; F1176-V1232 HydrophobicContact CD1-CG2 4.09Å; F1176-V1232 HydrophobicContact CE1-CG1 4.21Å; F1176-V1232 HydrophobicContact CE1-CG2 4.2Å; V1232-V1234 HydrophobicContact CG1-CG1 4.35Å; V1232-I1244 HydrophobicContact CB-CB 4.37Å; V1232-I1244 PolarHBondContact N-O 3.33Å; V1232-I1244 PolarHBondContact O-N 2.95Å; V1232-L1249 HydrophobicContact CG2-CD1 3.97Å; V1232-L1249 HydrophobicContact CG2-CD2 3.9Å; V1232-P1257 HydrophobicContact CG2-CB 3.85Å; V1232-V1261 HydrophobicContact CG1-CG2 4.22Å; V1232-V1261 HydrophobicContact CG2-CG2 4.22Å
1233	R	95.2	Very high	86.3	Confident	125 Å²	125	48.4 Å²	48.4	47%	0.472	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	138.9	166.3	-69.8	172.9	-70.2	166.7	-2.9	109.2	T1174 G1175 F1176 T1177 F1243	T1174-R1233 PolarHBondContact N-O 2.88Å; T1174-R1233 WeakPolarHBondContact OG1-CB 3.4Å; T1174-R1233 PolarHBondContact OG1-O 2.62Å; G1175-R1233 PolarHBondContact N-O 2.93Å; G1175-R1233 WeakPolarHBondContact O-CB 3.14Å; G1175-R1233 PolarHBondContact O-N 3.31Å; F1176-R1233 PolarHBondContact O-NH2 3.27Å; F1176-R1233 VanDerWaalsContact O-NH2 3.15Å; T1177-R1233 HydrophobicContact CG2-CG 3.82Å; R1233-F1243 HydrophobicContact CG-CD2 4.16Å
1234	V	94.9	Very high	87.5	Confident	2 Å²	2	42.6 Å²	42.6	1%	0.012	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	168.3	175.1	-55.4	0	0	0	0	110.2	A1171 M1172 V1173 V1232 G1242 I1244 I1267	A1171-V1234 HydrophobicContact CB-CB 3.92Å; A1171-V1234 HydrophobicContact CB-CG2 3.84Å; M1172-V1234 CarbonylContact O-C 3.46Å; M1172-V1234 WeakPolarHBondContact O-CA 3.24Å; M1172-V1234 WeakPolarHBondContact O-CB 3.45Å; V1173-V1234 HydrophobicContact CG2-CG1 4.28Å; V1232-V1234 HydrophobicContact CG1-CG1 4.35Å; V1234-G1242 PolarHBondContact N-O 2.96Å; V1234-G1242 PolarHBondContact O-N 2.81Å; V1234-I1244 HydrophobicContact CG1-CD1 3.76Å; V1234-I1244 HydrophobicContact CG1-CG1 4.22Å; V1234-I1267 HydrophobicContact CG1-CD1 4.22Å
1235	R	94.3	Very high	88.2	Confident	136 Å²	136	43.1 Å²	43.1	51%	0.513	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	131.1	167.5	173.5	178.5	-68.4	163.2	-1.1	108.1	A1171 M1172 T1174 L1240	A1171-R1235 CarbonylContact C-O 3.51Å; A1171-R1235 VanDerWaalsContact CA-O 3.29Å; A1171-R1235 WeakPolarHBondContact CA-O 3.48Å; M1172-R1235 PolarHBondContact N-O 2.88Å; M1172-R1235 PolarHBondContact O-N 2.96Å; T1174-R1235 HydrophobicContact CG2-CB 3.67Å; R1235-L1240 WeakPolarHBondContact CA-O 3.37Å
1236	L	91.8	Very high	88.8	Confident	5 Å²	5	44.2 Å²	44.2	3%	0.026	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	163.1	174.1	-68.6	152.7	0	0	0	110.2	F1163 V1169 A1171 N1238 G1239 L1240 V1269 V1281	F1163-L1236 HydrophobicContact CE2-CD1 4.4Å; F1163-L1236 HydrophobicContact CZ-CD1 4.02Å; V1169-L1236 HydrophobicContact CB-CD2 4.18Å; V1169-L1236 HydrophobicContact CG2-CD2 3.39Å; A1171-L1236 HydrophobicContact CB-CD2 4.23Å; L1236-N1238 VanDerWaalsContact C-N 3.33Å; L1236-N1238 WeakPolarHBondContact CB-OD1 3.45Å; L1236-N1238 PolarHBondContact O-N 2.9Å; L1236-G1239 WeakPolarHBondContact O-CA 3.37Å; L1236-G1239 PolarHBondContact O-N 3.21Å; L1236-L1240 HydrophobicContact CB-CB 4.34Å; L1236-L1240 HydrophobicContact CD1-CB 3.85Å; L1236-L1240 PolarHBondContact N-O 2.71Å; L1236-V1269 HydrophobicContact CD2-CG2 4.42Å; L1236-V1281 HydrophobicContact CD1-CB 3.93Å; L1236-V1281 HydrophobicContact CD1-CG1 4.31Å; L1236-V1281 HydrophobicContact CD1-CG2 3.61Å
1237	E	86.1	Confident	89.6	Confident	139 Å²	139	49.2 Å²	49.2	65%	0.65	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-36.3	-176.5	-70.7	173.3	178.5	0	0	112.4	T1170 G1239	T1170-E1237 WeakPolarHBondContact CB-OE1 3.36Å; T1170-E1237 PolarHBondContact OG1-OE1 2.86Å; T1170-E1237 PolarHBondContact OG1-OE2 3.04Å; E1237-G1239 PolarHBondContact O-N 2.62Å
1238	N	83.9	Confident	90.2	Very high	46 Å²	46	50.8 Å²	50.8	25%	0.246	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.5	16.4	167.4	66.1	16.7	0	0	0	114.7	E1158 F1163 L1236 L1240	E1158-N1238 HydrophobicContact CG-CB 4.42Å; E1158-N1238 PolarHBondContact OE1-ND2 2.85Å; F1163-N1238 WeakPolarHBondContact CD2-ND2 3.47Å; F1163-N1238 WeakPolarHBondContact CE2-ND2 3.43Å; L1236-N1238 VanDerWaalsContact C-N 3.33Å; L1236-N1238 WeakPolarHBondContact CB-OD1 3.45Å; L1236-N1238 PolarHBondContact O-N 2.9Å; N1238-L1240 PolarHBondContact O-N 2.76Å; N1238-L1240 VanDerWaalsContact O-N 3.13Å; N1238-L1240 WeakPolarHBondContact OD1-CB 3.1Å; N1238-L1240 WeakPolarHBondContact OD1-CG 3.3Å; N1238-L1240 PolarHBondContact OD1-N 2.81Å
1239	G	83.6	Confident	90.6	Very high	41 Å²	41	45.3 Å²	45.3	42%	0.423	22%	0.222	S	C	.	.	S	Bend	trans	76.4	-11	177.5	0	0	0	0	0	115.9	L1236 E1237	L1236-G1239 WeakPolarHBondContact O-CA 3.37Å; L1236-G1239 PolarHBondContact O-N 3.21Å; E1237-G1239 PolarHBondContact O-N 2.62Å
1240	L	90	Very high	90.9	Very high	7 Å²	7	46 Å²	46	4%	0.037	23%	0.227	C	C	.	.	P	Polyproline II helix	trans	-63.2	136.6	-173.8	-71.5	171.5	0	0	0	112.5	F1152 T1156 F1163 R1235 L1236 N1238 G1242 F1279 V1281	F1152-L1240 HydrophobicContact CE2-CD1 4.22Å; F1152-L1240 HydrophobicContact CE2-CD2 4.3Å; F1152-L1240 HydrophobicContact CZ-CD1 3.73Å; T1156-L1240 HydrophobicContact CG2-CD1 4.18Å; T1156-L1240 HydrophobicContact CG2-CD2 3.94Å; T1156-L1240 HydrophobicContact CG2-CG 4.26Å; F1163-L1240 HydrophobicContact CE1-CD1 3.82Å; F1163-L1240 HydrophobicContact CE2-CD1 4.48Å; F1163-L1240 HydrophobicContact CZ-CD1 3.79Å; R1235-L1240 WeakPolarHBondContact CA-O 3.37Å; L1236-L1240 HydrophobicContact CB-CB 4.34Å; L1236-L1240 HydrophobicContact CD1-CB 3.85Å; L1236-L1240 PolarHBondContact N-O 2.71Å; N1238-L1240 PolarHBondContact O-N 2.76Å; N1238-L1240 VanDerWaalsContact O-N 3.13Å; N1238-L1240 WeakPolarHBondContact OD1-CB 3.1Å; N1238-L1240 WeakPolarHBondContact OD1-CG 3.3Å; N1238-L1240 PolarHBondContact OD1-N 2.81Å; L1240-G1242 PolarHBondContact O-N 3.31Å; L1240-F1279 HydrophobicContact CD2-CB 4.02Å; L1240-F1279 HydrophobicContact CD2-CD1 4.4Å; L1240-V1281 HydrophobicContact CB-CG2 4.26Å; L1240-V1281 HydrophobicContact CD1-CG2 4.19Å
1241	P	93.2	Very high	90.8	Very high	60 Å²	60	48.8 Å²	48.8	39%	0.39	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	118.5	174	29.8	-33.3	0	0	0	110.9	F1279 S1280 V1281	P1241-F1279 VanDerWaalsContact CD-O 3.25Å; P1241-F1279 WeakPolarHBondContact CD-O 3.4Å; P1241-F1279 VanDerWaalsContact CG-O 3.3Å; P1241-F1279 WeakPolarHBondContact CG-O 3.17Å; P1241-S1280 WeakPolarHBondContact O-CA 3.31Å; P1241-V1281 PolarHBondContact O-N 2.95Å
1242	G	93.4	Very high	90.5	Very high	5 Å²	5	58.8 Å²	58.8	5%	0.052	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	156.2	175.2	0	0	0	0	0	113	V1234 L1240 V1281	V1234-G1242 PolarHBondContact N-O 2.96Å; V1234-G1242 PolarHBondContact O-N 2.81Å; L1240-G1242 PolarHBondContact O-N 3.31Å; G1242-V1281 CarbonylContact C-O 3.59Å; G1242-V1281 VanDerWaalsContact CA-O 3.25Å; G1242-V1281 WeakPolarHBondContact CA-O 3.01Å
1243	F	95.3	Very high	89.9	Confident	61 Å²	61	67.3 Å²	67.3	27%	0.268	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	127.1	174.7	-174	-105.7	0	0	0	112.1	T1177 R1233 H1245 V1281 E1282 C1283	T1177-F1243 HydrophobicContact CG2-CE2 4.05Å; T1177-F1243 WeakPolarHBondContact OG1-CE2 3.44Å; R1233-F1243 HydrophobicContact CG-CD2 4.16Å; F1243-H1245 HydrophobicContact CE1-CB 4.06Å; F1243-V1281 PolarHBondContact N-O 2.79Å; F1243-E1282 WeakPolarHBondContact O-CA 3.13Å; F1243-C1283 PolarHBondContact O-N 2.78Å
1244	I	94.9	Very high	89.2	Confident	0 Å²	0	62.4 Å²	62.4	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	105.5	172.8	-53.3	172.3	0	0	0	107.7	G1231 V1232 V1234 N1248 L1249 I1267 V1269 C1283	G1231-I1244 CarbonylContact C-O 3.58Å; G1231-I1244 WeakPolarHBondContact CA-O 3.3Å; V1232-I1244 HydrophobicContact CB-CB 4.37Å; V1232-I1244 PolarHBondContact N-O 3.33Å; V1232-I1244 PolarHBondContact O-N 2.95Å; V1234-I1244 HydrophobicContact CG1-CD1 3.76Å; V1234-I1244 HydrophobicContact CG1-CG1 4.22Å; I1244-N1248 HydrophobicContact CG2-CB 4.12Å; I1244-L1249 HydrophobicContact CG2-CB 4.36Å; I1244-L1249 HydrophobicContact CG2-CD1 4.35Å; I1244-I1267 HydrophobicContact CD1-CD1 3.62Å; I1244-V1269 HydrophobicContact CD1-CG1 3.75Å; I1244-C1283 HydrophobicContact CG1-CB 4.21Å
1245	H	92.2	Very high	88.4	Confident	69 Å²	69	68.8 Å²	68.8	32%	0.319	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.2	142.8	172	-175.2	-90.5	0	0	0	110.3	F1243 K1247 N1248	F1243-H1245 HydrophobicContact CE1-CB 4.06Å; H1245-K1247 PolarHBondContact ND1-N 3.45Å; H1245-K1247 PolarHBondContact O-N 2.91Å; H1245-N1248 WeakPolarHBondContact O-CA 3.38Å; H1245-N1248 WeakPolarHBondContact O-CB 3.29Å; H1245-N1248 PolarHBondContact O-N 2.96Å
1246	I	89.5	Confident	87.6	Confident	33 Å²	33	64.6 Å²	64.6	17%	0.169	31%	0.313	C	S	.	.	G	3₁₀ helix	trans	-54.7	-35.3	-171.1	-172.5	167.2	0	0	0	114	P1229 S1230 N1248 L1249	P1229-I1246 HydrophobicContact CB-CD1 4.03Å; P1229-I1246 HydrophobicContact CG-CD1 3.89Å; P1229-I1246 WeakPolarHBondContact O-CD1 3.34Å; S1230-I1246 PolarHBondContact O-N 3.43Å; I1246-N1248 PolarHBondContact O-N 3.34Å; I1246-N1248 VanDerWaalsContact O-N 3.15Å; I1246-L1249 WeakPolarHBondContact O-CB 3.2Å; I1246-L1249 PolarHBondContact O-N 3.16Å
1247	K	89.9	Confident	87.3	Confident	153 Å²	153	64.3 Å²	64.3	67%	0.665	31%	0.312	S	S	*	.	G	3₁₀ helix	trans	-60.9	-18.4	174	-64.3	175.8	-178.2	177	0	114.5	H1245 R1286	H1245-K1247 PolarHBondContact ND1-N 3.45Å; H1245-K1247 PolarHBondContact O-N 2.91Å; K1247-R1286 VanDerWaalsContact O-CZ 3.3Å; K1247-R1286 PolarHBondContact O-NE 3.21Å; K1247-R1286 PolarHBondContact O-NH2 3.21Å
1248	N	91.4	Very high	87.2	Confident	33 Å²	33	62.2 Å²	62.2	18%	0.176	30%	0.302	C	S	.	.	G	3₁₀ helix	trans	-107.1	6.1	-175	-61.9	10.1	0	0	0	111.9	I1244 H1245 I1246 S1284 S1285 R1286	I1244-N1248 HydrophobicContact CG2-CB 4.12Å; H1245-N1248 WeakPolarHBondContact O-CA 3.38Å; H1245-N1248 WeakPolarHBondContact O-CB 3.29Å; H1245-N1248 PolarHBondContact O-N 2.96Å; I1246-N1248 PolarHBondContact O-N 3.34Å; I1246-N1248 VanDerWaalsContact O-N 3.15Å; N1248-S1284 PolarHBondContact O-OG 2.94Å; N1248-S1284 VanDerWaalsContact O-OG 3.08Å; N1248-S1285 PolarHBondContact O-N 3.07Å; N1248-R1286 PolarHBondContact O-N 3.27Å; N1248-R1286 PolarHBondContact OD1-NH2 3.43Å
1249	L	90.5	Very high	87.2	Confident	0 Å²	0	66.8 Å²	66.8	0%	0	32%	0.322	C	S	.	.	S	Bend	trans	-82.2	-26.6	-178.8	-173.2	61.2	0	0	0	113.2	V1232 I1244 I1246 V1254 P1257 R1260 V1261	V1232-L1249 HydrophobicContact CG2-CD1 3.97Å; V1232-L1249 HydrophobicContact CG2-CD2 3.9Å; I1244-L1249 HydrophobicContact CG2-CB 4.36Å; I1244-L1249 HydrophobicContact CG2-CD1 4.35Å; I1246-L1249 WeakPolarHBondContact O-CB 3.2Å; I1246-L1249 PolarHBondContact O-N 3.16Å; L1249-V1254 HydrophobicContact CD2-CG1 4.29Å; L1249-P1257 HydrophobicContact CD2-CB 3.64Å; L1249-R1260 HydrophobicContact CD2-CB 4.38Å; L1249-R1260 HydrophobicContact CG-CG 4.25Å; L1249-V1261 HydrophobicContact CD1-CG1 4.11Å; L1249-V1261 HydrophobicContact CD1-CG2 4.28Å
1250	S	88.5	Confident	87.3	Confident	22 Å²	22	69.4 Å²	69.4	15%	0.154	32%	0.319	C	S	.	.			trans	-162.7	161.5	176.1	-164.4	0	0	0	0	111.3
1251	D	84.7	Confident	87.4	Confident	87 Å²	87	69.1 Å²	69.1	47%	0.465	32%	0.317	S	S	.	.	S	Bend	trans	-69.5	-26.2	172.7	-49.2	-8.1	0	0	0	111.4	R1286 T1287 A1288	D1251-R1286 WeakPolarHBondContact OD1-CA 3.09Å; D1251-R1286 VanDerWaalsContact OD1-CB 3.23Å; D1251-R1286 WeakPolarHBondContact OD1-CB 3.34Å; D1251-T1287 PolarHBondContact OD1-N 2.98Å; D1251-T1287 WeakPolarHBondContact OD2-CB 3.46Å; D1251-A1288 PolarHBondContact OD1-N 3.25Å; D1251-A1288 PolarHBondContact OD2-N 2.86Å
1252	R	84.6	Confident	87.3	Confident	211 Å²	211	75.3 Å²	75.3	80%	0.796	33%	0.333	S	S	*	.	S	Bend	trans	-85.9	144.9	171.7	-64.9	-176.5	179.8	179.1	0.6	109.6	V1254	R1252-V1254 PolarHBondContact O-N 3.17Å
1253	Q	80.1	Confident	87.2	Confident	178 Å²	178	78.6 Å²	78.6	83%	0.832	35%	0.352	S	S	*	.			trans	-67.5	97.9	176.9	-174	-179.3	10	0	0	111.1
1254	V	81.4	Confident	87	Confident	23 Å²	23	80 Å²	80	14%	0.139	37%	0.369	C	S	.	.			trans	-76.2	130.6	171.8	179.7	0	0	0	0	109.5	L1249 R1252 N1256 R1260	L1249-V1254 HydrophobicContact CD2-CG1 4.29Å; R1252-V1254 PolarHBondContact O-N 3.17Å; V1254-N1256 WeakPolarHBondContact CG1-O 3.22Å; V1254-R1260 HydrophobicContact CG2-CB 4.33Å
1255	R	76.3	Confident	86.9	Confident	136 Å²	136	83.4 Å²	83.4	51%	0.513	39%	0.385	S	S	.	.	S	Bend	trans	-94.2	-49.3	173.1	-70.2	-170	-176.5	-172.3	2.7	112	P1229	P1229-R1255 WeakPolarHBondContact CG-O 3.16Å
1256	N	78.9	Confident	86.9	Confident	47 Å²	47	84.7 Å²	84.7	25%	0.251	39%	0.393	S	S	.	.	S	Bend	trans	-107.4	120.2	170.2	-179.3	1.4	0	0	0	110.2	V1254 E1258 E1259	V1254-N1256 WeakPolarHBondContact CG1-O 3.22Å; N1256-E1258 PolarHBondContact ND2-OE2 3.27Å; N1256-E1258 PolarHBondContact O-N 3.24Å; N1256-E1258 WeakPolarHBondContact OD1-CB 3.46Å; N1256-E1258 PolarHBondContact OD1-N 3.39Å; N1256-E1259 HydrophobicContact CB-CG 4.13Å; N1256-E1259 WeakPolarHBondContact CB-OE1 3.44Å; N1256-E1259 WeakPolarHBondContact O-CB 3.46Å; N1256-E1259 PolarHBondContact O-N 3.29Å
1257	P	84.7	Confident	87.1	Confident	0 Å²	0	83.6 Å²	83.6	0%	0	39%	0.387	C	S	.	.	G	3₁₀ helix	trans	-59.6	-25.6	178.7	25.7	-36.2	0	0	0	114.1	F1176 P1229 V1232 L1249 E1259 R1260 V1261	F1176-P1257 HydrophobicContact CD1-CB 3.78Å; F1176-P1257 HydrophobicContact CD1-CG 3.61Å; F1176-P1257 HydrophobicContact CE1-CB 3.89Å; F1176-P1257 HydrophobicContact CE1-CG 4.13Å; F1176-P1257 HydrophobicContact CG-CG 4.24Å; P1229-P1257 HydrophobicContact CB-CG 4.03Å; V1232-P1257 HydrophobicContact CG2-CB 3.85Å; L1249-P1257 HydrophobicContact CD2-CB 3.64Å; P1257-E1259 PolarHBondContact O-N 2.84Å; P1257-R1260 PolarHBondContact O-N 3.13Å; P1257-V1261 PolarHBondContact O-N 2.71Å
1258	E	85	Confident	87.2	Confident	94 Å²	94	82 Å²	82	44%	0.439	38%	0.381	S	S	.	.	G	3₁₀ helix	trans	-65.8	-21.1	179.2	-65.1	168.1	177.9	0	0	113.2	F1176 Y1178 N1256 R1260	F1176-E1258 HydrophobicContact CD2-CG 3.77Å; F1176-E1258 HydrophobicContact CE1-CG 4.26Å; F1176-E1258 HydrophobicContact CE2-CG 3.42Å; F1176-E1258 VanDerWaalsContact CE2-CG 3.42Å; F1176-E1258 HydrophobicContact CG-CG 4.35Å; F1176-E1258 HydrophobicContact CZ-CG 3.7Å; Y1178-E1258 PolarHBondContact OH-OE1 3.08Å; N1256-E1258 PolarHBondContact ND2-OE2 3.27Å; N1256-E1258 PolarHBondContact O-N 3.24Å; N1256-E1258 WeakPolarHBondContact OD1-CB 3.46Å; N1256-E1258 PolarHBondContact OD1-N 3.39Å; E1258-R1260 PolarHBondContact O-N 2.83Å
1259	E	83.4	Confident	87.3	Confident	142 Å²	142	80.4 Å²	80.4	66%	0.664	37%	0.373	S	S	*	.	G	3₁₀ helix	trans	-66.5	-26.8	171.9	-65.3	165.9	-154.2	0	0	112.3	N1256 P1257	N1256-E1259 HydrophobicContact CB-CG 4.13Å; N1256-E1259 WeakPolarHBondContact CB-OE1 3.44Å; N1256-E1259 WeakPolarHBondContact O-CB 3.46Å; N1256-E1259 PolarHBondContact O-N 3.29Å; P1257-E1259 PolarHBondContact O-N 2.84Å
1260	R	85.9	Confident	87.4	Confident	97 Å²	97	80.5 Å²	80.5	37%	0.366	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.6	-30.9	-169.4	179.3	56.1	-171.2	86.3	1.6	113.8	L1249 V1254 P1257 E1258	L1249-R1260 HydrophobicContact CD2-CB 4.38Å; L1249-R1260 HydrophobicContact CG-CG 4.25Å; V1254-R1260 HydrophobicContact CG2-CB 4.33Å; P1257-R1260 PolarHBondContact O-N 3.13Å; E1258-R1260 PolarHBondContact O-N 2.83Å
1261	V	90.7	Very high	87.6	Confident	1 Å²	1	79.5 Å²	79.5	1%	0.006	37%	0.366	C	S	.	.			trans	-142.5	151.1	177.2	-58.7	0	0	0	0	111.6	V1173 F1176 V1232 L1249 P1257 Q1265 I1267	V1173-V1261 HydrophobicContact CG1-CG2 4.46Å; V1173-V1261 HydrophobicContact CG2-CB 4.18Å; V1173-V1261 HydrophobicContact CG2-CG2 4.13Å; F1176-V1261 HydrophobicContact CE1-CG2 3.93Å; F1176-V1261 HydrophobicContact CZ-CG2 4.42Å; F1176-V1261 WeakPolarHBondContact CZ-O 3.44Å; V1232-V1261 HydrophobicContact CG1-CG2 4.22Å; V1232-V1261 HydrophobicContact CG2-CG2 4.22Å; L1249-V1261 HydrophobicContact CD1-CG1 4.11Å; L1249-V1261 HydrophobicContact CD1-CG2 4.28Å; P1257-V1261 PolarHBondContact O-N 2.71Å; V1261-Q1265 VanDerWaalsContact CA-OE1 3.32Å; V1261-I1267 HydrophobicContact CG1-CD1 4.4Å; V1261-I1267 HydrophobicContact CG1-CG2 3.97Å
1262	R	91.5	Very high	87.9	Confident	189 Å²	189	78 Å²	78	71%	0.713	36%	0.358	S	S	*	.			trans	-108.6	158.5	174.6	-64.3	179.4	-178.3	-101.2	-4	111.1	V1173 Q1265	V1173-R1262 VanDerWaalsContact CB-O 3.28Å; V1173-R1262 WeakPolarHBondContact CB-O 3.19Å; V1173-R1262 WeakPolarHBondContact CG1-O 3.28Å; R1262-Q1265 HydrophobicContact CB-CB 4.44Å; R1262-Q1265 WeakPolarHBondContact O-CB 3.44Å; R1262-Q1265 PolarHBondContact O-N 2.97Å
1263	V	91.9	Very high	88.3	Confident	75 Å²	75	71.7 Å²	71.7	46%	0.455	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	144.9	169.2	-171.5	0	0	0	0	109.6	F1176 Q1265	F1176-V1263 HydrophobicContact CD2-CG2 4.34Å; F1176-V1263 HydrophobicContact CE2-CG2 3.68Å; F1176-V1263 HydrophobicContact CZ-CG2 4.27Å; V1263-Q1265 PolarHBondContact O-N 2.98Å
1264	S	91.2	Very high	88.9	Confident	90 Å²	90	64.8 Å²	64.8	63%	0.629	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	63	9.9	-171.3	-50.4	0	0	0	0	115.4	V1173	V1173-S1264 PolarHBondContact O-N 3.43Å
1265	Q	92.3	Very high	89.4	Confident	71 Å²	71	65.2 Å²	65.2	33%	0.332	31%	0.306	S	S	.	.			trans	-78.6	130.2	170.7	-173.5	175.7	-1.2	0	0	110.6	V1173 V1261 R1262 V1263 I1267	V1173-Q1265 PolarHBondContact N-O 2.83Å; V1261-Q1265 VanDerWaalsContact CA-OE1 3.32Å; R1262-Q1265 HydrophobicContact CB-CB 4.44Å; R1262-Q1265 WeakPolarHBondContact O-CB 3.44Å; R1262-Q1265 PolarHBondContact O-N 2.97Å; V1263-Q1265 PolarHBondContact O-N 2.98Å; Q1265-I1267 HydrophobicContact CG-CG2 4.09Å
1266	M	93	Very high	90.1	Very high	97 Å²	97	61.1 Å²	61.1	48%	0.478	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	130.2	165.1	-67.1	-62.2	-80.4	0	0	110	T1170 M1172	T1170-M1266 HydrophobicContact CG2-CE 4.5Å; M1172-M1266 HydrophobicContact CB-SD 3.62Å; M1172-M1266 HydrophobicContact CG-SD 4.28Å
1267	I	93	Very high	90.5	Very high	10 Å²	10	65.3 Å²	65.3	5%	0.051	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	150.7	176.3	57.5	170.6	0	0	0	110.4	A1171 V1173 V1234 I1244 V1261 Q1265 V1269	A1171-I1267 PolarHBondContact N-O 3.33Å; A1171-I1267 WeakPolarHBondContact O-CG1 3.46Å; A1171-I1267 PolarHBondContact O-N 3.3Å; V1173-I1267 HydrophobicContact CG2-CD1 3.73Å; V1173-I1267 HydrophobicContact CG2-CG1 4.06Å; V1173-I1267 HydrophobicContact CG2-CG2 4.47Å; V1234-I1267 HydrophobicContact CG1-CD1 4.22Å; I1244-I1267 HydrophobicContact CD1-CD1 3.62Å; V1261-I1267 HydrophobicContact CG1-CD1 4.4Å; V1261-I1267 HydrophobicContact CG1-CG2 3.97Å; Q1265-I1267 HydrophobicContact CG-CG2 4.09Å; I1267-V1269 HydrophobicContact CD1-CG1 3.99Å; I1267-V1269 HydrophobicContact CG1-CG1 3.97Å
1268	H	92.9	Very high	90.7	Very high	118 Å²	118	73.7 Å²	73.7	55%	0.546	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	135.7	170.2	-68.1	71.3	0	0	0	109	S1285 L1290	H1268-S1285 PolarHBondContact O-OG 2.86Å; H1268-L1290 HydrophobicContact CB-CD1 4.37Å; H1268-L1290 HydrophobicContact CB-CD2 4.05Å
1269	V	93	Very high	91	Very high	0 Å²	0	69.5 Å²	69.5	0%	0	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	143.3	177.9	-52	0	0	0	0	110.4	V1169 A1171 L1236 I1244 I1267 C1283 S1284	V1169-V1269 HydrophobicContact CG2-CG2 3.76Å; V1169-V1269 PolarHBondContact N-O 3.13Å; V1169-V1269 PolarHBondContact O-N 2.83Å; A1171-V1269 HydrophobicContact CB-CG1 4.14Å; A1171-V1269 HydrophobicContact CB-CG2 3.88Å; L1236-V1269 HydrophobicContact CD2-CG2 4.42Å; I1244-V1269 HydrophobicContact CD1-CG1 3.75Å; I1267-V1269 HydrophobicContact CD1-CG1 3.99Å; I1267-V1269 HydrophobicContact CG1-CG1 3.97Å; V1269-C1283 HydrophobicContact CB-CB 3.88Å; V1269-C1283 HydrophobicContact CG2-CB 3.89Å; V1269-S1284 CarbonylContact C-O 3.41Å; V1269-S1284 WeakPolarHBondContact CA-O 3.12Å
1270	R	92	Very high	91.4	Very high	3 Å²	3	64.2 Å²	64.2	1%	0.011	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	134.2	166.9	-163.6	174.7	-67	-78.8	-0.5	109.7	E635 G1166 K1167 C1283 S1284 D1289 L1290	E635-R1270 IonicContact OE1-CZ 2.73Å; E635-R1270 IonicContact OE1-NH1 3.23Å; E635-R1270 PolarHBondContact OE1-NH1 3.36Å; E635-R1270 IonicContact OE1-NH2 3.46Å; E635-R1270 PolarHBondContact OE1-NH2 3.22Å; E635-R1270 IonicContact OE2-NH2 2.63Å; G1166-R1270 VanDerWaalsContact O-CD 3.3Å; G1166-R1270 WeakPolarHBondContact O-CD 3.38Å; G1166-R1270 WeakPolarHBondContact O-CG 3.49Å; G1166-R1270 PolarHBondContact O-NH1 2.83Å; K1167-R1270 WeakPolarHBondContact O-CA 3.43Å; R1270-C1283 CarbonylContact O-C 3.34Å; R1270-C1283 VanDerWaalsContact O-CA 3.28Å; R1270-C1283 WeakPolarHBondContact O-CA 3.35Å; R1270-S1284 PolarHBondContact N-O 2.79Å; R1270-S1284 PolarHBondContact O-N 2.77Å; R1270-D1289 WeakPolarHBondContact CD-O 3.06Å; R1270-D1289 PolarHBondContact NE-O 3.23Å; R1270-L1290 HydrophobicContact CB-CD2 4.45Å; R1270-L1290 PolarHBondContact NH2-O 3.03Å
1271	I	92.2	Very high	91.8	Very high	0 Å²	0	59.8 Å²	59.8	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	127.1	176.4	-62	174.5	0	0	0	109	F1163 V1165 G1166 K1167 V1169 I1274 V1281	F1163-I1271 HydrophobicContact CD2-CD1 4.17Å; F1163-I1271 HydrophobicContact CE1-CD1 4.13Å; F1163-I1271 HydrophobicContact CE2-CD1 3.55Å; F1163-I1271 HydrophobicContact CZ-CD1 3.51Å; V1165-I1271 HydrophobicContact CG2-CG2 4.48Å; G1166-I1271 VanDerWaalsContact CA-O 3.31Å; G1166-I1271 WeakPolarHBondContact CA-O 3.43Å; G1166-I1271 PolarHBondContact N-O 3.16Å; K1167-I1271 HydrophobicContact CB-CD1 4.46Å; K1167-I1271 PolarHBondContact O-N 2.94Å; V1169-I1271 HydrophobicContact CG1-CD1 4.42Å; V1169-I1271 HydrophobicContact CG2-CD1 4.1Å; V1169-I1271 HydrophobicContact CG2-CG1 3.92Å; I1271-I1274 HydrophobicContact CG2-CD1 4.41Å; I1271-I1274 HydrophobicContact CG2-CG1 3.82Å; I1271-V1281 HydrophobicContact CB-CG1 4.39Å; I1271-V1281 HydrophobicContact CD1-CG1 4.5Å; I1271-V1281 HydrophobicContact CG1-CG1 4.1Å; I1271-V1281 HydrophobicContact CG2-CG1 3.68Å
1272	I	92.3	Very high	92	Very high	56 Å²	56	63.9 Å²	63.9	29%	0.287	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	-34.3	176.5	-70.4	178.4	0	0	0	111.6	V1165 E1282 W1297	V1165-I1272 WeakPolarHBondContact CG1-O 3.42Å; I1272-E1282 PolarHBondContact N-O 3.42Å; I1272-W1297 HydrophobicContact CG1-CZ2 4.23Å
1273	K	92.9	Very high	92.1	Very high	79 Å²	79	55 Å²	55	34%	0.343	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	138.6	177.4	165.9	176.9	162.9	-109.7	0	110	D1275 V1281 E1282	K1273-D1275 IonicContact NZ-OD2 2.86Å; K1273-D1275 PolarHBondContact NZ-OD2 3.13Å; K1273-V1281 WeakPolarHBondContact O-CG1 3.47Å; K1273-E1282 HydrophobicContact CB-CB 4.24Å; K1273-E1282 WeakPolarHBondContact CD-OE1 3.42Å; K1273-E1282 PolarHBondContact N-O 3.29Å; K1273-E1282 IonicContact NZ-OE1 2.67Å; K1273-E1282 PolarHBondContact NZ-OE1 2.69Å; K1273-E1282 PolarHBondContact O-N 3.42Å
1274	I	91.8	Very high	92.2	Very high	32 Å²	32	51.4 Å²	51.4	16%	0.164	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	134.6	167.9	-58.2	167.5	0	0	0	107	F1152 F1163 V1165 I1271 I1276 V1281	F1152-I1274 HydrophobicContact CE2-CG2 4.16Å; F1152-I1274 HydrophobicContact CZ-CG2 3.86Å; F1163-I1274 HydrophobicContact CD1-CD1 3.65Å; F1163-I1274 HydrophobicContact CD1-CG1 4.39Å; F1163-I1274 HydrophobicContact CE1-CD1 3.69Å; F1163-I1274 HydrophobicContact CE1-CG1 3.92Å; F1163-I1274 HydrophobicContact CE1-CG2 4.43Å; F1163-I1274 WeakPolarHBondContact O-CD1 3.44Å; V1165-I1274 HydrophobicContact CG2-CB 4.44Å; V1165-I1274 HydrophobicContact CG2-CD1 4.09Å; V1165-I1274 HydrophobicContact CG2-CG1 3.96Å; I1271-I1274 HydrophobicContact CG2-CD1 4.41Å; I1271-I1274 HydrophobicContact CG2-CG1 3.82Å; I1274-I1276 HydrophobicContact CG2-CG1 4.06Å; I1274-V1281 HydrophobicContact CG1-CG1 4.48Å
1275	D	92.4	Very high	92.3	Very high	33 Å²	33	47.2 Å²	47.2	18%	0.176	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	88.9	177.8	-159.8	-60.6	0	0	0	107.3	K1273 R1278 F1279 S1280	K1273-D1275 IonicContact NZ-OD2 2.86Å; K1273-D1275 PolarHBondContact NZ-OD2 3.13Å; D1275-R1278 HydrophobicContact CB-CB 4.43Å; D1275-R1278 PolarHBondContact O-N 3.08Å; D1275-R1278 WeakPolarHBondContact OD1-CB 3.43Å; D1275-R1278 WeakPolarHBondContact OD1-CD 3.17Å; D1275-R1278 WeakPolarHBondContact OD1-CG 3.48Å; D1275-R1278 IonicContact OD1-NE 2.72Å; D1275-F1279 PolarHBondContact O-N 2.9Å; D1275-S1280 WeakPolarHBondContact CB-O 2.85Å; D1275-S1280 PolarHBondContact N-O 3.49Å; D1275-S1280 PolarHBondContact O-N 3.48Å
1276	I	90.7	Very high	92.2	Very high	50 Å²	50	46.9 Å²	46.9	26%	0.256	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-53.8	-165.8	-57.5	-178.4	0	0	0	110.2	A1148 E1149 F1152 I1274 R1278 F1279	A1148-I1276 HydrophobicContact CB-CG2 4.44Å; A1148-I1276 VanDerWaalsContact O-CG2 3.29Å; A1148-I1276 WeakPolarHBondContact O-CG2 3.35Å; E1149-I1276 HydrophobicContact CG-CD1 4.08Å; F1152-I1276 HydrophobicContact CB-CG2 3.67Å; F1152-I1276 HydrophobicContact CD2-CG2 4.06Å; F1152-I1276 HydrophobicContact CG-CG2 4.02Å; I1274-I1276 HydrophobicContact CG2-CG1 4.06Å; I1276-R1278 PolarHBondContact O-N 3.42Å; I1276-F1279 WeakPolarHBondContact O-CD2 3.35Å; I1276-F1279 PolarHBondContact O-N 3.25Å
1277	D	88.4	Confident	92	Very high	135 Å²	135	45 Å²	45	72%	0.722	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53	-33	178.1	-61.3	-41.5	0	0	0	113.5
1278	R	88.9	Confident	91.8	Very high	175 Å²	175	46.1 Å²	46.1	66%	0.66	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.5	-13.5	-178.1	-66	-179.9	-174.5	-116.5	-9.7	113.5	R859 D1275 I1276 S1280	R859-R1278 PolarHBondContact NH2-O 2.81Å; D1275-R1278 HydrophobicContact CB-CB 4.43Å; D1275-R1278 PolarHBondContact O-N 3.08Å; D1275-R1278 WeakPolarHBondContact OD1-CB 3.43Å; D1275-R1278 WeakPolarHBondContact OD1-CD 3.17Å; D1275-R1278 WeakPolarHBondContact OD1-CG 3.48Å; D1275-R1278 IonicContact OD1-NE 2.72Å; I1276-R1278 PolarHBondContact O-N 3.42Å; R1278-S1280 WeakPolarHBondContact CB-OG 3.46Å
1279	F	91.1	Very high	91.5	Very high	7 Å²	7	41.3 Å²	41.3	3%	0.031	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	49.3	61.9	-166.7	-71.6	-113.9	0	0	0	109.5	R859 Q862 F1152 L1155 T1156 L1240 P1241 D1275 I1276	R859-F1279 VanDerWaalsContact NH1-CB 3.32Å; R859-F1279 PolarHBondContact NH1-O 3.41Å; R859-F1279 VanDerWaalsContact NH1-O 3.1Å; Q862-F1279 VanDerWaalsContact NE2-CZ 3.28Å; F1152-F1279 HydrophobicContact CB-CE1 4.19Å; F1152-F1279 HydrophobicContact CB-CZ 4.09Å; F1152-F1279 AromaticContact CD2-CD1 3.74Å; F1152-F1279 HydrophobicContact CD2-CD1 3.74Å; F1152-F1279 HydrophobicContact CD2-CD2 4.45Å; F1152-F1279 AromaticContact CD2-CE1 3.83Å; F1152-F1279 HydrophobicContact CD2-CE1 3.83Å; F1152-F1279 HydrophobicContact CD2-CE2 4.5Å; F1152-F1279 HydrophobicContact CD2-CG 4.06Å; F1152-F1279 HydrophobicContact CD2-CZ 4.21Å; F1152-F1279 HydrophobicContact CE2-CD1 4.18Å; F1152-F1279 HydrophobicContact CE2-CG 4.44Å; F1152-F1279 HydrophobicContact CG-CE1 4.26Å; L1155-F1279 HydrophobicContact CB-CE1 4Å; L1155-F1279 HydrophobicContact CD1-CE1 4.33Å; L1155-F1279 HydrophobicContact CD1-CZ 4.14Å; T1156-F1279 HydrophobicContact CG2-CD1 4.1Å; T1156-F1279 HydrophobicContact CG2-CE1 4.26Å; L1240-F1279 HydrophobicContact CD2-CB 4.02Å; L1240-F1279 HydrophobicContact CD2-CD1 4.4Å; P1241-F1279 VanDerWaalsContact CD-O 3.25Å; P1241-F1279 WeakPolarHBondContact CD-O 3.4Å; P1241-F1279 VanDerWaalsContact CG-O 3.3Å; P1241-F1279 WeakPolarHBondContact CG-O 3.17Å; D1275-F1279 PolarHBondContact O-N 2.9Å; I1276-F1279 WeakPolarHBondContact O-CD2 3.35Å; I1276-F1279 PolarHBondContact O-N 3.25Å
1280	S	92.3	Very high	91.2	Very high	31 Å²	31	43 Å²	43	22%	0.217	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	161	-178.2	66.8	0	0	0	0	112.4	P1241 D1275 R1278	P1241-S1280 WeakPolarHBondContact O-CA 3.31Å; D1275-S1280 WeakPolarHBondContact CB-O 2.85Å; D1275-S1280 PolarHBondContact N-O 3.49Å; D1275-S1280 PolarHBondContact O-N 3.48Å; R1278-S1280 WeakPolarHBondContact CB-OG 3.46Å
1281	V	93.6	Very high	90.8	Very high	4 Å²	4	49.3 Å²	49.3	2%	0.024	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	138.9	-166.6	-166.1	0	0	0	0	111.4	F1163 L1236 L1240 P1241 G1242 F1243 I1271 K1273 I1274	F1163-V1281 HydrophobicContact CE1-CG2 4.21Å; F1163-V1281 HydrophobicContact CZ-CG2 3.99Å; L1236-V1281 HydrophobicContact CD1-CB 3.93Å; L1236-V1281 HydrophobicContact CD1-CG1 4.31Å; L1236-V1281 HydrophobicContact CD1-CG2 3.61Å; L1240-V1281 HydrophobicContact CB-CG2 4.26Å; L1240-V1281 HydrophobicContact CD1-CG2 4.19Å; P1241-V1281 PolarHBondContact O-N 2.95Å; G1242-V1281 CarbonylContact C-O 3.59Å; G1242-V1281 VanDerWaalsContact CA-O 3.25Å; G1242-V1281 WeakPolarHBondContact CA-O 3.01Å; F1243-V1281 PolarHBondContact N-O 2.79Å; I1271-V1281 HydrophobicContact CB-CG1 4.39Å; I1271-V1281 HydrophobicContact CD1-CG1 4.5Å; I1271-V1281 HydrophobicContact CG1-CG1 4.1Å; I1271-V1281 HydrophobicContact CG2-CG1 3.68Å; K1273-V1281 WeakPolarHBondContact O-CG1 3.47Å; I1274-V1281 HydrophobicContact CG1-CG1 4.48Å
1282	E	94.7	Very high	90.3	Very high	87 Å²	87	49.4 Å²	49.4	41%	0.407	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	126.5	170.8	-63.8	178.1	-129.3	0	0	109.7	F1243 I1272 K1273	F1243-E1282 WeakPolarHBondContact O-CA 3.13Å; I1272-E1282 PolarHBondContact N-O 3.42Å; K1273-E1282 HydrophobicContact CB-CB 4.24Å; K1273-E1282 WeakPolarHBondContact CD-OE1 3.42Å; K1273-E1282 PolarHBondContact N-O 3.29Å; K1273-E1282 IonicContact NZ-OE1 2.67Å; K1273-E1282 PolarHBondContact NZ-OE1 2.69Å; K1273-E1282 PolarHBondContact O-N 3.42Å
1283	C	94	Very high	89.5	Confident	1 Å²	1	51.2 Å²	51.2	1%	0.007	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	167.8	-171.3	-45.7	0	0	0	0	112.9	F1243 I1244 V1269 R1270	F1243-C1283 PolarHBondContact O-N 2.78Å; I1244-C1283 HydrophobicContact CG1-CB 4.21Å; V1269-C1283 HydrophobicContact CB-CB 3.88Å; V1269-C1283 HydrophobicContact CG2-CB 3.89Å; R1270-C1283 CarbonylContact O-C 3.34Å; R1270-C1283 VanDerWaalsContact O-CA 3.28Å; R1270-C1283 WeakPolarHBondContact O-CA 3.35Å
1284	S	93.7	Very high	88.7	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	144.6	171.6	-177.9	0	0	0	0	112.3	N1248 V1269 R1270 R1286 D1289	N1248-S1284 PolarHBondContact O-OG 2.94Å; N1248-S1284 VanDerWaalsContact O-OG 3.08Å; V1269-S1284 CarbonylContact C-O 3.41Å; V1269-S1284 WeakPolarHBondContact CA-O 3.12Å; R1270-S1284 PolarHBondContact N-O 2.79Å; R1270-S1284 PolarHBondContact O-N 2.77Å; S1284-R1286 PolarHBondContact OG-N 3.47Å; S1284-D1289 WeakPolarHBondContact CB-OD2 3.46Å; S1284-D1289 PolarHBondContact OG-OD2 2.71Å
1285	S	93.3	Very high	87.8	Confident	2 Å²	2	57 Å²	57	1%	0.014	29%	0.289	C	S	.	.			trans	-118.5	17.3	172.2	-175.7	0	0	0	0	111.8	N1248 H1268	N1248-S1285 PolarHBondContact O-N 3.07Å; H1268-S1285 PolarHBondContact O-OG 2.86Å
1286	R	91	Very high	87	Confident	65 Å²	65	60.6 Å²	60.6	25%	0.245	31%	0.305	C	S	.	.			trans	-56.8	142.5	167.5	-72.7	-153.7	-161.6	103	1.6	110.8	K1247 N1248 D1251 S1284 A1288 D1289 L1290	K1247-R1286 VanDerWaalsContact O-CZ 3.3Å; K1247-R1286 PolarHBondContact O-NE 3.21Å; K1247-R1286 PolarHBondContact O-NH2 3.21Å; N1248-R1286 PolarHBondContact O-N 3.27Å; N1248-R1286 PolarHBondContact OD1-NH2 3.43Å; D1251-R1286 WeakPolarHBondContact OD1-CA 3.09Å; D1251-R1286 VanDerWaalsContact OD1-CB 3.23Å; D1251-R1286 WeakPolarHBondContact OD1-CB 3.34Å; S1284-R1286 PolarHBondContact OG-N 3.47Å; R1286-A1288 VanDerWaalsContact C-N 3.29Å; R1286-D1289 HydrophobicContact CB-CB 3.91Å; R1286-D1289 VanDerWaalsContact CB-CG 3.48Å; R1286-D1289 WeakPolarHBondContact CD-OD1 3.48Å; R1286-D1289 IonicContact CZ-OD2 3.42Å; R1286-D1289 IonicContact NH1-OD1 2.98Å; R1286-D1289 PolarHBondContact NH1-OD1 3.26Å; R1286-D1289 IonicContact NH1-OD2 2.66Å; R1286-D1289 PolarHBondContact NH1-OD2 3.42Å; R1286-D1289 PolarHBondContact O-N 3Å; R1286-L1290 WeakPolarHBondContact O-CB 3.34Å; R1286-L1290 WeakPolarHBondContact O-CG 3.41Å; R1286-L1290 PolarHBondContact O-N 2.83Å
1287	T	88.9	Confident	86.3	Confident	58 Å²	58	60.6 Å²	60.6	36%	0.356	30%	0.302	S	S	.	.	H	α-helix	trans	-74.3	-25.4	175.9	-49.2	0	0	0	0	111	D1251 K1291	D1251-T1287 PolarHBondContact OD1-N 2.98Å; D1251-T1287 WeakPolarHBondContact OD2-CB 3.46Å; T1287-K1291 HydrophobicContact CG2-CD 4.25Å; T1287-K1291 WeakPolarHBondContact O-CB 3.13Å; T1287-K1291 VanDerWaalsContact O-CG 3.3Å; T1287-K1291 WeakPolarHBondContact O-CG 3.06Å; T1287-K1291 PolarHBondContact O-N 3.05Å
1288	A	86.9	Confident	85.6	Confident	33 Å²	33	57 Å²	57	27%	0.273	28%	0.278	S	S	.	.	H	α-helix	trans	-64.8	-53.4	167.8	0	0	0	0	0	111.9	D1251 R1286 K1291 D1292 V1293	D1251-A1288 PolarHBondContact OD1-N 3.25Å; D1251-A1288 PolarHBondContact OD2-N 2.86Å; R1286-A1288 VanDerWaalsContact C-N 3.29Å; A1288-K1291 PolarHBondContact O-N 3.5Å; A1288-D1292 PolarHBondContact O-N 3.32Å; A1288-V1293 HydrophobicContact CB-CG2 4.44Å; A1288-V1293 PolarHBondContact O-N 3.12Å; A1288-V1293 VanDerWaalsContact O-N 3.16Å
1289	D	88.1	Confident	84.9	Confident	17 Å²	17	51.1 Å²	51.1	9%	0.091	26%	0.263	C	S	.	.	H	α-helix	trans	-68.3	-40.6	-177.1	-48.9	1.6	0	0	0	111.3	R1270 S1284 R1286 K1291 D1292 W1297	R1270-D1289 WeakPolarHBondContact CD-O 3.06Å; R1270-D1289 PolarHBondContact NE-O 3.23Å; S1284-D1289 WeakPolarHBondContact CB-OD2 3.46Å; S1284-D1289 PolarHBondContact OG-OD2 2.71Å; R1286-D1289 HydrophobicContact CB-CB 3.91Å; R1286-D1289 VanDerWaalsContact CB-CG 3.48Å; R1286-D1289 WeakPolarHBondContact CD-OD1 3.48Å; R1286-D1289 IonicContact CZ-OD2 3.42Å; R1286-D1289 IonicContact NH1-OD1 2.98Å; R1286-D1289 PolarHBondContact NH1-OD1 3.26Å; R1286-D1289 IonicContact NH1-OD2 2.66Å; R1286-D1289 PolarHBondContact NH1-OD2 3.42Å; R1286-D1289 PolarHBondContact O-N 3Å; D1289-K1291 VanDerWaalsContact C-N 3.32Å; D1289-K1291 PolarHBondContact O-N 2.97Å; D1289-D1292 PolarHBondContact O-N 2.89Å; D1289-W1297 HydrophobicContact CB-CH2 4.07Å; D1289-W1297 HydrophobicContact CB-CZ3 4.03Å
1290	L	86.3	Confident	84.4	Confident	36 Å²	36	58 Å²	58	19%	0.188	29%	0.288	C	S	.	.	H	α-helix	trans	-62.9	-34.8	176	-75.4	171.5	0	0	0	112.9	H1268 R1270 R1286 D1292	H1268-L1290 HydrophobicContact CB-CD1 4.37Å; H1268-L1290 HydrophobicContact CB-CD2 4.05Å; R1270-L1290 HydrophobicContact CB-CD2 4.45Å; R1270-L1290 PolarHBondContact NH2-O 3.03Å; R1286-L1290 WeakPolarHBondContact O-CB 3.34Å; R1286-L1290 WeakPolarHBondContact O-CG 3.41Å; R1286-L1290 PolarHBondContact O-N 2.83Å; L1290-D1292 VanDerWaalsContact C-N 3.3Å
1291	K	82.5	Confident	84.1	Confident	134 Å²	134	59.4 Å²	59.4	58%	0.583	29%	0.289	S	S	*	.	H	α-helix	trans	-80.1	-14.4	173.4	-72.2	179.6	177.5	-173.8	0	113.3	T1287 A1288 D1289 V1293 R1298	T1287-K1291 HydrophobicContact CG2-CD 4.25Å; T1287-K1291 WeakPolarHBondContact O-CB 3.13Å; T1287-K1291 VanDerWaalsContact O-CG 3.3Å; T1287-K1291 WeakPolarHBondContact O-CG 3.06Å; T1287-K1291 PolarHBondContact O-N 3.05Å; A1288-K1291 PolarHBondContact O-N 3.5Å; D1289-K1291 VanDerWaalsContact C-N 3.32Å; D1289-K1291 PolarHBondContact O-N 2.97Å; K1291-V1293 HydrophobicContact CB-CG2 3.98Å; K1291-R1298 PolarHBondContact O-NE 3.29Å; K1291-R1298 PolarHBondContact O-NH2 3.08Å
1292	D	81.7	Confident	83.8	Confident	2 Å²	2	60.6 Å²	60.6	1%	0.011	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	49.3	60.9	-165	-169.3	11.8	0	0	0	112.4	A1288 D1289 L1290 N1294 N1295 E1296 W1297 R1298	A1288-D1292 PolarHBondContact O-N 3.32Å; D1289-D1292 PolarHBondContact O-N 2.89Å; L1290-D1292 VanDerWaalsContact C-N 3.3Å; D1292-N1294 PolarHBondContact O-N 2.97Å; D1292-N1294 VanDerWaalsContact O-N 3.15Å; D1292-N1295 PolarHBondContact O-N 3.42Å; D1292-N1295 WeakPolarHBondContact OD1-CA 3.48Å; D1292-N1295 PolarHBondContact OD1-N 3.45Å; D1292-N1295 WeakPolarHBondContact OD2-CA 3.48Å; D1292-E1296 PolarHBondContact OD1-N 2.84Å; D1292-E1296 PolarHBondContact OD2-N 3.36Å; D1292-E1296 VanDerWaalsContact OD2-N 3.13Å; D1292-W1297 HydrophobicContact CB-CE3 4.09Å; D1292-W1297 WeakPolarHBondContact OD2-CA 3.18Å; D1292-W1297 PolarHBondContact OD2-N 2.88Å; D1292-R1298 HydrophobicContact CB-CG 4.06Å; D1292-R1298 WeakPolarHBondContact OD2-CG 3.37Å; D1292-R1298 PolarHBondContact OD2-N 2.99Å
1293	V	76.7	Confident	83.5	Confident	95 Å²	95	63.8 Å²	63.8	58%	0.576	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-20.8	-179.7	176.1	0	0	0	0	112.7	A1288 K1291	A1288-V1293 HydrophobicContact CB-CG2 4.44Å; A1288-V1293 PolarHBondContact O-N 3.12Å; A1288-V1293 VanDerWaalsContact O-N 3.16Å; K1291-V1293 HydrophobicContact CB-CG2 3.98Å
1294	N	76	Confident	83.4	Confident	113 Å²	113	67.7 Å²	67.7	60%	0.604	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.7	-9	-178.8	-65.4	-4.7	0	0	0	113.5	D1292 E1296	D1292-N1294 PolarHBondContact O-N 2.97Å; D1292-N1294 VanDerWaalsContact O-N 3.15Å; N1294-E1296 VanDerWaalsContact C-N 3.33Å; N1294-E1296 HydrophobicContact CB-CG 3.8Å; N1294-E1296 VanDerWaalsContact CB-OE1 3.28Å; N1294-E1296 WeakPolarHBondContact CB-OE1 3.49Å; N1294-E1296 PolarHBondContact ND2-OE1 3.36Å
1295	N	72.6	Confident	83.2	Confident	119 Å²	119	68.3 Å²	68.3	64%	0.636	33%	0.333	S	S	*	.			trans	53.5	45.6	-167.8	-60.8	-56.4	0	0	0	112.9	D1292	D1292-N1295 PolarHBondContact O-N 3.42Å; D1292-N1295 WeakPolarHBondContact OD1-CA 3.48Å; D1292-N1295 PolarHBondContact OD1-N 3.45Å; D1292-N1295 WeakPolarHBondContact OD2-CA 3.48Å
1296	E	76.1	Confident	83.2	Confident	108 Å²	108	69.9 Å²	69.9	51%	0.505	34%	0.341	S	S	.	.	S	Bend	trans	-83.8	-27.2	177.8	-78	178.6	-131.6	0	0	113.4	D1292 N1294	D1292-E1296 PolarHBondContact OD1-N 2.84Å; D1292-E1296 PolarHBondContact OD2-N 3.36Å; D1292-E1296 VanDerWaalsContact OD2-N 3.13Å; N1294-E1296 VanDerWaalsContact C-N 3.33Å; N1294-E1296 HydrophobicContact CB-CG 3.8Å; N1294-E1296 VanDerWaalsContact CB-OE1 3.28Å; N1294-E1296 WeakPolarHBondContact CB-OE1 3.49Å; N1294-E1296 PolarHBondContact ND2-OE1 3.36Å
1297	W	75.6	Confident	83.1	Confident	50 Å²	50	73 Å²	73	19%	0.189	35%	0.353	C	S	.	.	S	Bend	trans	-125.7	-26.4	-169	-59.9	-68.8	0	0	0	115	I1272 D1289 D1292	I1272-W1297 HydrophobicContact CG1-CZ2 4.23Å; D1289-W1297 HydrophobicContact CB-CH2 4.07Å; D1289-W1297 HydrophobicContact CB-CZ3 4.03Å; D1292-W1297 HydrophobicContact CB-CE3 4.09Å; D1292-W1297 WeakPolarHBondContact OD2-CA 3.18Å; D1292-W1297 PolarHBondContact OD2-N 2.88Å
1298	R	73.8	Confident	83.2	Confident	60 Å²	60	74.7 Å²	74.7	23%	0.226	36%	0.364	C	S	.	.	S	Bend	trans	-54.2	139	179.5	-77.7	-179.9	-177.6	-59.4	-25.3	111.5	E635 Y640 K1291 D1292 R1300	E635-R1298 IonicContact OE2-CZ 3.45Å; E635-R1298 IonicContact OE2-NH1 2.67Å; E635-R1298 PolarHBondContact OE2-NH1 2.97Å; E635-R1298 IonicContact OE2-NH2 2.79Å; E635-R1298 PolarHBondContact OE2-NH2 3.01Å; Y640-R1298 PolarHBondContact OH-NH1 2.93Å; Y640-R1298 VanDerWaalsContact OH-NH1 3.08Å; K1291-R1298 PolarHBondContact O-NE 3.29Å; K1291-R1298 PolarHBondContact O-NH2 3.08Å; D1292-R1298 HydrophobicContact CB-CG 4.06Å; D1292-R1298 WeakPolarHBondContact OD2-CG 3.37Å; D1292-R1298 PolarHBondContact OD2-N 2.99Å; R1298-R1300 PolarHBondContact O-N 3.29Å
1299	P	73.7	Confident	83.3	Confident	51 Å²	51	73.7 Å²	73.7	33%	0.331	35%	0.354	S	S	.	.	P	Polyproline II helix	trans	-50.5	135.4	169.9	-27.2	34.8	0	0	0	110.8	Y640 R1301	Y640-P1299 HydrophobicContact CD1-CB 4.45Å; Y640-P1299 HydrophobicContact CD1-CG 4.42Å; P1299-R1301 PolarHBondContact O-N 3.41Å
1300	R	81.1	Confident	83.4	Confident	152 Å²	152	74.6 Å²	74.6	57%	0.574	36%	0.358	S	S	*	.	P	Polyproline II helix	trans	-63.5	124.2	177.6	-73.7	-179.8	168.1	-113.5	-12.9	108.9	S641 R1298	S641-R1300 WeakPolarHBondContact CB-O 3.38Å; R1298-R1300 PolarHBondContact O-N 3.29Å
1301	R	85.3	Confident	83.5	Confident	61 Å²	61	78.9 Å²	78.9	23%	0.23	38%	0.377	C	S	.	.	P	Polyproline II helix	trans	-58.1	148.5	168.7	-70.6	175.7	172.3	-156.7	-11.6	109.9	P1299 Y1305 E1310	P1299-R1301 PolarHBondContact O-N 3.41Å; R1301-Y1305 HydrophobicContact CB-CD2 3.69Å; R1301-Y1305 HydrophobicContact CB-CE2 4.23Å; R1301-Y1305 HydrophobicContact CB-CG 3.89Å; R1301-Y1305 HydrophobicContact CG-CD2 3.79Å; R1301-Y1305 HydrophobicContact CG-CE2 3.8Å; R1301-Y1305 HydrophobicContact CG-CG 4.13Å; R1301-Y1305 PolarHBondContact NH2-OH 3.44Å; R1301-E1310 IonicContact CZ-OE1 2.99Å; R1301-E1310 IonicContact CZ-OE2 3.32Å; R1301-E1310 VanDerWaalsContact CZ-OE2 3.29Å; R1301-E1310 IonicContact NH1-OE1 2.88Å; R1301-E1310 IonicContact NH1-OE2 2.64Å; R1301-E1310 PolarHBondContact NH1-OE2 3.27Å; R1301-E1310 VanDerWaalsContact NH2-CD 3.29Å; R1301-E1310 IonicContact NH2-OE1 3.18Å; R1301-E1310 PolarHBondContact NH2-OE1 2.67Å; R1301-E1310 IonicContact NH2-OE2 3.14Å; R1301-E1310 PolarHBondContact NH2-OE2 3.39Å; R1301-E1310 VanDerWaalsContact NH2-OE2 3.07Å
1302	D	88.2	Confident	83.9	Confident	28 Å²	28	76.3 Å²	76.3	15%	0.15	37%	0.367	C	S	.	.	P	Polyproline II helix	trans	-56.1	153.4	175.6	-169	-71.9	0	0	0	111	S641 M642 V645 K648 Y1304 Y1305	S641-D1302 WeakPolarHBondContact O-CB 3.5Å; S641-D1302 PolarHBondContact O-N 3.28Å; M642-D1302 HydrophobicContact CG-CB 4.41Å; V645-D1302 HydrophobicContact CG2-CB 4.03Å; K648-D1302 IonicContact NZ-OD2 3.2Å; K648-D1302 PolarHBondContact NZ-OD2 2.79Å; D1302-Y1304 PolarHBondContact O-N 2.84Å; D1302-Y1304 WeakPolarHBondContact OD1-CD2 3.4Å; D1302-Y1304 PolarHBondContact OD1-N 3.3Å; D1302-Y1305 WeakPolarHBondContact O-CB 3.49Å; D1302-Y1305 PolarHBondContact O-N 2.97Å
1303	N	88.5	Confident	84.2	Confident	154 Å²	154	77.6 Å²	77.6	82%	0.824	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-25.9	178.3	-65.1	-37.1	0	0	0	112.4
1304	Y	91	Very high	84.6	Confident	84 Å²	84	77.2 Å²	77.2	33%	0.329	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.9	23.1	-177.8	-60.6	-82.5	0	0	0	113.3	V645 A646 K648 P649 D652 D1302	V645-Y1304 WeakPolarHBondContact CA-O 3.49Å; A646-Y1304 PolarHBondContact N-O 3.08Å; K648-Y1304 HydrophobicContact CB-CD2 3.86Å; K648-Y1304 HydrophobicContact CB-CG 3.83Å; K648-Y1304 HydrophobicContact CD-CD2 4.18Å; K648-Y1304 HydrophobicContact CG-CD2 3.72Å; K648-Y1304 HydrophobicContact CG-CE2 4.28Å; K648-Y1304 HydrophobicContact CG-CG 4.23Å; P649-Y1304 HydrophobicContact CG-CE1 4.37Å; D652-Y1304 HydrophobicContact CB-CE2 4.28Å; D652-Y1304 VanDerWaalsContact OD2-CE2 3.3Å; D652-Y1304 WeakPolarHBondContact OD2-CE2 3.43Å; D652-Y1304 PolarHBondContact OD2-OH 3.04Å; D1302-Y1304 PolarHBondContact O-N 2.84Å; D1302-Y1304 WeakPolarHBondContact OD1-CD2 3.4Å; D1302-Y1304 PolarHBondContact OD1-N 3.3Å
1305	Y	90.8	Very high	85.2	Confident	13 Å²	13	77.5 Å²	77.5	5%	0.051	36%	0.361	C	S	.	.	B	Isolated β-bridge	trans	-70.4	129	-175.8	-160.7	-82.5	0	0	0	113.3	S641 K643 Y644 R1301 D1302 Y1307 E1310	S641-Y1305 VanDerWaalsContact O-CD2 3.27Å; S641-Y1305 WeakPolarHBondContact O-CD2 3.47Å; K643-Y1305 HydrophobicContact CB-CE2 4.5Å; Y644-Y1305 HydrophobicContact CD2-CE1 4.3Å; Y644-Y1305 CarbonylContact O-C 3.39Å; Y644-Y1305 WeakPolarHBondContact O-CA 3.47Å; Y644-Y1305 VanDerWaalsContact O-CD2 3.3Å; Y644-Y1305 WeakPolarHBondContact O-CD2 3.42Å; Y644-Y1305 VanDerWaalsContact O-CG 3.27Å; R1301-Y1305 HydrophobicContact CB-CD2 3.69Å; R1301-Y1305 HydrophobicContact CB-CE2 4.23Å; R1301-Y1305 HydrophobicContact CB-CG 3.89Å; R1301-Y1305 HydrophobicContact CG-CD2 3.79Å; R1301-Y1305 HydrophobicContact CG-CE2 3.8Å; R1301-Y1305 HydrophobicContact CG-CG 4.13Å; R1301-Y1305 PolarHBondContact NH2-OH 3.44Å; D1302-Y1305 WeakPolarHBondContact O-CB 3.49Å; D1302-Y1305 PolarHBondContact O-N 2.97Å; Y1305-Y1307 HydrophobicContact CD1-CD1 4.26Å; Y1305-Y1307 HydrophobicContact CD1-CD2 4.15Å; Y1305-Y1307 HydrophobicContact CD1-CE1 4.22Å; Y1305-Y1307 HydrophobicContact CD1-CE2 4.08Å; Y1305-Y1307 HydrophobicContact CD1-CG 4.22Å; Y1305-Y1307 HydrophobicContact CG-CE2 4.41Å; Y1305-Y1307 WeakPolarHBondContact O-CD2 3.17Å; Y1305-Y1307 WeakPolarHBondContact O-CE2 3.43Å; Y1305-Y1307 PolarHBondContact O-N 2.99Å; Y1305-E1310 PolarHBondContact OH-OE1 2.96Å
1306	D	91.5	Very high	85.9	Confident	34 Å²	34	77.9 Å²	77.9	18%	0.182	36%	0.357	C	S	.	.			trans	-92.5	84.8	-179.3	-172.7	-1.7	0	0	0	112.7	Y644 A646 V1308 T1309 E1310	Y644-D1306 PolarHBondContact O-N 3.35Å; A646-D1306 HydrophobicContact CB-CB 3.89Å; D1306-V1308 PolarHBondContact O-N 2.92Å; D1306-V1308 WeakPolarHBondContact OD1-CA 3.37Å; D1306-V1308 WeakPolarHBondContact OD1-CB 3.3Å; D1306-V1308 PolarHBondContact OD1-N 3.45Å; D1306-T1309 PolarHBondContact OD1-N 3.18Å; D1306-T1309 WeakPolarHBondContact OD2-CB 3.27Å; D1306-T1309 PolarHBondContact OD2-OG1 3.27Å; D1306-E1310 PolarHBondContact O-N 2.85Å; D1306-E1310 VanDerWaalsContact O-N 3.14Å
1307	Y	90.1	Very high	86.3	Confident	131 Å²	131	75 Å²	75	51%	0.514	35%	0.347	S	S	.	.	H	α-helix	trans	-60.1	-23.2	171.9	-58.6	-94.5	0	0	0	113.5	Y1305 E1311	Y1305-Y1307 HydrophobicContact CD1-CD1 4.26Å; Y1305-Y1307 HydrophobicContact CD1-CD2 4.15Å; Y1305-Y1307 HydrophobicContact CD1-CE1 4.22Å; Y1305-Y1307 HydrophobicContact CD1-CE2 4.08Å; Y1305-Y1307 HydrophobicContact CD1-CG 4.22Å; Y1305-Y1307 HydrophobicContact CG-CE2 4.41Å; Y1305-Y1307 WeakPolarHBondContact O-CD2 3.17Å; Y1305-Y1307 WeakPolarHBondContact O-CE2 3.43Å; Y1305-Y1307 PolarHBondContact O-N 2.99Å; Y1307-E1311 PolarHBondContact O-N 2.88Å
1308	V	90.2	Very high	86.6	Confident	94 Å²	94	76.1 Å²	76.1	57%	0.57	36%	0.362	S	S	*	.	H	α-helix	trans	-84.7	-39.3	-174	178.5	0	0	0	0	111.2	D1306 Q1312	D1306-V1308 PolarHBondContact O-N 2.92Å; D1306-V1308 WeakPolarHBondContact OD1-CA 3.37Å; D1306-V1308 WeakPolarHBondContact OD1-CB 3.3Å; D1306-V1308 PolarHBondContact OD1-N 3.45Å; V1308-Q1312 VanDerWaalsContact O-CG 3.28Å; V1308-Q1312 WeakPolarHBondContact O-CG 3.2Å; V1308-Q1312 PolarHBondContact O-N 3.3Å; V1308-Q1312 PolarHBondContact O-NE2 3.23Å
1309	T	89.9	Confident	87.1	Confident	11 Å²	11	77 Å²	77	7%	0.067	37%	0.372	C	S	.	.	H	α-helix	trans	-64.9	-44.7	166.5	-66	0	0	0	0	110	R624 Y644 D1306 E1311 Q1312 D1313	R624-T1309 PolarHBondContact NH2-OG1 3.26Å; Y644-T1309 HydrophobicContact CD1-CG2 3.84Å; Y644-T1309 HydrophobicContact CE1-CG2 3.94Å; D1306-T1309 PolarHBondContact OD1-N 3.18Å; D1306-T1309 WeakPolarHBondContact OD2-CB 3.27Å; D1306-T1309 PolarHBondContact OD2-OG1 3.27Å; T1309-E1311 PolarHBondContact O-N 2.94Å; T1309-Q1312 WeakPolarHBondContact O-CB 3.42Å; T1309-Q1312 PolarHBondContact O-N 3.35Å; T1309-Q1312 VanDerWaalsContact O-N 3.11Å; T1309-D1313 VanDerWaalsContact CG2-OD2 3.26Å; T1309-D1313 WeakPolarHBondContact CG2-OD2 3.28Å; T1309-D1313 PolarHBondContact O-N 3.29Å
1310	E	90.7	Very high	87.5	Confident	36 Å²	36	77.2 Å²	77.2	17%	0.168	38%	0.377	C	S	.	.	H	α-helix	trans	-56.3	-46	177.9	178.9	-178	-138	0	0	112.6	Y644 R1301 Y1305 D1306 Q1312 N1314	Y644-E1310 HydrophobicContact CD1-CB 4.32Å; Y644-E1310 HydrophobicContact CD2-CB 3.74Å; Y644-E1310 HydrophobicContact CD2-CG 3.97Å; Y644-E1310 HydrophobicContact CE1-CB 4.32Å; Y644-E1310 HydrophobicContact CE2-CB 3.74Å; Y644-E1310 HydrophobicContact CE2-CG 3.63Å; Y644-E1310 HydrophobicContact CG-CB 4.03Å; R1301-E1310 IonicContact CZ-OE1 2.99Å; R1301-E1310 IonicContact CZ-OE2 3.32Å; R1301-E1310 VanDerWaalsContact CZ-OE2 3.29Å; R1301-E1310 IonicContact NH1-OE1 2.88Å; R1301-E1310 IonicContact NH1-OE2 2.64Å; R1301-E1310 PolarHBondContact NH1-OE2 3.27Å; R1301-E1310 VanDerWaalsContact NH2-CD 3.29Å; R1301-E1310 IonicContact NH2-OE1 3.18Å; R1301-E1310 PolarHBondContact NH2-OE1 2.67Å; R1301-E1310 IonicContact NH2-OE2 3.14Å; R1301-E1310 PolarHBondContact NH2-OE2 3.39Å; R1301-E1310 VanDerWaalsContact NH2-OE2 3.07Å; Y1305-E1310 PolarHBondContact OH-OE1 2.96Å; D1306-E1310 PolarHBondContact O-N 2.85Å; D1306-E1310 VanDerWaalsContact O-N 3.14Å; E1310-Q1312 VanDerWaalsContact C-N 3.33Å; E1310-Q1312 PolarHBondContact O-N 3.2Å; E1310-N1314 WeakPolarHBondContact CG-ND2 3.41Å; E1310-N1314 VanDerWaalsContact O-CB 3.3Å; E1310-N1314 WeakPolarHBondContact O-CB 3.44Å; E1310-N1314 PolarHBondContact O-N 3.4Å; E1310-N1314 PolarHBondContact O-ND2 3.35Å
1311	E	88.1	Confident	87.4	Confident	126 Å²	126	77 Å²	77	59%	0.589	38%	0.38	S	S	*	.	H	α-helix	trans	-64.6	-39	178.2	-161.1	-153.4	129.3	0	0	111.6	Y1307 T1309 R1315	Y1307-E1311 PolarHBondContact O-N 2.88Å; T1309-E1311 PolarHBondContact O-N 2.94Å; E1311-R1315 VanDerWaalsContact O-CB 3.25Å; E1311-R1315 WeakPolarHBondContact O-CB 3.25Å; E1311-R1315 PolarHBondContact O-N 2.89Å; E1311-R1315 IonicContact OE1-NH1 3.65Å; E1311-R1315 PolarHBondContact OE1-NH1 3.17Å
1312	Q	89.4	Confident	87	Confident	81 Å²	81	76 Å²	76	38%	0.379	39%	0.386	S	S	.	.	H	α-helix	trans	-64.3	-46.7	178	-75.8	178.7	66.3	0	0	112.2	V1308 T1309 E1310 R1315 K1316	V1308-Q1312 VanDerWaalsContact O-CG 3.28Å; V1308-Q1312 WeakPolarHBondContact O-CG 3.2Å; V1308-Q1312 PolarHBondContact O-N 3.3Å; V1308-Q1312 PolarHBondContact O-NE2 3.23Å; T1309-Q1312 WeakPolarHBondContact O-CB 3.42Å; T1309-Q1312 PolarHBondContact O-N 3.35Å; T1309-Q1312 VanDerWaalsContact O-N 3.11Å; E1310-Q1312 VanDerWaalsContact C-N 3.33Å; E1310-Q1312 PolarHBondContact O-N 3.2Å; Q1312-R1315 WeakPolarHBondContact O-CB 3.48Å; Q1312-R1315 PolarHBondContact O-N 2.98Å; Q1312-K1316 WeakPolarHBondContact O-CG 3.36Å; Q1312-K1316 PolarHBondContact O-N 2.99Å
1313	D	88.5	Confident	86.5	Confident	28 Å²	28	83.4 Å²	83.4	15%	0.15	41%	0.411	C	S	.	.	H	α-helix	trans	-73.5	-37.9	-177.6	-69.7	-31.6	0	0	0	111.9	M630 Y644 T1309 R1315 K1316 V1317	M630-D1313 HydrophobicContact SD-CB 4.18Å; Y644-D1313 HydrophobicContact CE1-CB 4.49Å; T1309-D1313 VanDerWaalsContact CG2-OD2 3.26Å; T1309-D1313 WeakPolarHBondContact CG2-OD2 3.28Å; T1309-D1313 PolarHBondContact O-N 3.29Å; D1313-R1315 VanDerWaalsContact C-N 3.27Å; D1313-R1315 PolarHBondContact O-N 2.83Å; D1313-K1316 PolarHBondContact O-N 2.69Å; D1313-K1316 WeakPolarHBondContact OD1-CD 3.37Å; D1313-K1316 VanDerWaalsContact OD1-CE 3.29Å; D1313-K1316 WeakPolarHBondContact OD1-CE 3.35Å; D1313-K1316 IonicContact OD1-NZ 2.77Å; D1313-K1316 PolarHBondContact OD1-NZ 2.93Å; D1313-V1317 WeakPolarHBondContact O-CG2 3.16Å; D1313-V1317 PolarHBondContact O-N 3Å
1314	N	86.5	Confident	85.6	Confident	88 Å²	88	78.7 Å²	78.7	47%	0.471	39%	0.394	S	S	.	.	H	α-helix	trans	-59.4	-37.9	168.3	-80.3	-61.5	0	0	0	112.2	E1310 S1318	E1310-N1314 WeakPolarHBondContact CG-ND2 3.41Å; E1310-N1314 VanDerWaalsContact O-CB 3.3Å; E1310-N1314 WeakPolarHBondContact O-CB 3.44Å; E1310-N1314 PolarHBondContact O-N 3.4Å; E1310-N1314 PolarHBondContact O-ND2 3.35Å; N1314-S1318 WeakPolarHBondContact O-CB 3.27Å; N1314-S1318 PolarHBondContact O-N 3.36Å
1315	R	87.6	Confident	84.5	Confident	119 Å²	119	81.4 Å²	81.4	45%	0.449	41%	0.413	S	S	.	.	H	α-helix	trans	-67.2	-45	174.3	-174.7	168.3	63.8	-121.8	2.8	111.9	E1311 Q1312 D1313 V1317 S1318 D1319	E1311-R1315 VanDerWaalsContact O-CB 3.25Å; E1311-R1315 WeakPolarHBondContact O-CB 3.25Å; E1311-R1315 PolarHBondContact O-N 2.89Å; E1311-R1315 IonicContact OE1-NH1 3.65Å; E1311-R1315 PolarHBondContact OE1-NH1 3.17Å; Q1312-R1315 WeakPolarHBondContact O-CB 3.48Å; Q1312-R1315 PolarHBondContact O-N 2.98Å; D1313-R1315 VanDerWaalsContact C-N 3.27Å; D1313-R1315 PolarHBondContact O-N 2.83Å; R1315-V1317 VanDerWaalsContact C-N 3.33Å; R1315-V1317 PolarHBondContact O-N 2.94Å; R1315-S1318 PolarHBondContact O-N 2.73Å; R1315-D1319 WeakPolarHBondContact O-CB 3.5Å; R1315-D1319 PolarHBondContact O-N 3.13Å
1316	K	87.6	Confident	83.2	Confident	127 Å²	127	88.1 Å²	88.1	55%	0.552	44%	0.443	S	S	*	.	H	α-helix	trans	-55.3	-46.8	173.1	-68.6	171.7	-161.2	164.8	0	111.3	Q1312 D1313 D1319 A1320	Q1312-K1316 WeakPolarHBondContact O-CG 3.36Å; Q1312-K1316 PolarHBondContact O-N 2.99Å; D1313-K1316 PolarHBondContact O-N 2.69Å; D1313-K1316 WeakPolarHBondContact OD1-CD 3.37Å; D1313-K1316 VanDerWaalsContact OD1-CE 3.29Å; D1313-K1316 WeakPolarHBondContact OD1-CE 3.35Å; D1313-K1316 IonicContact OD1-NZ 2.77Å; D1313-K1316 PolarHBondContact OD1-NZ 2.93Å; K1316-D1319 PolarHBondContact O-N 3.05Å; K1316-A1320 VanDerWaalsContact O-CB 3.22Å; K1316-A1320 WeakPolarHBondContact O-CB 3.49Å; K1316-A1320 PolarHBondContact O-N 3.23Å
1317	V	83.9	Confident	81.7	Confident	47 Å²	47	96.8 Å²	96.8	29%	0.285	47%	0.473	S	S	.	.	H	α-helix	trans	-65.8	-39.5	178.5	171.1	0	0	0	0	111.9	M630 D1313 R1315 K1321	M630-V1317 HydrophobicContact CE-CG2 4.41Å; M630-V1317 HydrophobicContact SD-CG2 4.08Å; D1313-V1317 WeakPolarHBondContact O-CG2 3.16Å; D1313-V1317 PolarHBondContact O-N 3Å; R1315-V1317 VanDerWaalsContact C-N 3.33Å; R1315-V1317 PolarHBondContact O-N 2.94Å; V1317-K1321 HydrophobicContact CG1-CD 4.1Å; V1317-K1321 WeakPolarHBondContact O-CB 3.22Å; V1317-K1321 VanDerWaalsContact O-CG 3.31Å; V1317-K1321 WeakPolarHBondContact O-CG 3.27Å; V1317-K1321 PolarHBondContact O-N 2.76Å
1318	S	81.8	Confident	80	Confident	73 Å²	73	99.2 Å²	99.2	51%	0.51	49%	0.486	S	S	.	.	H	α-helix	trans	-64	-48.5	175	-171.9	0	0	0	0	111.8	N1314 R1315 A1320 K1321 A1322	N1314-S1318 WeakPolarHBondContact O-CB 3.27Å; N1314-S1318 PolarHBondContact O-N 3.36Å; R1315-S1318 PolarHBondContact O-N 2.73Å; S1318-A1320 PolarHBondContact O-N 3.38Å; S1318-K1321 PolarHBondContact O-N 3.17Å; S1318-A1322 WeakPolarHBondContact O-CB 3.42Å; S1318-A1322 PolarHBondContact O-N 3.31Å
1319	D	85.9	Confident	78.5	Confident	80 Å²	80	99.7 Å²	99.7	43%	0.428	48%	0.484	S	S	.	.	H	α-helix	trans	-65.4	-38.1	178	-76.3	-26.4	0	0	0	111.7	R1315 K1316 A1322 R1323	R1315-D1319 WeakPolarHBondContact O-CB 3.5Å; R1315-D1319 PolarHBondContact O-N 3.13Å; K1316-D1319 PolarHBondContact O-N 3.05Å; D1319-A1322 PolarHBondContact O-N 3.06Å; D1319-R1323 WeakPolarHBondContact O-CB 3.5Å; D1319-R1323 VanDerWaalsContact O-CG 3.23Å; D1319-R1323 WeakPolarHBondContact O-CG 3.3Å; D1319-R1323 PolarHBondContact O-N 2.89Å
1320	A	81.4	Confident	77.2	Confident	55 Å²	55	103.8 Å²	103.8	46%	0.455	50%	0.499	S	S	.	.	H	α-helix	trans	-62.8	-46.1	173.2	0	0	0	0	0	111.7	K1316 S1318 A1322 R1323 A1324	K1316-A1320 VanDerWaalsContact O-CB 3.22Å; K1316-A1320 WeakPolarHBondContact O-CB 3.49Å; K1316-A1320 PolarHBondContact O-N 3.23Å; S1318-A1320 PolarHBondContact O-N 3.38Å; A1320-A1322 VanDerWaalsContact C-N 3.32Å; A1320-A1322 PolarHBondContact O-N 2.78Å; A1320-R1323 PolarHBondContact O-N 3.17Å; A1320-A1324 WeakPolarHBondContact O-CB 3.17Å; A1320-A1324 PolarHBondContact O-N 3.08Å
1321	K	79.1	Confident	76	Confident	147 Å²	147	104.1 Å²	104.1	64%	0.639	51%	0.508	S	S	*	.	H	α-helix	trans	-60.9	-39.9	173.9	-74.9	171.6	-179.8	174.4	0	111.6	V1317 S1318 A1324 L1325	V1317-K1321 HydrophobicContact CG1-CD 4.1Å; V1317-K1321 WeakPolarHBondContact O-CB 3.22Å; V1317-K1321 VanDerWaalsContact O-CG 3.31Å; V1317-K1321 WeakPolarHBondContact O-CG 3.27Å; V1317-K1321 PolarHBondContact O-N 2.76Å; S1318-K1321 PolarHBondContact O-N 3.17Å; K1321-A1324 PolarHBondContact O-N 2.96Å; K1321-L1325 WeakPolarHBondContact O-CB 3.26Å; K1321-L1325 PolarHBondContact O-N 3.05Å
1322	A	77.6	Confident	75.4	Confident	41 Å²	41	107.9 Å²	107.9	34%	0.339	52%	0.517	S	S	.	.	H	α-helix	trans	-68.2	-35.9	175.4	0	0	0	0	0	113.2	S1318 D1319 A1320 K1326	S1318-A1322 WeakPolarHBondContact O-CB 3.42Å; S1318-A1322 PolarHBondContact O-N 3.31Å; D1319-A1322 PolarHBondContact O-N 3.06Å; A1320-A1322 VanDerWaalsContact C-N 3.32Å; A1320-A1322 PolarHBondContact O-N 2.78Å; A1322-K1326 WeakPolarHBondContact O-CB 3.32Å; A1322-K1326 VanDerWaalsContact O-CG 3.25Å; A1322-K1326 WeakPolarHBondContact O-CG 3.39Å; A1322-K1326 PolarHBondContact O-N 3.06Å
1323	R	76.3	Confident	75	Confident	183 Å²	183	104.3 Å²	104.3	69%	0.691	50%	0.5	S	S	*	.	H	α-helix	trans	-67.8	-44.4	172.6	-72.9	171.4	-169.6	-157.2	5.1	111.4	D1319 A1320 K1326 R1327	D1319-R1323 WeakPolarHBondContact O-CB 3.5Å; D1319-R1323 VanDerWaalsContact O-CG 3.23Å; D1319-R1323 WeakPolarHBondContact O-CG 3.3Å; D1319-R1323 PolarHBondContact O-N 2.89Å; A1320-R1323 PolarHBondContact O-N 3.17Å; R1323-K1326 CarbonylContact O-C 3.6Å; R1323-K1326 WeakPolarHBondContact O-CA 3.46Å; R1323-K1326 WeakPolarHBondContact O-CB 3.25Å; R1323-K1326 PolarHBondContact O-N 3.12Å; R1323-K1326 VanDerWaalsContact O-N 3.14Å; R1323-R1327 PolarHBondContact O-N 3.2Å
1324	A	70.4	Confident	74.6	Confident	55 Å²	55	108.8 Å²	108.8	46%	0.455	53%	0.528	S	S	.	.	H	α-helix	trans	-62.5	-44.2	177.3	0	0	0	0	0	111.9	A1320 K1321 K1326 R1327	A1320-A1324 WeakPolarHBondContact O-CB 3.17Å; A1320-A1324 PolarHBondContact O-N 3.08Å; K1321-A1324 PolarHBondContact O-N 2.96Å; A1324-K1326 PolarHBondContact O-N 2.86Å; A1324-R1327 PolarHBondContact O-N 3.4Å; A1324-R1327 VanDerWaalsContact O-N 3.11Å
1325	L	68	Low	74.6	Confident	140 Å²	140	105.6 Å²	105.6	73%	0.733	51%	0.511	S	S	*	.	H	α-helix	trans	-61.7	-33.1	174.4	-163	71.6	0	0	0	112	K1321	K1321-L1325 WeakPolarHBondContact O-CB 3.26Å; K1321-L1325 PolarHBondContact O-N 3.05Å
1326	K	63.8	Low	74.4	Confident	154 Å²	154	105.4 Å²	105.4	67%	0.67	54%	0.535	S	S	*	.	H	α-helix	trans	-77.9	-19.7	173.9	-74.3	172.1	-178.5	176.5	0	114.8	A1322 R1323 A1324 I1329	A1322-K1326 WeakPolarHBondContact O-CB 3.32Å; A1322-K1326 VanDerWaalsContact O-CG 3.25Å; A1322-K1326 WeakPolarHBondContact O-CG 3.39Å; A1322-K1326 PolarHBondContact O-N 3.06Å; R1323-K1326 CarbonylContact O-C 3.6Å; R1323-K1326 WeakPolarHBondContact O-CA 3.46Å; R1323-K1326 WeakPolarHBondContact O-CB 3.25Å; R1323-K1326 PolarHBondContact O-N 3.12Å; R1323-K1326 VanDerWaalsContact O-N 3.14Å; A1324-K1326 PolarHBondContact O-N 2.86Å; K1326-I1329 WeakPolarHBondContact O-CD1 3.46Å; K1326-I1329 WeakPolarHBondContact O-CG1 3.44Å
1327	R	58.8	Low	74.4	Confident	216 Å²	216	100.5 Å²	100.5	82%	0.815	51%	0.514	S	S	*	.	H	α-helix	trans	-75.9	-21.8	175	-81.2	-172.2	174.4	179.3	-0.5	112.5	R1323 A1324 I1329	R1323-R1327 PolarHBondContact O-N 3.2Å; A1324-R1327 PolarHBondContact O-N 3.4Å; A1324-R1327 VanDerWaalsContact O-N 3.11Å; R1327-I1329 PolarHBondContact O-N 2.86Å
1328	K	55.4	Low	74.6	Confident	183 Å²	183	103.7 Å²	103.7	80%	0.796	54%	0.536	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.9	50.6	178.7	-64.8	-166.5	174.4	-168.5	0	114.2
1329	I	57.8	Low	75	Confident	104 Å²	104	101.6 Å²	101.6	53%	0.533	52%	0.521	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.7	-29	-177.4	-75	170	0	0	0	113.3	K1326 R1327 A1331	K1326-I1329 WeakPolarHBondContact O-CD1 3.46Å; K1326-I1329 WeakPolarHBondContact O-CG1 3.44Å; R1327-I1329 PolarHBondContact O-N 2.86Å; I1329-A1331 PolarHBondContact O-N 3.21Å
1330	Y	63.1	Low	75.3	Confident	96 Å²	96	98.7 Å²	98.7	38%	0.376	50%	0.504	S	S	.	.			trans	-80.4	102.1	176.8	-66.9	-69.5	0	0	0	111.5	P1364	Y1330-P1364 HydrophobicContact CD1-CB 4.39Å
1331	A	66.2	Low	75.7	Confident	44 Å²	44	99 Å²	99	36%	0.364	50%	0.496	S	S	.	.			trans	-75.9	121.9	164.4	0	0	0	0	0	109.7	I1329 R1333	I1329-A1331 PolarHBondContact O-N 3.21Å; A1331-R1333 PolarHBondContact O-N 2.99Å
1332	R	74.2	Confident	76.1	Confident	204 Å²	204	95.3 Å²	95.3	77%	0.77	48%	0.483	S	S	*	.			trans	-59.7	131	166.7	-78.1	-174.7	166.2	178.2	-3	108.8	N1342 F1397	R1332-N1342 WeakPolarHBondContact CA-OD1 3.19Å; R1332-N1342 HydrophobicContact CG-CB 4.26Å; R1332-F1397 WeakPolarHBondContact O-CD1 3.39Å
1333	R	81.1	Confident	76.6	Confident	6 Å²	6	96.7 Å²	96.7	2%	0.023	48%	0.481	C	S	.	.			trans	-105.9	158.3	177.7	-59.8	-76.8	-158.5	87.5	21	110.3	A1331 I1335 F1340 N1342 P1364 K1369 H1371 E1390 K1393 D1396 F1397 S1398	A1331-R1333 PolarHBondContact O-N 2.99Å; R1333-I1335 HydrophobicContact CB-CD1 3.87Å; R1333-I1335 HydrophobicContact CB-CG1 4.06Å; R1333-I1335 HydrophobicContact CG-CD1 4.2Å; R1333-F1340 HydrophobicContact CB-CE1 4.16Å; R1333-F1340 HydrophobicContact CB-CZ 3.83Å; R1333-F1340 HydrophobicContact CG-CZ 4.22Å; R1333-N1342 PolarHBondContact N-OD1 3.25Å; R1333-N1342 PolarHBondContact O-ND2 3.23Å; R1333-N1342 PolarHBondContact O-OD1 3.1Å; R1333-P1364 HydrophobicContact CG-CG 4.16Å; R1333-K1369 PolarHBondContact NH2-O 3.43Å; R1333-H1371 PolarHBondContact NH2-O 2.92Å; R1333-E1390 IonicContact CZ-OE1 3.01Å; R1333-E1390 IonicContact CZ-OE2 3.76Å; R1333-E1390 IonicContact NH1-OE1 3.72Å; R1333-E1390 PolarHBondContact NH1-OE1 3.02Å; R1333-E1390 IonicContact NH1-OE2 3.1Å; R1333-E1390 PolarHBondContact NH1-OE2 2.85Å; R1333-E1390 IonicContact NH2-OE1 3.66Å; R1333-E1390 IonicContact NH2-OE2 2.72Å; R1333-E1390 PolarHBondContact NH2-OE2 3.36Å; R1333-K1393 VanDerWaalsContact CZ-NZ 3.33Å; R1333-D1396 WeakPolarHBondContact CD-O 3.44Å; R1333-F1397 WeakPolarHBondContact CB-O 3.36Å; R1333-S1398 PolarHBondContact NH1-O 2.88Å; R1333-S1398 VanDerWaalsContact NH1-O 3.15Å
1334	V	81.2	Confident	76.9	Confident	123 Å²	123	89.3 Å²	89.3	75%	0.745	46%	0.458	S	S	*	.			trans	-112.8	82.6	171.9	-173.6	0	0	0	0	108.1	F1397	V1334-F1397 PolarHBondContact N-O 3.43Å
1335	I	84.6	Confident	77.6	Confident	21 Å²	21	92.4 Å²	92.4	11%	0.108	46%	0.459	C	S	.	.			trans	-120.5	114.8	-178.8	-63.7	169.2	0	0	0	107.4	R1333 H1337 F1340 L1372 L1399 L1413	R1333-I1335 HydrophobicContact CB-CD1 3.87Å; R1333-I1335 HydrophobicContact CB-CG1 4.06Å; R1333-I1335 HydrophobicContact CG-CD1 4.2Å; I1335-H1337 HydrophobicContact CG2-CB 4.36Å; I1335-H1337 PolarHBondContact O-N 3.41Å; I1335-F1340 HydrophobicContact CB-CD1 3.8Å; I1335-F1340 HydrophobicContact CB-CD2 4.41Å; I1335-F1340 HydrophobicContact CB-CE1 3.96Å; I1335-F1340 HydrophobicContact CB-CG 4.05Å; I1335-F1340 HydrophobicContact CB-CZ 4.35Å; I1335-F1340 HydrophobicContact CD1-CD2 4.43Å; I1335-F1340 HydrophobicContact CD1-CE1 4.47Å; I1335-F1340 HydrophobicContact CD1-CE2 3.99Å; I1335-F1340 HydrophobicContact CD1-CZ 4.02Å; I1335-F1340 HydrophobicContact CG2-CB 4.38Å; I1335-F1340 HydrophobicContact CG2-CD1 4.29Å; I1335-F1340 HydrophobicContact CG2-CD2 4.35Å; I1335-F1340 HydrophobicContact CG2-CG 4.05Å; I1335-F1340 WeakPolarHBondContact O-CD1 3.38Å; I1335-L1372 HydrophobicContact CD1-CD1 4.26Å; I1335-L1372 HydrophobicContact CD1-CD2 4.34Å; I1335-L1399 HydrophobicContact CD1-CB 4.3Å; I1335-L1399 HydrophobicContact CD1-CD1 4.18Å; I1335-L1399 HydrophobicContact CG1-CB 4.26Å; I1335-L1413 HydrophobicContact CG2-CD1 3.85Å
1336	A	84.4	Confident	78.5	Confident	114 Å²	114	88.9 Å²	88.9	94%	0.942	45%	0.449	S	S	*	.			trans	-88.5	85.1	-178.3	0	0	0	0	0	110.5
1337	H	87.5	Confident	79.6	Confident	24 Å²	24	85.9 Å²	85.9	11%	0.111	44%	0.438	C	S	.	.			trans	-140.8	137	176.7	-179.5	-88.5	0	0	0	110.3	I1335 S1339 F1340 L1413 D1414 I1417	I1335-H1337 HydrophobicContact CG2-CB 4.36Å; I1335-H1337 PolarHBondContact O-N 3.41Å; H1337-S1339 WeakPolarHBondContact CE1-CB 3.45Å; H1337-S1339 PolarHBondContact CE1-N 3.4Å; H1337-S1339 PolarHBondContact CE1-OG 3.11Å; H1337-S1339 PolarHBondContact ND1-N 3.03Å; H1337-S1339 PolarHBondContact O-N 3.27Å; H1337-S1339 VanDerWaalsContact O-N 3.17Å; H1337-F1340 HydrophobicContact CB-CB 3.92Å; H1337-F1340 PolarHBondContact O-N 3.1Å; H1337-L1413 HydrophobicContact CB-CD1 3.8Å; H1337-D1414 IonicContact CD2-OD1 2.68Å; H1337-D1414 IonicContact CD2-OD2 3.42Å; H1337-D1414 IonicContact CE1-OD1 3.78Å; H1337-D1414 WeakPolarHBondContact NE2-CB 3.09Å; H1337-D1414 PolarHBondContact NE2-N 3.02Å; H1337-D1414 CovalentContact NE2-OD1 1.78Å; H1337-D1414 IonicContact NE2-OD1 2.67Å; H1337-D1414 PolarHBondContact NE2-OD1 3.47Å; H1337-D1414 IonicContact NE2-OD2 2.71Å; H1337-D1414 PolarHBondContact NE2-OD2 3.21Å; H1337-I1417 WeakPolarHBondContact CE1-CD1 3.47Å
1338	P	88.8	Confident	81.1	Confident	115 Å²	115	75.6 Å²	75.6	75%	0.747	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-28.4	-172.8	-26.1	35.6	0	0	0	115.3
1339	S	89.6	Confident	82.7	Confident	29 Å²	29	68.5 Å²	68.5	20%	0.203	37%	0.371	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.4	6.8	178.6	-51.7	0	0	0	0	112.9	H1337 F1341 L1362	H1337-S1339 WeakPolarHBondContact CE1-CB 3.45Å; H1337-S1339 PolarHBondContact CE1-N 3.4Å; H1337-S1339 PolarHBondContact CE1-OG 3.11Å; H1337-S1339 PolarHBondContact ND1-N 3.03Å; H1337-S1339 PolarHBondContact O-N 3.27Å; H1337-S1339 VanDerWaalsContact O-N 3.17Å; S1339-F1341 VanDerWaalsContact C-CE2 3.46Å; S1339-F1341 VanDerWaalsContact O-CD2 3.22Å; S1339-F1341 WeakPolarHBondContact O-CD2 3.19Å; S1339-F1341 VanDerWaalsContact O-CE2 3.24Å; S1339-F1341 WeakPolarHBondContact O-CE2 3.42Å; S1339-L1362 WeakPolarHBondContact O-CB 3.24Å; S1339-L1362 PolarHBondContact O-N 2.89Å
1340	F	92.3	Very high	84.2	Confident	18 Å²	18	66.5 Å²	66.5	8%	0.079	37%	0.37	C	S	.	.	B	Isolated β-bridge	trans	-95.2	126.3	179.4	-178.6	-92.6	0	0	0	112.7	R1333 I1335 H1337 L1362 P1364 L1372	R1333-F1340 HydrophobicContact CB-CE1 4.16Å; R1333-F1340 HydrophobicContact CB-CZ 3.83Å; R1333-F1340 HydrophobicContact CG-CZ 4.22Å; I1335-F1340 HydrophobicContact CB-CD1 3.8Å; I1335-F1340 HydrophobicContact CB-CD2 4.41Å; I1335-F1340 HydrophobicContact CB-CE1 3.96Å; I1335-F1340 HydrophobicContact CB-CG 4.05Å; I1335-F1340 HydrophobicContact CB-CZ 4.35Å; I1335-F1340 HydrophobicContact CD1-CD2 4.43Å; I1335-F1340 HydrophobicContact CD1-CE1 4.47Å; I1335-F1340 HydrophobicContact CD1-CE2 3.99Å; I1335-F1340 HydrophobicContact CD1-CZ 4.02Å; I1335-F1340 HydrophobicContact CG2-CB 4.38Å; I1335-F1340 HydrophobicContact CG2-CD1 4.29Å; I1335-F1340 HydrophobicContact CG2-CD2 4.35Å; I1335-F1340 HydrophobicContact CG2-CG 4.05Å; I1335-F1340 WeakPolarHBondContact O-CD1 3.38Å; H1337-F1340 HydrophobicContact CB-CB 3.92Å; H1337-F1340 PolarHBondContact O-N 3.1Å; F1340-L1362 CarbonylContact C-O 3.48Å; F1340-L1362 WeakPolarHBondContact CA-O 3.41Å; F1340-L1362 HydrophobicContact CB-CB 4.45Å; F1340-L1362 HydrophobicContact CD2-CB 4.08Å; F1340-P1364 HydrophobicContact CE2-CG 4.5Å; F1340-P1364 HydrophobicContact CZ-CG 3.98Å; F1340-L1372 HydrophobicContact CE2-CD2 3.97Å
1341	F	89.9	Confident	85.4	Confident	62 Å²	62	64.4 Å²	64.4	27%	0.272	36%	0.364	S	S	.	.			trans	-129.8	131.7	-177.6	-55.1	-85.4	0	0	0	111.2	S1339 K1343 M1351 A1361 L1362 R1363 P1364	S1339-F1341 VanDerWaalsContact C-CE2 3.46Å; S1339-F1341 VanDerWaalsContact O-CD2 3.22Å; S1339-F1341 WeakPolarHBondContact O-CD2 3.19Å; S1339-F1341 VanDerWaalsContact O-CE2 3.24Å; S1339-F1341 WeakPolarHBondContact O-CE2 3.42Å; F1341-K1343 HydrophobicContact CB-CB 4.09Å; F1341-K1343 HydrophobicContact CB-CD 4.18Å; F1341-K1343 HydrophobicContact CB-CG 4.08Å; F1341-K1343 PolarHBondContact O-N 3.35Å; F1341-M1351 HydrophobicContact CD1-CE 4.41Å; F1341-M1351 HydrophobicContact CD1-SD 4.14Å; F1341-M1351 HydrophobicContact CD2-CE 3.72Å; F1341-M1351 HydrophobicContact CD2-SD 4.47Å; F1341-M1351 HydrophobicContact CE1-CE 4.27Å; F1341-M1351 HydrophobicContact CE1-SD 4.05Å; F1341-M1351 HydrophobicContact CE2-CE 3.54Å; F1341-M1351 HydrophobicContact CE2-SD 4.39Å; F1341-M1351 HydrophobicContact CG-CE 4.16Å; F1341-M1351 HydrophobicContact CG-SD 4.35Å; F1341-M1351 HydrophobicContact CZ-CE 3.84Å; F1341-M1351 HydrophobicContact CZ-SD 4.18Å; F1341-A1361 HydrophobicContact CD2-CB 3.92Å; F1341-A1361 HydrophobicContact CE2-CB 4.07Å; F1341-L1362 PolarHBondContact N-O 3.46Å; F1341-R1363 WeakPolarHBondContact O-CA 3.49Å; F1341-R1363 WeakPolarHBondContact O-CB 3.3Å; F1341-P1364 VanDerWaalsContact O-CD 3.31Å; F1341-P1364 WeakPolarHBondContact O-CD 3.21Å
1342	N	88.1	Confident	86.6	Confident	70 Å²	70	62.5 Å²	62.5	37%	0.374	35%	0.348	S	S	.	.			trans	-77.1	45.4	168.8	-79	-54.9	0	0	0	112.2	R1332 R1333	R1332-N1342 WeakPolarHBondContact CA-OD1 3.19Å; R1332-N1342 HydrophobicContact CG-CB 4.26Å; R1333-N1342 PolarHBondContact N-OD1 3.25Å; R1333-N1342 PolarHBondContact O-ND2 3.23Å; R1333-N1342 PolarHBondContact O-OD1 3.1Å
1343	K	87.3	Confident	87.2	Confident	70 Å²	70	54.8 Å²	54.8	30%	0.304	33%	0.328	S	S	.	.			trans	-106.6	147.2	-177.6	-77.6	-176.6	169.2	-172.8	0	110.5	F1341 E1347 V1348 M1351 R1363	F1341-K1343 HydrophobicContact CB-CB 4.09Å; F1341-K1343 HydrophobicContact CB-CD 4.18Å; F1341-K1343 HydrophobicContact CB-CG 4.08Å; F1341-K1343 PolarHBondContact O-N 3.35Å; K1343-E1347 HydrophobicContact CB-CB 3.82Å; K1343-E1347 HydrophobicContact CD-CB 4.05Å; K1343-E1347 HydrophobicContact CG-CB 4.03Å; K1343-V1348 HydrophobicContact CB-CG2 3.68Å; K1343-M1351 HydrophobicContact CD-SD 4Å; K1343-M1351 PolarHBondContact NZ-SD 3.31Å; K1343-R1363 WeakPolarHBondContact O-CB 3.49Å; K1343-R1363 WeakPolarHBondContact O-CD 3.24Å
1344	S	83.1	Confident	87.5	Confident	28 Å²	28	63.5 Å²	63.5	20%	0.196	37%	0.369	C	S	.	.			trans	-67.7	178.6	173.2	70.1	0	0	0	0	112.4	E1347 V1348	S1344-E1347 WeakPolarHBondContact CA-OE2 3.44Å; S1344-E1347 WeakPolarHBondContact CB-OE2 3.46Å; S1344-E1347 PolarHBondContact N-OE2 2.76Å; S1344-E1347 PolarHBondContact OG-N 3.03Å; S1344-E1347 PolarHBondContact OG-OE2 2.82Å; S1344-V1348 WeakPolarHBondContact O-CB 3.44Å; S1344-V1348 WeakPolarHBondContact O-CG2 3.3Å; S1344-V1348 PolarHBondContact O-N 3.29Å
1345	Y	85.3	Confident	87.9	Confident	120 Å²	120	58.1 Å²	58.1	47%	0.471	34%	0.337	S	S	.	.	H	α-helix	trans	-58.7	-46	173.2	164.7	-118.6	0	0	0	112.7	V1348 V1349 H1385	Y1345-V1348 PolarHBondContact O-N 3.37Å; Y1345-V1349 HydrophobicContact CD2-CG2 3.88Å; Y1345-V1349 HydrophobicContact CE2-CG2 3.39Å; Y1345-V1349 WeakPolarHBondContact O-CG2 3.41Å; Y1345-V1349 PolarHBondContact O-N 3.11Å; Y1345-H1385 AromaticContact CD2-CE1 3.93Å; Y1345-H1385 AromaticContact CE2-CE1 3.5Å; Y1345-H1385 VanDerWaalsContact CE2-CE1 3.5Å; Y1345-H1385 WeakPolarHBondContact CE2-CE1 3.41Å; Y1345-H1385 AromaticContact CE2-NE2 3.46Å; Y1345-H1385 WeakPolarHBondContact CE2-NE2 3.33Å
1346	A	85.7	Confident	88.2	Confident	65 Å²	65	63 Å²	63	54%	0.537	36%	0.364	S	S	.	.	H	α-helix	trans	-66.9	-47.2	-176.9	0	0	0	0	0	111.9	V1348 V1349 A1350	A1346-V1348 VanDerWaalsContact C-N 3.28Å; A1346-V1348 PolarHBondContact O-N 3.06Å; A1346-V1349 PolarHBondContact O-N 2.59Å; A1346-V1349 VanDerWaalsContact O-N 3.14Å; A1346-A1350 PolarHBondContact O-N 3.48Å
1347	E	87.8	Confident	88.6	Confident	92 Å²	92	58.8 Å²	58.8	43%	0.43	32%	0.324	S	S	.	.	H	α-helix	trans	-61.5	-34.1	177.5	-68.1	162.5	81.5	0	0	113	K1343 S1344 M1351	K1343-E1347 HydrophobicContact CB-CB 3.82Å; K1343-E1347 HydrophobicContact CD-CB 4.05Å; K1343-E1347 HydrophobicContact CG-CB 4.03Å; S1344-E1347 WeakPolarHBondContact CA-OE2 3.44Å; S1344-E1347 WeakPolarHBondContact CB-OE2 3.46Å; S1344-E1347 PolarHBondContact N-OE2 2.76Å; S1344-E1347 PolarHBondContact OG-N 3.03Å; S1344-E1347 PolarHBondContact OG-OE2 2.82Å; E1347-M1351 WeakPolarHBondContact O-CB 3.34Å; E1347-M1351 PolarHBondContact O-N 3.07Å
1348	V	89.4	Confident	88.8	Confident	0 Å²	0	58.3 Å²	58.3	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-74.1	-35.9	174.7	165.8	0	0	0	0	112	K1343 S1344 Y1345 A1346 L1352 A1361 R1363 T1375	K1343-V1348 HydrophobicContact CB-CG2 3.68Å; S1344-V1348 WeakPolarHBondContact O-CB 3.44Å; S1344-V1348 WeakPolarHBondContact O-CG2 3.3Å; S1344-V1348 PolarHBondContact O-N 3.29Å; Y1345-V1348 PolarHBondContact O-N 3.37Å; A1346-V1348 VanDerWaalsContact C-N 3.28Å; A1346-V1348 PolarHBondContact O-N 3.06Å; V1348-L1352 HydrophobicContact CG1-CD1 3.9Å; V1348-L1352 WeakPolarHBondContact O-CB 3.46Å; V1348-L1352 WeakPolarHBondContact O-CG 3.35Å; V1348-L1352 PolarHBondContact O-N 2.91Å; V1348-A1361 HydrophobicContact CG1-CB 3.67Å; V1348-A1361 HydrophobicContact CG2-CB 4.44Å; V1348-R1363 HydrophobicContact CG2-CB 4.2Å; V1348-R1363 HydrophobicContact CG2-CG 4.23Å; V1348-T1375 HydrophobicContact CG1-CG2 4Å
1349	V	88.9	Confident	89	Confident	34 Å²	34	57.4 Å²	57.4	21%	0.206	31%	0.312	C	S	.	.	H	α-helix	trans	-66.1	-45.4	173.8	164.3	0	0	0	0	111.1	Y1345 A1346 L1352 A1353 F1383	Y1345-V1349 HydrophobicContact CD2-CG2 3.88Å; Y1345-V1349 HydrophobicContact CE2-CG2 3.39Å; Y1345-V1349 WeakPolarHBondContact O-CG2 3.41Å; Y1345-V1349 PolarHBondContact O-N 3.11Å; A1346-V1349 PolarHBondContact O-N 2.59Å; A1346-V1349 VanDerWaalsContact O-N 3.14Å; V1349-L1352 CarbonylContact O-C 3.56Å; V1349-L1352 PolarHBondContact O-N 2.93Å; V1349-A1353 PolarHBondContact O-N 3.48Å; V1349-F1383 HydrophobicContact CG1-CD2 4.01Å; V1349-F1383 HydrophobicContact CG1-CE2 3.75Å; V1349-F1383 HydrophobicContact CG1-CZ 4.47Å; V1349-F1383 HydrophobicContact CG2-CD2 4.15Å
1350	A	88.8	Confident	89.2	Confident	62 Å²	62	57 Å²	57	51%	0.512	31%	0.308	S	S	.	.	H	α-helix	trans	-59.8	-47.6	175.3	0	0	0	0	0	111.6	A1346 L1352 A1353	A1346-A1350 PolarHBondContact O-N 3.48Å; A1350-L1352 VanDerWaalsContact C-N 3.28Å; A1350-L1352 PolarHBondContact O-N 3.14Å; A1350-A1353 WeakPolarHBondContact O-CB 3.49Å; A1350-A1353 PolarHBondContact O-N 2.82Å; A1350-A1353 VanDerWaalsContact O-N 3.12Å
1351	M	88.7	Confident	89.3	Confident	52 Å²	52	56.1 Å²	56.1	26%	0.256	30%	0.304	S	S	.	.	H	α-helix	trans	-63	-31.1	177.7	-171	-173.1	82.8	0	0	113.4	F1341 K1343 E1347 A1361	F1341-M1351 HydrophobicContact CD1-CE 4.41Å; F1341-M1351 HydrophobicContact CD1-SD 4.14Å; F1341-M1351 HydrophobicContact CD2-CE 3.72Å; F1341-M1351 HydrophobicContact CD2-SD 4.47Å; F1341-M1351 HydrophobicContact CE1-CE 4.27Å; F1341-M1351 HydrophobicContact CE1-SD 4.05Å; F1341-M1351 HydrophobicContact CE2-CE 3.54Å; F1341-M1351 HydrophobicContact CE2-SD 4.39Å; F1341-M1351 HydrophobicContact CG-CE 4.16Å; F1341-M1351 HydrophobicContact CG-SD 4.35Å; F1341-M1351 HydrophobicContact CZ-CE 3.84Å; F1341-M1351 HydrophobicContact CZ-SD 4.18Å; K1343-M1351 HydrophobicContact CD-SD 4Å; K1343-M1351 PolarHBondContact NZ-SD 3.31Å; E1347-M1351 WeakPolarHBondContact O-CB 3.34Å; E1347-M1351 PolarHBondContact O-N 3.07Å; M1351-A1361 HydrophobicContact CE-CB 3.55Å
1352	L	91	Very high	89.4	Confident	3 Å²	3	53.1 Å²	53.1	2%	0.016	29%	0.291	C	S	.	.	H	α-helix	trans	-89.1	-6.6	176	-71.6	173.3	0	0	0	113.7	V1348 V1349 A1350 A1355 E1359 A1361 T1375 K1377 F1383	V1348-L1352 HydrophobicContact CG1-CD1 3.9Å; V1348-L1352 WeakPolarHBondContact O-CB 3.46Å; V1348-L1352 WeakPolarHBondContact O-CG 3.35Å; V1348-L1352 PolarHBondContact O-N 2.91Å; V1349-L1352 CarbonylContact O-C 3.56Å; V1349-L1352 PolarHBondContact O-N 2.93Å; A1350-L1352 VanDerWaalsContact C-N 3.28Å; A1350-L1352 PolarHBondContact O-N 3.14Å; L1352-A1355 HydrophobicContact CB-CB 4.49Å; L1352-A1355 HydrophobicContact CD2-CB 3.93Å; L1352-A1355 PolarHBondContact O-N 3.03Å; L1352-E1359 HydrophobicContact CD2-CB 4.06Å; L1352-A1361 HydrophobicContact CD1-CB 3.93Å; L1352-A1361 HydrophobicContact CD2-CB 4.37Å; L1352-A1361 HydrophobicContact CG-CB 4.21Å; L1352-T1375 HydrophobicContact CD1-CG2 3.56Å; L1352-K1377 WeakPolarHBondContact O-CD 3.48Å; L1352-F1383 HydrophobicContact CB-CD1 3.89Å; L1352-F1383 HydrophobicContact CB-CE1 3.61Å; L1352-F1383 HydrophobicContact CD1-CD1 4.44Å; L1352-F1383 WeakPolarHBondContact O-CE1 3.38Å
1353	A	88.3	Confident	89.6	Confident	42 Å²	42	50.4 Å²	50.4	35%	0.347	28%	0.276	S	S	.	.	H	α-helix	trans	-65.7	-47.3	176.4	0	0	0	0	0	111	V1349 A1350 A1355 K1377 F1383	V1349-A1353 PolarHBondContact O-N 3.48Å; A1350-A1353 WeakPolarHBondContact O-CB 3.49Å; A1350-A1353 PolarHBondContact O-N 2.82Å; A1350-A1353 VanDerWaalsContact O-N 3.12Å; A1353-A1355 VanDerWaalsContact C-N 3.28Å; A1353-A1355 PolarHBondContact O-N 2.8Å; A1353-K1377 PolarHBondContact O-NZ 3.44Å; A1353-F1383 HydrophobicContact CB-CZ 4.5Å
1354	E	87.1	Confident	89.7	Confident	189 Å²	189	47.4 Å²	47.4	88%	0.883	26%	0.263	S	S	*	.	S	Bend	trans	-74	-17.4	177.5	-58.2	-175.7	161.3	0	0	113.4
1355	A	89.1	Confident	89.9	Confident	11 Å²	11	46.4 Å²	46.4	9%	0.091	26%	0.256	C	S	.	.	S	Bend	trans	-71.8	158.7	-175.1	0	0	0	0	0	113.9	L1352 A1353 E1359 K1377	L1352-A1355 HydrophobicContact CB-CB 4.49Å; L1352-A1355 HydrophobicContact CD2-CB 3.93Å; L1352-A1355 PolarHBondContact O-N 3.03Å; A1353-A1355 VanDerWaalsContact C-N 3.28Å; A1353-A1355 PolarHBondContact O-N 2.8Å; A1355-E1359 HydrophobicContact CB-CB 3.95Å; A1355-E1359 HydrophobicContact CB-CG 4.28Å; A1355-K1377 WeakPolarHBondContact O-CD 3.35Å; A1355-K1377 WeakPolarHBondContact O-CE 3.49Å; A1355-K1377 PolarHBondContact O-NZ 2.87Å
1356	D	92.1	Very high	89.7	Confident	124 Å²	124	43.6 Å²	43.6	66%	0.663	26%	0.255	S	S	*	.	P	Polyproline II helix	trans	-72.4	154	177.5	-126.5	-18.4	0	0	0	111.8	G1358 E1359	D1356-G1358 PolarHBondContact O-N 2.73Å; D1356-E1359 HydrophobicContact CB-CG 4.28Å; D1356-E1359 WeakPolarHBondContact CB-OE1 3.14Å; D1356-E1359 PolarHBondContact N-OE1 2.81Å; D1356-E1359 WeakPolarHBondContact O-CB 3.13Å; D1356-E1359 PolarHBondContact O-N 3.3Å; D1356-E1359 VanDerWaalsContact O-N 3.11Å
1357	Q	92.5	Very high	89.6	Confident	24 Å²	24	47.1 Å²	47.1	11%	0.112	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.2	122.6	179.8	-176.9	-84.7	-25.7	0	0	110.4	V1378 A1425 R1429 I1432	Q1357-V1378 VanDerWaalsContact CG-O 3.31Å; Q1357-V1378 WeakPolarHBondContact CG-O 3.14Å; Q1357-V1378 PolarHBondContact NE2-O 3.5Å; Q1357-A1425 PolarHBondContact NE2-O 3.04Å; Q1357-R1429 PolarHBondContact O-NH2 2.88Å; Q1357-I1432 HydrophobicContact CG-CD1 4.07Å
1358	G	90.9	Very high	89.3	Confident	15 Å²	15	45 Å²	45	16%	0.155	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	100.2	-5.5	-175.6	0	0	0	0	0	115.9	D1356 K1377	D1356-G1358 PolarHBondContact O-N 2.73Å; G1358-K1377 PolarHBondContact N-O 2.92Å
1359	E	93.3	Very high	88.9	Confident	96 Å²	96	50.3 Å²	50.3	45%	0.449	28%	0.276	S	S	.	.			trans	-65.3	153.2	172.3	-76.9	-166.8	-126	0	0	112.8	L1352 A1355 D1356 W1376 K1377	L1352-E1359 HydrophobicContact CD2-CB 4.06Å; A1355-E1359 HydrophobicContact CB-CB 3.95Å; A1355-E1359 HydrophobicContact CB-CG 4.28Å; D1356-E1359 HydrophobicContact CB-CG 4.28Å; D1356-E1359 WeakPolarHBondContact CB-OE1 3.14Å; D1356-E1359 PolarHBondContact N-OE1 2.81Å; D1356-E1359 WeakPolarHBondContact O-CB 3.13Å; D1356-E1359 PolarHBondContact O-N 3.3Å; D1356-E1359 VanDerWaalsContact O-N 3.11Å; E1359-W1376 WeakPolarHBondContact O-CA 3.13Å; E1359-W1376 WeakPolarHBondContact O-CB 3.39Å; E1359-K1377 PolarHBondContact O-N 2.61Å; E1359-K1377 VanDerWaalsContact O-N 3.1Å
1360	V	94.1	Very high	88.8	Confident	19 Å²	19	52.6 Å²	52.6	12%	0.115	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	133.7	-168.4	-168.1	0	0	0	0	111.6	T1375 W1376 I1417 I1421	V1360-T1375 CarbonylContact C-O 3.29Å; V1360-T1375 WeakPolarHBondContact CA-O 3.32Å; V1360-W1376 HydrophobicContact CG1-CB 4.46Å; V1360-W1376 HydrophobicContact CG2-CB 4.04Å; V1360-I1417 HydrophobicContact CB-CG1 4.49Å; V1360-I1417 HydrophobicContact CG1-CG1 4.2Å; V1360-I1417 HydrophobicContact CG2-CG2 4.42Å; V1360-I1421 HydrophobicContact CG1-CD1 3.73Å; V1360-I1421 HydrophobicContact CG2-CB 4.37Å; V1360-I1421 HydrophobicContact CG2-CD1 4.4Å; V1360-I1421 HydrophobicContact CG2-CG2 3.63Å
1361	A	93.7	Very high	88.9	Confident	0 Å²	0	51 Å²	51	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	115.6	170.7	0	0	0	0	0	110.6	F1341 V1348 M1351 L1352 T1375	F1341-A1361 HydrophobicContact CD2-CB 3.92Å; F1341-A1361 HydrophobicContact CE2-CB 4.07Å; V1348-A1361 HydrophobicContact CG1-CB 3.67Å; V1348-A1361 HydrophobicContact CG2-CB 4.44Å; M1351-A1361 HydrophobicContact CE-CB 3.55Å; L1352-A1361 HydrophobicContact CD1-CB 3.93Å; L1352-A1361 HydrophobicContact CD2-CB 4.37Å; L1352-A1361 HydrophobicContact CG-CB 4.21Å; A1361-T1375 PolarHBondContact N-O 3.24Å; A1361-T1375 PolarHBondContact O-N 3.08Å
1362	L	93.1	Very high	89	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	136.1	171.1	-71	151.8	0	0	0	109.2	S1339 F1340 F1341 T1373 A1374 L1413 I1417	S1339-L1362 WeakPolarHBondContact O-CB 3.24Å; S1339-L1362 PolarHBondContact O-N 2.89Å; F1340-L1362 CarbonylContact C-O 3.48Å; F1340-L1362 WeakPolarHBondContact CA-O 3.41Å; F1340-L1362 HydrophobicContact CB-CB 4.45Å; F1340-L1362 HydrophobicContact CD2-CB 4.08Å; F1341-L1362 PolarHBondContact N-O 3.46Å; L1362-T1373 WeakPolarHBondContact CA-O 3.3Å; L1362-A1374 HydrophobicContact CD2-CB 3.55Å; L1362-A1374 HydrophobicContact CG-CB 4.39Å; L1362-L1413 HydrophobicContact CD1-CB 3.89Å; L1362-L1413 HydrophobicContact CD1-CD1 4.23Å; L1362-L1413 HydrophobicContact CD1-CD2 3.94Å; L1362-L1413 HydrophobicContact CD1-CG 4.23Å; L1362-L1413 HydrophobicContact CD2-CD2 4.02Å; L1362-I1417 HydrophobicContact CD1-CD1 4.14Å
1363	R	91.6	Very high	89.2	Confident	12 Å²	12	48.9 Å²	48.9	5%	0.045	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	164	177.3	56.7	157.7	177.3	73	3.8	112.3	F1341 K1343 V1348 S1365 L1372 T1373	F1341-R1363 WeakPolarHBondContact O-CA 3.49Å; F1341-R1363 WeakPolarHBondContact O-CB 3.3Å; K1343-R1363 WeakPolarHBondContact O-CB 3.49Å; K1343-R1363 WeakPolarHBondContact O-CD 3.24Å; V1348-R1363 HydrophobicContact CG2-CB 4.2Å; V1348-R1363 HydrophobicContact CG2-CG 4.23Å; R1363-S1365 PolarHBondContact O-N 3.02Å; R1363-L1372 WeakPolarHBondContact O-CA 3.27Å; R1363-T1373 PolarHBondContact N-O 3.28Å; R1363-T1373 VanDerWaalsContact NH1-CB 3.3Å; R1363-T1373 PolarHBondContact NH1-OG1 3.29Å; R1363-T1373 PolarHBondContact O-N 2.91Å
1364	P	89.7	Confident	89.4	Confident	7 Å²	7	46.9 Å²	46.9	5%	0.045	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-50.9	139	166.6	-26	35.2	0	0	0	111.9	Y1330 R1333 F1340 F1341	Y1330-P1364 HydrophobicContact CD1-CB 4.39Å; R1333-P1364 HydrophobicContact CG-CG 4.16Å; F1340-P1364 HydrophobicContact CE2-CG 4.5Å; F1340-P1364 HydrophobicContact CZ-CG 3.98Å; F1341-P1364 VanDerWaalsContact O-CD 3.31Å; F1341-P1364 WeakPolarHBondContact O-CD 3.21Å
1365	S	87	Confident	89.8	Confident	7 Å²	7	37.9 Å²	37.9	5%	0.049	20%	0.201	C	C	.	.			trans	-80.8	144	172.8	-168.8	0	0	0	0	110.5	R1363 K1367 H1371	R1363-S1365 PolarHBondContact O-N 3.02Å; S1365-K1367 PolarHBondContact O-N 2.98Å; S1365-K1367 PolarHBondContact OG-N 3.36Å; S1365-H1371 WeakPolarHBondContact CB-O 3.16Å; S1365-H1371 PolarHBondContact N-O 2.95Å; S1365-H1371 VanDerWaalsContact N-O 3.16Å
1366	S	81.4	Confident	90	Very high	62 Å²	62	37.4 Å²	37.4	43%	0.434	20%	0.196	S	C	.	.	S	Bend	trans	-79.3	-2.3	169.8	47.9	0	0	0	0	113.2
1367	K	82.7	Confident	90.1	Very high	138 Å²	138	32 Å²	32	60%	0.6	17%	0.167	S	C	*	.	S	Bend	trans	-76.7	-51.2	-179.5	-63.9	-171.7	-174.1	-172.5	0	113.2	S1365 D1387	S1365-K1367 PolarHBondContact O-N 2.98Å; S1365-K1367 PolarHBondContact OG-N 3.36Å; K1367-D1387 WeakPolarHBondContact CE-OD2 3.43Å; K1367-D1387 IonicContact NZ-OD1 3.7Å; K1367-D1387 IonicContact NZ-OD2 3.16Å; K1367-D1387 PolarHBondContact NZ-OD2 3.3Å
1368	S	80.9	Confident	90.2	Very high	47 Å²	47	30.9 Å²	30.9	33%	0.329	16%	0.162	S	C	.	.			trans	-164.1	176	177	80	0	0	0	0	110.9	D1370 H1371	S1368-D1370 PolarHBondContact O-N 2.92Å; S1368-D1370 PolarHBondContact OG-N 2.89Å; S1368-D1370 PolarHBondContact OG-OD2 2.98Å; S1368-H1371 PolarHBondContact OG-CD2 2.68Å
1369	K	82.3	Confident	90.2	Very high	113 Å²	113	30.5 Å²	30.5	49%	0.491	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-14.9	170.8	-60.1	-175.1	-178.4	-178.1	0	113.8	R1333 K1393 D1396	R1333-K1369 PolarHBondContact NH2-O 3.43Å; K1369-K1393 PolarHBondContact O-NZ 3.39Å; K1369-D1396 WeakPolarHBondContact CD-OD2 3.3Å; K1369-D1396 WeakPolarHBondContact CE-OD2 3.45Å; K1369-D1396 IonicContact NZ-OD2 2.8Å; K1369-D1396 PolarHBondContact NZ-OD2 3.38Å
1370	D	86.6	Confident	90	Very high	81 Å²	81	31.6 Å²	31.6	43%	0.433	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.9	15.5	-169.8	-45.7	-61.2	0	0	0	112.6	S1368 E1390	S1368-D1370 PolarHBondContact O-N 2.92Å; S1368-D1370 PolarHBondContact OG-N 2.89Å; S1368-D1370 PolarHBondContact OG-OD2 2.98Å; D1370-E1390 PolarHBondContact O-N 3.23Å
1371	H	90.6	Very high	89.6	Confident	30 Å²	30	35.9 Å²	35.9	14%	0.139	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	146	-179.8	-77.2	-120.4	0	0	0	111.1	R1333 S1365 S1368 D1387 V1388 E1390	R1333-H1371 PolarHBondContact NH2-O 2.92Å; S1365-H1371 WeakPolarHBondContact CB-O 3.16Å; S1365-H1371 PolarHBondContact N-O 2.95Å; S1365-H1371 VanDerWaalsContact N-O 3.16Å; S1368-H1371 PolarHBondContact OG-CD2 2.68Å; H1371-D1387 IonicContact CE1-OD1 2.7Å; H1371-D1387 IonicContact CE1-OD2 2.76Å; H1371-D1387 PolarHBondContact CE1-OD2 3.03Å; H1371-D1387 VanDerWaalsContact CE1-OD2 3.27Å; H1371-D1387 IonicContact CG-OD1 2.81Å; H1371-D1387 VanDerWaalsContact ND1-CG 3.25Å; H1371-D1387 IonicContact ND1-OD1 3.84Å; H1371-D1387 PolarHBondContact ND1-OD1 3.45Å; H1371-D1387 IonicContact ND1-OD2 2.7Å; H1371-D1387 PolarHBondContact ND1-OD2 3.37Å; H1371-V1388 CarbonylContact C-O 3.44Å; H1371-V1388 WeakPolarHBondContact CA-O 3.46Å; H1371-E1390 PolarHBondContact N-OE2 2.61Å
1372	L	91.6	Very high	89.5	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	170.3	161.3	-60.6	-178.4	0	0	0	109.9	I1335 F1340 R1363 V1388 E1390 L1399 L1413	I1335-L1372 HydrophobicContact CD1-CD1 4.26Å; I1335-L1372 HydrophobicContact CD1-CD2 4.34Å; F1340-L1372 HydrophobicContact CE2-CD2 3.97Å; R1363-L1372 WeakPolarHBondContact O-CA 3.27Å; L1372-V1388 HydrophobicContact CB-CB 4.26Å; L1372-V1388 PolarHBondContact N-O 3.41Å; L1372-V1388 PolarHBondContact O-N 3.49Å; L1372-E1390 HydrophobicContact CG-CG 4.24Å; L1372-L1399 HydrophobicContact CD1-CD1 3.65Å; L1372-L1413 HydrophobicContact CD1-CD2 4.1Å
1373	T	93.8	Very high	89.4	Confident	10 Å²	10	37.1 Å²	37.1	6%	0.061	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	119	169.5	-47.7	0	0	0	0	109.7	L1362 R1363 H1385 I1386	L1362-T1373 WeakPolarHBondContact CA-O 3.3Å; R1363-T1373 PolarHBondContact N-O 3.28Å; R1363-T1373 VanDerWaalsContact NH1-CB 3.3Å; R1363-T1373 PolarHBondContact NH1-OG1 3.29Å; R1363-T1373 PolarHBondContact O-N 2.91Å; T1373-H1385 HydrophobicContact CG2-CB 3.82Å; T1373-I1386 CarbonylContact C-O 3.47Å; T1373-I1386 WeakPolarHBondContact CA-O 3.48Å
1374	A	93.5	Very high	89.5	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	114.3	167.9	0	0	0	0	0	108.7	L1362 I1386 V1388 I1421	L1362-A1374 HydrophobicContact CD2-CB 3.55Å; L1362-A1374 HydrophobicContact CG-CB 4.39Å; A1374-I1386 HydrophobicContact CB-CB 4.38Å; A1374-I1386 PolarHBondContact N-O 2.87Å; A1374-I1386 PolarHBondContact O-N 3.03Å; A1374-V1388 HydrophobicContact CB-CG2 4.17Å; A1374-I1421 HydrophobicContact CB-CD1 3.8Å
1375	T	94.4	Very high	89.7	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	135.2	174.3	-56.9	0	0	0	0	109.2	V1348 L1352 V1360 A1361 F1383 Q1384 H1385	V1348-T1375 HydrophobicContact CG1-CG2 4Å; L1352-T1375 HydrophobicContact CD1-CG2 3.56Å; V1360-T1375 CarbonylContact C-O 3.29Å; V1360-T1375 WeakPolarHBondContact CA-O 3.32Å; A1361-T1375 PolarHBondContact N-O 3.24Å; A1361-T1375 PolarHBondContact O-N 3.08Å; T1375-F1383 HydrophobicContact CG2-CB 4.06Å; T1375-Q1384 WeakPolarHBondContact CA-O 3.32Å; T1375-H1385 WeakPolarHBondContact CG2-CE1 3.5Å; T1375-H1385 WeakPolarHBondContact CG2-ND1 3.47Å; T1375-H1385 PolarHBondContact OG1-ND1 3.41Å
1376	W	94.7	Very high	89.9	Confident	0 Å²	0	42 Å²	42	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	149.8	175.6	75.3	-84.4	0	0	0	113.3	E1359 V1360 V1378 F1383 Q1384 I1421 M1424 A1425 A1428	E1359-W1376 WeakPolarHBondContact O-CA 3.13Å; E1359-W1376 WeakPolarHBondContact O-CB 3.39Å; V1360-W1376 HydrophobicContact CG1-CB 4.46Å; V1360-W1376 HydrophobicContact CG2-CB 4.04Å; W1376-V1378 HydrophobicContact CD2-CG2 4.32Å; W1376-V1378 HydrophobicContact CE3-CG2 4.39Å; W1376-V1378 HydrophobicContact CH2-CB 4.19Å; W1376-V1378 HydrophobicContact CH2-CG1 4Å; W1376-V1378 HydrophobicContact CH2-CG2 3.98Å; W1376-V1378 HydrophobicContact CZ2-CG1 4.48Å; W1376-V1378 HydrophobicContact CZ2-CG2 3.87Å; W1376-V1378 HydrophobicContact CZ3-CB 4.28Å; W1376-V1378 HydrophobicContact CZ3-CG1 4.46Å; W1376-V1378 HydrophobicContact CZ3-CG2 4.23Å; W1376-V1378 PolarHBondContact O-N 3.13Å; W1376-F1383 WeakPolarHBondContact O-CA 3.31Å; W1376-Q1384 PolarHBondContact N-O 2.9Å; W1376-Q1384 PolarHBondContact O-N 3.15Å; W1376-I1421 HydrophobicContact CB-CG2 3.74Å; W1376-I1421 HydrophobicContact CD2-CG2 3.86Å; W1376-I1421 HydrophobicContact CE3-CG2 4.45Å; W1376-I1421 HydrophobicContact CG-CG2 3.54Å; W1376-M1424 HydrophobicContact CH2-CB 4.21Å; W1376-M1424 HydrophobicContact CZ2-CB 3.89Å; W1376-M1424 HydrophobicContact CZ2-CE 4.12Å; W1376-A1425 HydrophobicContact CE3-CB 4.15Å; W1376-A1425 HydrophobicContact CH2-CB 4.45Å; W1376-A1425 HydrophobicContact CZ3-CB 3.77Å; W1376-A1428 HydrophobicContact CH2-CB 4Å; W1376-A1428 HydrophobicContact CZ3-CB 4.44Å
1377	K	94.4	Very high	90.5	Very high	10 Å²	10	41.3 Å²	41.3	4%	0.043	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	105.8	-178.4	-169.6	-179.1	-168.8	-180	0	110.9	L1352 A1353 A1355 G1358 E1359 A1379 D1380 F1383	L1352-K1377 WeakPolarHBondContact O-CD 3.48Å; A1353-K1377 PolarHBondContact O-NZ 3.44Å; A1355-K1377 WeakPolarHBondContact O-CD 3.35Å; A1355-K1377 WeakPolarHBondContact O-CE 3.49Å; A1355-K1377 PolarHBondContact O-NZ 2.87Å; G1358-K1377 PolarHBondContact N-O 2.92Å; E1359-K1377 PolarHBondContact O-N 2.61Å; E1359-K1377 VanDerWaalsContact O-N 3.1Å; K1377-A1379 WeakPolarHBondContact CG-O 3.25Å; K1377-D1380 WeakPolarHBondContact CE-OD1 3.27Å; K1377-D1380 IonicContact NZ-OD1 2.71Å; K1377-D1380 PolarHBondContact NZ-OD1 3.41Å; K1377-F1383 HydrophobicContact CB-CD1 4.16Å; K1377-F1383 HydrophobicContact CB-CE1 4.15Å; K1377-F1383 HydrophobicContact CD-CE1 4.37Å; K1377-F1383 HydrophobicContact CG-CD1 4.22Å; K1377-F1383 HydrophobicContact CG-CE1 3.85Å
1378	V	93.7	Very high	91	Very high	2 Å²	2	34.8 Å²	34.8	1%	0.012	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	-47.1	-179.8	-171.2	0	0	0	0	110.6	Q1357 W1376 I1382 Q1384 A1428 I1432 P1478 F1481	Q1357-V1378 VanDerWaalsContact CG-O 3.31Å; Q1357-V1378 WeakPolarHBondContact CG-O 3.14Å; Q1357-V1378 PolarHBondContact NE2-O 3.5Å; W1376-V1378 HydrophobicContact CD2-CG2 4.32Å; W1376-V1378 HydrophobicContact CE3-CG2 4.39Å; W1376-V1378 HydrophobicContact CH2-CB 4.19Å; W1376-V1378 HydrophobicContact CH2-CG1 4Å; W1376-V1378 HydrophobicContact CH2-CG2 3.98Å; W1376-V1378 HydrophobicContact CZ2-CG1 4.48Å; W1376-V1378 HydrophobicContact CZ2-CG2 3.87Å; W1376-V1378 HydrophobicContact CZ3-CB 4.28Å; W1376-V1378 HydrophobicContact CZ3-CG1 4.46Å; W1376-V1378 HydrophobicContact CZ3-CG2 4.23Å; W1376-V1378 PolarHBondContact O-N 3.13Å; V1378-I1382 WeakPolarHBondContact CA-O 3.23Å; V1378-I1382 HydrophobicContact CB-CG2 4.15Å; V1378-I1382 VanDerWaalsContact CB-O 3.29Å; V1378-I1382 WeakPolarHBondContact CB-O 3.24Å; V1378-I1382 PolarHBondContact N-O 3.02Å; V1378-Q1384 HydrophobicContact CG2-CB 3.54Å; V1378-A1428 HydrophobicContact CG1-CB 4.18Å; V1378-I1432 VanDerWaalsContact O-CD1 3.32Å; V1378-I1432 WeakPolarHBondContact O-CD1 3.46Å; V1378-P1478 HydrophobicContact CG2-CB 4.35Å; V1378-F1481 HydrophobicContact CG1-CE2 4.25Å; V1378-F1481 HydrophobicContact CG1-CZ 4.44Å
1379	A	90.6	Very high	91.6	Very high	6 Å²	6	38 Å²	38	5%	0.05	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.8	177.8	174.2	0	0	0	0	0	107.8	K1377 D1381 I1382 I1432 A1473	K1377-A1379 WeakPolarHBondContact CG-O 3.25Å; A1379-D1381 PolarHBondContact O-N 3.5Å; A1379-I1382 HydrophobicContact CB-CB 4.38Å; A1379-I1382 PolarHBondContact N-O 3.39Å; A1379-I1382 PolarHBondContact O-N 3.38Å; A1379-I1382 VanDerWaalsContact O-N 3.12Å; A1379-I1432 HydrophobicContact CB-CD1 3.92Å; A1379-A1473 HydrophobicContact CB-CB 3.9Å
1380	D	88.8	Confident	92	Very high	119 Å²	119	32.8 Å²	32.8	64%	0.636	16%	0.162	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.1	136.1	174.6	-53.5	-57.9	0	0	0	111.3	K1377 I1382	K1377-D1380 WeakPolarHBondContact CE-OD1 3.27Å; K1377-D1380 IonicContact NZ-OD1 2.71Å; K1377-D1380 PolarHBondContact NZ-OD1 3.41Å; D1380-I1382 PolarHBondContact O-N 2.91Å
1381	D	86.2	Confident	92	Very high	110 Å²	110	32.8 Å²	32.8	59%	0.588	16%	0.159	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.9	17.4	-170.9	-59.3	-25.7	0	0	0	116.8	A1379	A1379-D1381 PolarHBondContact O-N 3.5Å
1382	I	91	Very high	91.7	Very high	7 Å²	7	33.7 Å²	33.7	4%	0.036	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	99.6	-179.1	-59.4	175	0	0	0	110.1	V1378 A1379 D1380 N1440 A1473 R1475 P1478	V1378-I1382 WeakPolarHBondContact CA-O 3.23Å; V1378-I1382 HydrophobicContact CB-CG2 4.15Å; V1378-I1382 VanDerWaalsContact CB-O 3.29Å; V1378-I1382 WeakPolarHBondContact CB-O 3.24Å; V1378-I1382 PolarHBondContact N-O 3.02Å; A1379-I1382 HydrophobicContact CB-CB 4.38Å; A1379-I1382 PolarHBondContact N-O 3.39Å; A1379-I1382 PolarHBondContact O-N 3.38Å; A1379-I1382 VanDerWaalsContact O-N 3.12Å; D1380-I1382 PolarHBondContact O-N 2.91Å; I1382-N1440 HydrophobicContact CD1-CB 4.43Å; I1382-A1473 HydrophobicContact CD1-CB 3.6Å; I1382-A1473 WeakPolarHBondContact CD1-O 3.46Å; I1382-R1475 HydrophobicContact CD1-CB 4.26Å; I1382-R1475 HydrophobicContact CG1-CB 4.3Å; I1382-R1475 HydrophobicContact CG1-CG 4.32Å; I1382-P1478 HydrophobicContact CG2-CB 3.95Å; I1382-P1478 HydrophobicContact CG2-CG 4.09Å
1383	F	92.7	Very high	91.2	Very high	18 Å²	18	36 Å²	36	8%	0.079	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	137	-179.8	-49.4	-78.1	0	0	0	110.9	V1349 L1352 A1353 T1375 W1376 K1377 P1478	V1349-F1383 HydrophobicContact CG1-CD2 4.01Å; V1349-F1383 HydrophobicContact CG1-CE2 3.75Å; V1349-F1383 HydrophobicContact CG1-CZ 4.47Å; V1349-F1383 HydrophobicContact CG2-CD2 4.15Å; L1352-F1383 HydrophobicContact CB-CD1 3.89Å; L1352-F1383 HydrophobicContact CB-CE1 3.61Å; L1352-F1383 HydrophobicContact CD1-CD1 4.44Å; L1352-F1383 WeakPolarHBondContact O-CE1 3.38Å; A1353-F1383 HydrophobicContact CB-CZ 4.5Å; T1375-F1383 HydrophobicContact CG2-CB 4.06Å; W1376-F1383 WeakPolarHBondContact O-CA 3.31Å; K1377-F1383 HydrophobicContact CB-CD1 4.16Å; K1377-F1383 HydrophobicContact CB-CE1 4.15Å; K1377-F1383 HydrophobicContact CD-CE1 4.37Å; K1377-F1383 HydrophobicContact CG-CD1 4.22Å; K1377-F1383 HydrophobicContact CG-CE1 3.85Å; F1383-P1478 WeakPolarHBondContact O-CB 3.49Å; F1383-P1478 WeakPolarHBondContact O-CG 3.27Å
1384	Q	93.8	Very high	90.5	Very high	40 Å²	40	42.4 Å²	42.4	19%	0.187	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	129.7	173.8	-178.9	177.8	3.3	0	0	110.2	T1375 W1376 V1378 I1386 P1478	T1375-Q1384 WeakPolarHBondContact CA-O 3.32Å; W1376-Q1384 PolarHBondContact N-O 2.9Å; W1376-Q1384 PolarHBondContact O-N 3.15Å; V1378-Q1384 HydrophobicContact CG2-CB 3.54Å; Q1384-I1386 HydrophobicContact CG-CG1 4.25Å; Q1384-P1478 HydrophobicContact CB-CB 3.84Å; Q1384-P1478 HydrophobicContact CG-CB 4.42Å
1385	H	92.8	Very high	89.8	Confident	73 Å²	73	45.7 Å²	45.7	34%	0.338	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	113.1	179.4	-49.6	-70	0	0	0	109.8	Y1345 T1373 T1375	Y1345-H1385 AromaticContact CD2-CE1 3.93Å; Y1345-H1385 AromaticContact CE2-CE1 3.5Å; Y1345-H1385 VanDerWaalsContact CE2-CE1 3.5Å; Y1345-H1385 WeakPolarHBondContact CE2-CE1 3.41Å; Y1345-H1385 AromaticContact CE2-NE2 3.46Å; Y1345-H1385 WeakPolarHBondContact CE2-NE2 3.33Å; T1373-H1385 HydrophobicContact CG2-CB 3.82Å; T1375-H1385 WeakPolarHBondContact CG2-CE1 3.5Å; T1375-H1385 WeakPolarHBondContact CG2-ND1 3.47Å; T1375-H1385 PolarHBondContact OG1-ND1 3.41Å
1386	I	92.6	Very high	89.1	Confident	15 Å²	15	49.3 Å²	49.3	8%	0.077	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	124	178.8	-54.7	179.3	0	0	0	107.9	T1373 A1374 Q1384 I1405 I1421	T1373-I1386 CarbonylContact C-O 3.47Å; T1373-I1386 WeakPolarHBondContact CA-O 3.48Å; A1374-I1386 HydrophobicContact CB-CB 4.38Å; A1374-I1386 PolarHBondContact N-O 2.87Å; A1374-I1386 PolarHBondContact O-N 3.03Å; Q1384-I1386 HydrophobicContact CG-CG1 4.25Å; I1386-I1405 HydrophobicContact CG2-CD1 4.09Å; I1386-I1405 HydrophobicContact CG2-CG1 4.29Å; I1386-I1405 HydrophobicContact CG2-CG2 3.62Å; I1386-I1421 HydrophobicContact CD1-CG1 4.23Å
1387	D	93.4	Very high	88.4	Confident	49 Å²	49	54.8 Å²	54.8	26%	0.262	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	120.5	178.6	-172.6	46.2	0	0	0	109.4	K1367 H1371	K1367-D1387 WeakPolarHBondContact CE-OD2 3.43Å; K1367-D1387 IonicContact NZ-OD1 3.7Å; K1367-D1387 IonicContact NZ-OD2 3.16Å; K1367-D1387 PolarHBondContact NZ-OD2 3.3Å; H1371-D1387 IonicContact CE1-OD1 2.7Å; H1371-D1387 IonicContact CE1-OD2 2.76Å; H1371-D1387 PolarHBondContact CE1-OD2 3.03Å; H1371-D1387 VanDerWaalsContact CE1-OD2 3.27Å; H1371-D1387 IonicContact CG-OD1 2.81Å; H1371-D1387 VanDerWaalsContact ND1-CG 3.25Å; H1371-D1387 IonicContact ND1-OD1 3.84Å; H1371-D1387 PolarHBondContact ND1-OD1 3.45Å; H1371-D1387 IonicContact ND1-OD2 2.7Å; H1371-D1387 PolarHBondContact ND1-OD2 3.37Å
1388	V	93.4	Very high	87.8	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	113.4	-178.8	-178.7	0	0	0	0	107.3	H1371 L1372 A1374 L1403 I1405 I1416	H1371-V1388 CarbonylContact C-O 3.44Å; H1371-V1388 WeakPolarHBondContact CA-O 3.46Å; L1372-V1388 HydrophobicContact CB-CB 4.26Å; L1372-V1388 PolarHBondContact N-O 3.41Å; L1372-V1388 PolarHBondContact O-N 3.49Å; A1374-V1388 HydrophobicContact CB-CG2 4.17Å; V1388-L1403 HydrophobicContact CG1-CB 4.05Å; V1388-I1405 HydrophobicContact CG2-CD1 4.12Å; V1388-I1405 HydrophobicContact CG2-CG1 4.06Å; V1388-I1416 HydrophobicContact CG1-CD1 3.64Å; V1388-I1416 HydrophobicContact CG2-CD1 4.23Å
1389	R	92.4	Very high	87.4	Confident	114 Å²	114	58.6 Å²	58.6	43%	0.43	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	131.5	-178.9	-179.8	169.3	175.6	-90.1	-14.1	110	E1391 W1404	R1389-E1391 IonicContact CZ-OE1 3.18Å; R1389-E1391 IonicContact NH1-OE1 2.71Å; R1389-E1391 PolarHBondContact NH1-OE1 3.11Å; R1389-E1391 IonicContact NH2-OE1 2.82Å; R1389-E1391 PolarHBondContact NH2-OE1 3.49Å; R1389-W1404 HydrophobicContact CB-CB 4.28Å; R1389-W1404 PolarHBondContact N-O 2.89Å; R1389-W1404 PolarHBondContact O-N 3.43Å
1390	E	90.4	Very high	87.2	Confident	5 Å²	5	58.6 Å²	58.6	2%	0.023	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	132.6	-175.7	-60.2	165.7	88.6	0	0	110.5	R1333 D1370 H1371 L1372 K1393 G1400 L1403	R1333-E1390 IonicContact CZ-OE1 3.01Å; R1333-E1390 IonicContact CZ-OE2 3.76Å; R1333-E1390 IonicContact NH1-OE1 3.72Å; R1333-E1390 PolarHBondContact NH1-OE1 3.02Å; R1333-E1390 IonicContact NH1-OE2 3.1Å; R1333-E1390 PolarHBondContact NH1-OE2 2.85Å; R1333-E1390 IonicContact NH2-OE1 3.66Å; R1333-E1390 IonicContact NH2-OE2 2.72Å; R1333-E1390 PolarHBondContact NH2-OE2 3.36Å; D1370-E1390 PolarHBondContact O-N 3.23Å; H1371-E1390 PolarHBondContact N-OE2 2.61Å; L1372-E1390 HydrophobicContact CG-CG 4.24Å; E1390-K1393 VanDerWaalsContact CB-CE 3.42Å; E1390-K1393 VanDerWaalsContact CD-CE 3.44Å; E1390-K1393 VanDerWaalsContact OE1-CE 3.32Å; E1390-K1393 WeakPolarHBondContact OE1-CE 3.35Å; E1390-K1393 IonicContact OE1-NZ 3.27Å; E1390-K1393 PolarHBondContact OE1-NZ 3.16Å; E1390-K1393 IonicContact OE2-NZ 2.68Å; E1390-K1393 PolarHBondContact OE2-NZ 3.35Å; E1390-G1400 PolarHBondContact OE1-N 2.9Å; E1390-L1403 HydrophobicContact CB-CD2 4.34Å; E1390-L1403 HydrophobicContact CG-CD2 3.78Å
1391	E	88.5	Confident	87	Confident	81 Å²	81	61.8 Å²	61.8	38%	0.379	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	159.4	169.2	-62.8	-164.7	173.7	0	0	112.1	R1389 G1400 R1401 S1402	R1389-E1391 IonicContact CZ-OE1 3.18Å; R1389-E1391 IonicContact NH1-OE1 2.71Å; R1389-E1391 PolarHBondContact NH1-OE1 3.11Å; R1389-E1391 IonicContact NH2-OE1 2.82Å; R1389-E1391 PolarHBondContact NH2-OE1 3.49Å; E1391-G1400 CarbonylContact O-C 3.53Å; E1391-G1400 WeakPolarHBondContact O-CA 3.37Å; E1391-R1401 PolarHBondContact O-N 3.04Å; E1391-S1402 PolarHBondContact N-O 3.2Å; E1391-S1402 PolarHBondContact O-N 3.37Å
1392	G	84	Confident	87.1	Confident	49 Å²	49	57.4 Å²	57.4	51%	0.505	28%	0.282	S	S	.	.	S	Bend	trans	73.9	40.1	172.9	0	0	0	0	0	115.9	R1401	G1392-R1401 WeakPolarHBondContact O-CD 3.44Å; G1392-R1401 VanDerWaalsContact O-CG 3.25Å; G1392-R1401 WeakPolarHBondContact O-CG 3.44Å
1393	K	79.8	Confident	87.1	Confident	49 Å²	49	57 Å²	57	21%	0.213	28%	0.28	C	S	.	.			trans	-76.1	151.7	179.3	-60.7	-174.8	-178.7	-157.1	0	113.5	R1333 K1369 E1390	R1333-K1393 VanDerWaalsContact CZ-NZ 3.33Å; K1369-K1393 PolarHBondContact O-NZ 3.39Å; E1390-K1393 VanDerWaalsContact CB-CE 3.42Å; E1390-K1393 VanDerWaalsContact CD-CE 3.44Å; E1390-K1393 VanDerWaalsContact OE1-CE 3.32Å; E1390-K1393 WeakPolarHBondContact OE1-CE 3.35Å; E1390-K1393 IonicContact OE1-NZ 3.27Å; E1390-K1393 PolarHBondContact OE1-NZ 3.16Å; E1390-K1393 IonicContact OE2-NZ 2.68Å; E1390-K1393 PolarHBondContact OE2-NZ 3.35Å
1394	E	78.6	Confident	87.1	Confident	144 Å²	144	59.6 Å²	59.6	67%	0.673	29%	0.29	S	S	*	.	S	Bend	trans	-93.5	-25.6	172.6	-61.4	-174.3	179	0	0	112.9	R1401	E1394-R1401 IonicContact OE1-CZ 3.04Å; E1394-R1401 IonicContact OE1-NE 3.03Å; E1394-R1401 PolarHBondContact OE1-NE 3.34Å; E1394-R1401 IonicContact OE1-NH2 3.89Å; E1394-R1401 PolarHBondContact OE1-NH2 3.35Å
1395	N	79.9	Confident	87	Confident	68 Å²	68	58.4 Å²	58.4	36%	0.364	28%	0.284	S	S	.	.	S	Bend	trans	-157.5	169.8	171.1	65.5	72.1	0	0	0	110.3	F1397 S1398	N1395-F1397 PolarHBondContact O-N 3.2Å; N1395-F1397 WeakPolarHBondContact OD1-CA 3.31Å; N1395-F1397 WeakPolarHBondContact OD1-CB 3.22Å; N1395-F1397 PolarHBondContact OD1-N 2.64Å; N1395-S1398 PolarHBondContact ND2-OG 3.15Å; N1395-S1398 PolarHBondContact OD1-N 2.67Å; N1395-S1398 PolarHBondContact OD1-OG 3.4Å
1396	D	79	Confident	86.6	Confident	76 Å²	76	58.7 Å²	58.7	41%	0.406	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-20.8	-178.3	-77.4	8.1	0	0	0	115.1	R1333 K1369	R1333-D1396 WeakPolarHBondContact CD-O 3.44Å; K1369-D1396 WeakPolarHBondContact CD-OD2 3.3Å; K1369-D1396 WeakPolarHBondContact CE-OD2 3.45Å; K1369-D1396 IonicContact NZ-OD2 2.8Å; K1369-D1396 PolarHBondContact NZ-OD2 3.38Å
1397	F	80.3	Confident	86.3	Confident	115 Å²	115	64.4 Å²	64.4	50%	0.504	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98	-22.6	-171.5	-54.2	-79.7	0	0	0	113.5	R1332 R1333 V1334 N1395	R1332-F1397 WeakPolarHBondContact O-CD1 3.39Å; R1333-F1397 WeakPolarHBondContact CB-O 3.36Å; V1334-F1397 PolarHBondContact N-O 3.43Å; N1395-F1397 PolarHBondContact O-N 3.2Å; N1395-F1397 WeakPolarHBondContact OD1-CA 3.31Å; N1395-F1397 WeakPolarHBondContact OD1-CB 3.22Å; N1395-F1397 PolarHBondContact OD1-N 2.64Å
1398	S	82.1	Confident	86	Confident	41 Å²	41	65.2 Å²	65.2	29%	0.287	35%	0.345	S	S	.	.	S	Bend	trans	-81.2	169.7	179.3	-63.6	0	0	0	0	113.2	R1333 N1395	R1333-S1398 PolarHBondContact NH1-O 2.88Å; R1333-S1398 VanDerWaalsContact NH1-O 3.15Å; N1395-S1398 PolarHBondContact ND2-OG 3.15Å; N1395-S1398 PolarHBondContact OD1-N 2.67Å; N1395-S1398 PolarHBondContact OD1-OG 3.4Å
1399	L	86.2	Confident	85.9	Confident	51 Å²	51	70.2 Å²	70.2	27%	0.267	37%	0.369	S	S	.	.	P	Polyproline II helix	trans	-75	153.1	169.2	-170.7	64.5	0	0	0	110.5	I1335 L1372 L1403 L1413	I1335-L1399 HydrophobicContact CD1-CB 4.3Å; I1335-L1399 HydrophobicContact CD1-CD1 4.18Å; I1335-L1399 HydrophobicContact CG1-CB 4.26Å; L1372-L1399 HydrophobicContact CD1-CD1 3.65Å; L1399-L1403 HydrophobicContact CD1-CD1 4.3Å; L1399-L1403 HydrophobicContact CD1-CD2 3.81Å; L1399-L1403 HydrophobicContact CD2-CD1 4.4Å; L1399-L1403 HydrophobicContact CG-CD2 4.18Å; L1399-L1413 HydrophobicContact CD1-CD1 4.17Å; L1399-L1413 HydrophobicContact CD1-CD2 4.16Å; L1399-L1413 HydrophobicContact CD1-CG 4.25Å; L1399-L1413 HydrophobicContact CD2-CD1 4.05Å; L1399-L1413 HydrophobicContact CD2-CG 4.02Å
1400	G	85.1	Confident	85.9	Confident	7 Å²	7	64.9 Å²	64.9	7%	0.072	35%	0.348	C	S	.	.	P	Polyproline II helix	trans	-69.5	158.6	169	0	0	0	0	0	113.4	E1390 E1391	E1390-G1400 PolarHBondContact OE1-N 2.9Å; E1391-G1400 CarbonylContact O-C 3.53Å; E1391-G1400 WeakPolarHBondContact O-CA 3.37Å
1401	R	85.9	Confident	85.6	Confident	185 Å²	185	72.7 Å²	72.7	70%	0.698	39%	0.385	S	S	*	.	S	Bend	trans	-81.1	-13	174.4	-75	177.4	177.4	-159.9	2.3	113.8	E1391 G1392 E1394	E1391-R1401 PolarHBondContact O-N 3.04Å; G1392-R1401 WeakPolarHBondContact O-CD 3.44Å; G1392-R1401 VanDerWaalsContact O-CG 3.25Å; G1392-R1401 WeakPolarHBondContact O-CG 3.44Å; E1394-R1401 IonicContact OE1-CZ 3.04Å; E1394-R1401 IonicContact OE1-NE 3.03Å; E1394-R1401 PolarHBondContact OE1-NE 3.34Å; E1394-R1401 IonicContact OE1-NH2 3.89Å; E1394-R1401 PolarHBondContact OE1-NH2 3.35Å
1402	S	86.7	Confident	85.7	Confident	18 Å²	18	72.2 Å²	72.2	13%	0.126	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	138.3	169.4	57.1	0	0	0	0	109.2	E1391 W1404 E1409	E1391-S1402 PolarHBondContact N-O 3.2Å; E1391-S1402 PolarHBondContact O-N 3.37Å; S1402-W1404 PolarHBondContact OG-NE1 3.13Å; S1402-E1409 VanDerWaalsContact CB-OE1 3.22Å; S1402-E1409 WeakPolarHBondContact CB-OE1 3.45Å
1403	L	91.7	Very high	86.1	Confident	0 Å²	0	70 Å²	70	0%	0	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	131.9	-177.3	-54.3	178.4	0	0	0	109.6	V1388 E1390 L1399 E1409 F1410 L1413 I1416	V1388-L1403 HydrophobicContact CG1-CB 4.05Å; E1390-L1403 HydrophobicContact CB-CD2 4.34Å; E1390-L1403 HydrophobicContact CG-CD2 3.78Å; L1399-L1403 HydrophobicContact CD1-CD1 4.3Å; L1399-L1403 HydrophobicContact CD1-CD2 3.81Å; L1399-L1403 HydrophobicContact CD2-CD1 4.4Å; L1399-L1403 HydrophobicContact CG-CD2 4.18Å; L1403-E1409 CarbonylContact O-C 3.49Å; L1403-E1409 WeakPolarHBondContact O-CA 3.48Å; L1403-F1410 HydrophobicContact CB-CB 4.34Å; L1403-F1410 PolarHBondContact N-O 3.08Å; L1403-F1410 VanDerWaalsContact N-O 3.12Å; L1403-F1410 PolarHBondContact O-N 3.25Å; L1403-L1413 HydrophobicContact CD1-CD2 3.79Å; L1403-L1413 HydrophobicContact CD1-CG 4.18Å; L1403-I1416 HydrophobicContact CB-CD1 3.92Å; L1403-I1416 HydrophobicContact CD1-CD1 3.9Å
1404	W	91.9	Very high	86.7	Confident	71 Å²	71	71.7 Å²	71.7	27%	0.269	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	126.3	-169.2	-66.1	82.6	0	0	0	111.9	R1389 S1402 E1408 E1409	R1389-W1404 HydrophobicContact CB-CB 4.28Å; R1389-W1404 PolarHBondContact N-O 2.89Å; R1389-W1404 PolarHBondContact O-N 3.43Å; S1402-W1404 PolarHBondContact OG-NE1 3.13Å; W1404-E1408 WeakPolarHBondContact CA-O 3.43Å; W1404-E1409 HydrophobicContact CD2-CB 4.26Å; W1404-E1409 HydrophobicContact CD2-CG 4.38Å; W1404-E1409 HydrophobicContact CE3-CB 4.07Å; W1404-E1409 HydrophobicContact CH2-CB 3.76Å; W1404-E1409 HydrophobicContact CH2-CG 4.04Å; W1404-E1409 HydrophobicContact CZ2-CB 3.94Å; W1404-E1409 HydrophobicContact CZ2-CG 3.71Å; W1404-E1409 WeakPolarHBondContact CZ2-OE1 3.27Å; W1404-E1409 HydrophobicContact CZ3-CB 3.83Å
1405	I	91.3	Very high	87.3	Confident	15 Å²	15	67.4 Å²	67.4	8%	0.077	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	105.7	169.4	-58.1	175.1	0	0	0	108	I1386 V1388 T1407 E1408 F1410 I1416	I1386-I1405 HydrophobicContact CG2-CD1 4.09Å; I1386-I1405 HydrophobicContact CG2-CG1 4.29Å; I1386-I1405 HydrophobicContact CG2-CG2 3.62Å; V1388-I1405 HydrophobicContact CG2-CD1 4.12Å; V1388-I1405 HydrophobicContact CG2-CG1 4.06Å; I1405-T1407 PolarHBondContact O-N 2.97Å; I1405-E1408 PolarHBondContact N-O 2.71Å; I1405-E1408 PolarHBondContact O-N 3.09Å; I1405-E1408 VanDerWaalsContact O-N 3.07Å; I1405-F1410 HydrophobicContact CB-CE2 3.82Å; I1405-F1410 HydrophobicContact CB-CZ 4.49Å; I1405-F1410 HydrophobicContact CD1-CD2 4.45Å; I1405-F1410 HydrophobicContact CD1-CE2 4Å; I1405-F1410 HydrophobicContact CD1-CZ 4.19Å; I1405-F1410 HydrophobicContact CG1-CD2 4.36Å; I1405-F1410 HydrophobicContact CG1-CE2 3.99Å; I1405-I1416 HydrophobicContact CD1-CB 4.35Å; I1405-I1416 HydrophobicContact CD1-CD1 4.13Å; I1405-I1416 HydrophobicContact CD1-CG1 3.92Å; I1405-I1416 HydrophobicContact CD1-CG2 3.65Å
1406	G	85.4	Confident	87.9	Confident	80 Å²	80	64.1 Å²	64.1	83%	0.825	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.3	-100.2	-176.3	0	0	0	0	0	112.3
1407	T	86.8	Confident	88.5	Confident	134 Å²	134	61.5 Å²	61.5	82%	0.822	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120.2	5.8	177.3	54.6	0	0	0	0	113.1	I1405	I1405-T1407 PolarHBondContact O-N 2.97Å
1408	E	87.3	Confident	89.1	Confident	66 Å²	66	58.8 Å²	58.8	31%	0.308	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	131.7	177.8	-69.9	172.2	-142	0	0	110.1	W1404 I1405 F1410 R1419	W1404-E1408 WeakPolarHBondContact CA-O 3.43Å; I1405-E1408 PolarHBondContact N-O 2.71Å; I1405-E1408 PolarHBondContact O-N 3.09Å; I1405-E1408 VanDerWaalsContact O-N 3.07Å; E1408-F1410 HydrophobicContact CB-CD2 4.45Å; E1408-F1410 HydrophobicContact CB-CE2 3.61Å; E1408-F1410 HydrophobicContact CB-CZ 4.11Å; E1408-R1419 IonicContact OE2-CZ 2.76Å; E1408-R1419 IonicContact OE2-NH1 3.18Å; E1408-R1419 PolarHBondContact OE2-NH1 3.3Å
1409	E	91.5	Very high	89.6	Confident	105 Å²	105	61.4 Å²	61.4	49%	0.491	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	148.1	170.8	-168.4	168.3	-158.2	0	0	109.5	S1402 L1403 W1404 R1419	S1402-E1409 VanDerWaalsContact CB-OE1 3.22Å; S1402-E1409 WeakPolarHBondContact CB-OE1 3.45Å; L1403-E1409 CarbonylContact O-C 3.49Å; L1403-E1409 WeakPolarHBondContact O-CA 3.48Å; W1404-E1409 HydrophobicContact CD2-CB 4.26Å; W1404-E1409 HydrophobicContact CD2-CG 4.38Å; W1404-E1409 HydrophobicContact CE3-CB 4.07Å; W1404-E1409 HydrophobicContact CH2-CB 3.76Å; W1404-E1409 HydrophobicContact CH2-CG 4.04Å; W1404-E1409 HydrophobicContact CZ2-CB 3.94Å; W1404-E1409 HydrophobicContact CZ2-CG 3.71Å; W1404-E1409 WeakPolarHBondContact CZ2-OE1 3.27Å; W1404-E1409 HydrophobicContact CZ3-CB 3.83Å; E1409-R1419 PolarHBondContact O-NH2 3.3Å
1410	F	90.9	Very high	89.9	Confident	2 Å²	2	60 Å²	60	1%	0.009	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	141.2	178.1	-61	-106.2	0	0	0	108.8	L1403 I1405 E1408 E1415 I1416 R1419 H1420	L1403-F1410 HydrophobicContact CB-CB 4.34Å; L1403-F1410 PolarHBondContact N-O 3.08Å; L1403-F1410 VanDerWaalsContact N-O 3.12Å; L1403-F1410 PolarHBondContact O-N 3.25Å; I1405-F1410 HydrophobicContact CB-CE2 3.82Å; I1405-F1410 HydrophobicContact CB-CZ 4.49Å; I1405-F1410 HydrophobicContact CD1-CD2 4.45Å; I1405-F1410 HydrophobicContact CD1-CE2 4Å; I1405-F1410 HydrophobicContact CD1-CZ 4.19Å; I1405-F1410 HydrophobicContact CG1-CD2 4.36Å; I1405-F1410 HydrophobicContact CG1-CE2 3.99Å; E1408-F1410 HydrophobicContact CB-CD2 4.45Å; E1408-F1410 HydrophobicContact CB-CE2 3.61Å; E1408-F1410 HydrophobicContact CB-CZ 4.11Å; F1410-E1415 VanDerWaalsContact CA-OE2 3.24Å; F1410-E1415 WeakPolarHBondContact CA-OE2 3.25Å; F1410-E1415 HydrophobicContact CD1-CB 4.33Å; F1410-E1415 HydrophobicContact CD1-CG 4.18Å; F1410-I1416 HydrophobicContact CB-CD1 4.23Å; F1410-I1416 HydrophobicContact CB-CG1 3.67Å; F1410-I1416 HydrophobicContact CD1-CB 4.26Å; F1410-I1416 HydrophobicContact CD1-CG1 3.54Å; F1410-I1416 HydrophobicContact CD2-CG1 4.02Å; F1410-I1416 HydrophobicContact CE1-CG1 4.15Å; F1410-I1416 HydrophobicContact CG-CD1 4.34Å; F1410-I1416 HydrophobicContact CG-CG1 3.47Å; F1410-I1416 VanDerWaalsContact CG-CG1 3.47Å; F1410-R1419 HydrophobicContact CE1-CB 4.31Å; F1410-H1420 HydrophobicContact CE1-CB 4.01Å; F1410-H1420 HydrophobicContact CZ-CB 3.97Å
1411	E	85.6	Confident	90.3	Very high	170 Å²	170	59.8 Å²	59.8	79%	0.794	31%	0.313	S	S	*	.	S	Bend	trans	-74.6	-39.7	-178.6	-62.9	-172.5	175.2	0	0	111.7	E1415	E1411-E1415 PolarHBondContact N-OE2 3.11Å
1412	D	89.9	Confident	90.6	Very high	71 Å²	71	55.8 Å²	55.8	38%	0.38	30%	0.303	S	S	.	.	S	Bend	trans	-148.3	-175.4	179.8	71.3	36.7	0	0	0	114.3	D1414 E1415 I1416	D1412-D1414 WeakPolarHBondContact OD1-CA 3.43Å; D1412-D1414 PolarHBondContact OD1-N 2.98Å; D1412-E1415 PolarHBondContact OD1-N 3.49Å; D1412-I1416 PolarHBondContact O-N 3.47Å
1413	L	92.3	Very high	90.9	Very high	3 Å²	3	56.8 Å²	56.8	2%	0.016	31%	0.309	C	S	.	.	H	α-helix	trans	-76.4	-27	-177.7	-65.7	173.8	0	0	0	113.5	I1335 H1337 L1362 L1372 L1399 L1403 I1416 I1417	I1335-L1413 HydrophobicContact CG2-CD1 3.85Å; H1337-L1413 HydrophobicContact CB-CD1 3.8Å; L1362-L1413 HydrophobicContact CD1-CB 3.89Å; L1362-L1413 HydrophobicContact CD1-CD1 4.23Å; L1362-L1413 HydrophobicContact CD1-CD2 3.94Å; L1362-L1413 HydrophobicContact CD1-CG 4.23Å; L1362-L1413 HydrophobicContact CD2-CD2 4.02Å; L1372-L1413 HydrophobicContact CD1-CD2 4.1Å; L1399-L1413 HydrophobicContact CD1-CD1 4.17Å; L1399-L1413 HydrophobicContact CD1-CD2 4.16Å; L1399-L1413 HydrophobicContact CD1-CG 4.25Å; L1399-L1413 HydrophobicContact CD2-CD1 4.05Å; L1399-L1413 HydrophobicContact CD2-CG 4.02Å; L1403-L1413 HydrophobicContact CD1-CD2 3.79Å; L1403-L1413 HydrophobicContact CD1-CG 4.18Å; L1413-I1416 HydrophobicContact CD2-CD1 4.5Å; L1413-I1417 WeakPolarHBondContact O-CG1 3.4Å; L1413-I1417 PolarHBondContact O-N 3Å
1414	D	91.3	Very high	91	Very high	84 Å²	84	57 Å²	57	45%	0.449	31%	0.311	S	S	.	.	H	α-helix	trans	-77.1	-34.3	176.7	-73.9	-50.7	0	0	0	110.9	H1337 D1412 I1416 I1417 A1418	H1337-D1414 IonicContact CD2-OD1 2.68Å; H1337-D1414 IonicContact CD2-OD2 3.42Å; H1337-D1414 IonicContact CE1-OD1 3.78Å; H1337-D1414 WeakPolarHBondContact NE2-CB 3.09Å; H1337-D1414 PolarHBondContact NE2-N 3.02Å; H1337-D1414 CovalentContact NE2-OD1 1.78Å; H1337-D1414 IonicContact NE2-OD1 2.67Å; H1337-D1414 PolarHBondContact NE2-OD1 3.47Å; H1337-D1414 IonicContact NE2-OD2 2.71Å; H1337-D1414 PolarHBondContact NE2-OD2 3.21Å; D1412-D1414 WeakPolarHBondContact OD1-CA 3.43Å; D1412-D1414 PolarHBondContact OD1-N 2.98Å; D1414-I1416 VanDerWaalsContact C-N 3.34Å; D1414-I1416 PolarHBondContact O-N 2.94Å; D1414-I1417 PolarHBondContact O-N 3.4Å; D1414-A1418 VanDerWaalsContact O-CB 3.29Å; D1414-A1418 WeakPolarHBondContact O-CB 3.4Å; D1414-A1418 PolarHBondContact O-N 3.36Å
1415	E	91.8	Very high	91.1	Very high	53 Å²	53	54 Å²	54	25%	0.248	30%	0.3	C	S	.	.	H	α-helix	trans	-62.4	-40.7	171.5	-159.1	-150.4	146.4	0	0	111.6	F1410 E1411 D1412 I1417 A1418 R1419	F1410-E1415 VanDerWaalsContact CA-OE2 3.24Å; F1410-E1415 WeakPolarHBondContact CA-OE2 3.25Å; F1410-E1415 HydrophobicContact CD1-CB 4.33Å; F1410-E1415 HydrophobicContact CD1-CG 4.18Å; E1411-E1415 PolarHBondContact N-OE2 3.11Å; D1412-E1415 PolarHBondContact OD1-N 3.49Å; E1415-I1417 VanDerWaalsContact C-N 3.34Å; E1415-I1417 PolarHBondContact O-N 2.92Å; E1415-A1418 PolarHBondContact O-N 3.44Å; E1415-R1419 HydrophobicContact CG-CB 4.46Å; E1415-R1419 VanDerWaalsContact O-CB 3.26Å; E1415-R1419 WeakPolarHBondContact O-CB 3.49Å; E1415-R1419 PolarHBondContact O-N 2.83Å; E1415-R1419 IonicContact OE1-CZ 2.82Å; E1415-R1419 IonicContact OE1-NE 3.17Å; E1415-R1419 PolarHBondContact OE1-NE 3.29Å; E1415-R1419 IonicContact OE1-NH2 2.67Å; E1415-R1419 PolarHBondContact OE1-NH2 3.04Å
1416	I	92.5	Very high	91.2	Very high	0 Å²	0	58.3 Å²	58.3	0%	0	32%	0.323	C	S	.	.	I	π-helix	trans	-58.3	-47	173.4	-74.2	171.9	0	0	0	110.8	V1388 L1403 I1405 F1410 D1412 L1413 D1414 H1420 I1421	V1388-I1416 HydrophobicContact CG1-CD1 3.64Å; V1388-I1416 HydrophobicContact CG2-CD1 4.23Å; L1403-I1416 HydrophobicContact CB-CD1 3.92Å; L1403-I1416 HydrophobicContact CD1-CD1 3.9Å; I1405-I1416 HydrophobicContact CD1-CB 4.35Å; I1405-I1416 HydrophobicContact CD1-CD1 4.13Å; I1405-I1416 HydrophobicContact CD1-CG1 3.92Å; I1405-I1416 HydrophobicContact CD1-CG2 3.65Å; F1410-I1416 HydrophobicContact CB-CD1 4.23Å; F1410-I1416 HydrophobicContact CB-CG1 3.67Å; F1410-I1416 HydrophobicContact CD1-CB 4.26Å; F1410-I1416 HydrophobicContact CD1-CG1 3.54Å; F1410-I1416 HydrophobicContact CD2-CG1 4.02Å; F1410-I1416 HydrophobicContact CE1-CG1 4.15Å; F1410-I1416 HydrophobicContact CG-CD1 4.34Å; F1410-I1416 HydrophobicContact CG-CG1 3.47Å; F1410-I1416 VanDerWaalsContact CG-CG1 3.47Å; D1412-I1416 PolarHBondContact O-N 3.47Å; L1413-I1416 HydrophobicContact CD2-CD1 4.5Å; D1414-I1416 VanDerWaalsContact C-N 3.34Å; D1414-I1416 PolarHBondContact O-N 2.94Å; I1416-H1420 VanDerWaalsContact O-CB 3.29Å; I1416-H1420 WeakPolarHBondContact O-CB 3.16Å; I1416-H1420 PolarHBondContact O-N 3.16Å; I1416-H1420 VanDerWaalsContact O-N 3.12Å; I1416-I1421 HydrophobicContact CG2-CD1 3.96Å; I1416-I1421 HydrophobicContact CG2-CG1 4.42Å; I1416-I1421 PolarHBondContact O-N 3.4Å
1417	I	92.8	Very high	91.6	Very high	20 Å²	20	54.9 Å²	54.9	10%	0.103	29%	0.287	C	S	.	.	I	π-helix	trans	-64.2	-50.5	179.2	-67.7	166.7	0	0	0	110	H1337 V1360 L1362 L1413 D1414 E1415 I1421 M1422	H1337-I1417 WeakPolarHBondContact CE1-CD1 3.47Å; V1360-I1417 HydrophobicContact CB-CG1 4.49Å; V1360-I1417 HydrophobicContact CG1-CG1 4.2Å; V1360-I1417 HydrophobicContact CG2-CG2 4.42Å; L1362-I1417 HydrophobicContact CD1-CD1 4.14Å; L1413-I1417 WeakPolarHBondContact O-CG1 3.4Å; L1413-I1417 PolarHBondContact O-N 3Å; D1414-I1417 PolarHBondContact O-N 3.4Å; E1415-I1417 VanDerWaalsContact C-N 3.34Å; E1415-I1417 PolarHBondContact O-N 2.92Å; I1417-I1421 PolarHBondContact O-N 3.39Å; I1417-M1422 HydrophobicContact CG2-CG 4.04Å; I1417-M1422 HydrophobicContact CG2-SD 4.14Å; I1417-M1422 WeakPolarHBondContact O-CB 3.17Å; I1417-M1422 WeakPolarHBondContact O-CG 3.33Å; I1417-M1422 PolarHBondContact O-N 3.43Å
1418	A	92.2	Very high	91.9	Very high	58 Å²	58	48.5 Å²	48.5	48%	0.479	25%	0.248	S	C	.	.	I	π-helix	trans	-73.6	-39.8	-173	0	0	0	0	0	114.4	D1414 E1415 P1423	D1414-A1418 VanDerWaalsContact O-CB 3.29Å; D1414-A1418 WeakPolarHBondContact O-CB 3.4Å; D1414-A1418 PolarHBondContact O-N 3.36Å; E1415-A1418 PolarHBondContact O-N 3.44Å; A1418-P1423 WeakPolarHBondContact O-CD 3.35Å
1419	R	92.6	Very high	92.2	Very high	96 Å²	96	49.9 Å²	49.9	36%	0.362	25%	0.25	S	S	.	.	I	π-helix	trans	-92.6	-28.5	-175.1	-172.7	167.8	63	75.6	-6.8	113.8	E1408 E1409 F1410 E1415	E1408-R1419 IonicContact OE2-CZ 2.76Å; E1408-R1419 IonicContact OE2-NH1 3.18Å; E1408-R1419 PolarHBondContact OE2-NH1 3.3Å; E1409-R1419 PolarHBondContact O-NH2 3.3Å; F1410-R1419 HydrophobicContact CE1-CB 4.31Å; E1415-R1419 HydrophobicContact CG-CB 4.46Å; E1415-R1419 VanDerWaalsContact O-CB 3.26Å; E1415-R1419 WeakPolarHBondContact O-CB 3.49Å; E1415-R1419 PolarHBondContact O-N 2.83Å; E1415-R1419 IonicContact OE1-CZ 2.82Å; E1415-R1419 IonicContact OE1-NE 3.17Å; E1415-R1419 PolarHBondContact OE1-NE 3.29Å; E1415-R1419 IonicContact OE1-NH2 2.67Å; E1415-R1419 PolarHBondContact OE1-NH2 3.04Å
1420	H	92.1	Very high	92.3	Very high	23 Å²	23	47.8 Å²	47.8	11%	0.106	24%	0.241	C	C	.	.	I	π-helix	trans	-108.6	-53.6	-177.1	-159.1	88.8	0	0	0	112.5	F1410 I1416 M1424	F1410-H1420 HydrophobicContact CE1-CB 4.01Å; F1410-H1420 HydrophobicContact CZ-CB 3.97Å; I1416-H1420 VanDerWaalsContact O-CB 3.29Å; I1416-H1420 WeakPolarHBondContact O-CB 3.16Å; I1416-H1420 PolarHBondContact O-N 3.16Å; I1416-H1420 VanDerWaalsContact O-N 3.12Å; H1420-M1424 WeakPolarHBondContact O-CG 3.46Å
1421	I	93.2	Very high	92.3	Very high	1 Å²	1	47.7 Å²	47.7	1%	0.005	24%	0.24	C	C	.	.	I	π-helix	trans	-82.6	-46.2	-168.2	-54.7	174.9	0	0	0	112.5	V1360 A1374 W1376 I1386 I1416 I1417 M1424 A1425	V1360-I1421 HydrophobicContact CG1-CD1 3.73Å; V1360-I1421 HydrophobicContact CG2-CB 4.37Å; V1360-I1421 HydrophobicContact CG2-CD1 4.4Å; V1360-I1421 HydrophobicContact CG2-CG2 3.63Å; A1374-I1421 HydrophobicContact CB-CD1 3.8Å; W1376-I1421 HydrophobicContact CB-CG2 3.74Å; W1376-I1421 HydrophobicContact CD2-CG2 3.86Å; W1376-I1421 HydrophobicContact CE3-CG2 4.45Å; W1376-I1421 HydrophobicContact CG-CG2 3.54Å; I1386-I1421 HydrophobicContact CD1-CG1 4.23Å; I1416-I1421 HydrophobicContact CG2-CD1 3.96Å; I1416-I1421 HydrophobicContact CG2-CG1 4.42Å; I1416-I1421 PolarHBondContact O-N 3.4Å; I1417-I1421 PolarHBondContact O-N 3.39Å; I1421-M1424 CarbonylContact O-C 3.51Å; I1421-M1424 WeakPolarHBondContact O-CB 3.36Å; I1421-M1424 PolarHBondContact O-N 3.01Å; I1421-M1424 VanDerWaalsContact O-N 3.15Å; I1421-A1425 WeakPolarHBondContact O-CB 3.2Å; I1421-A1425 PolarHBondContact O-N 2.94Å
1422	M	93.2	Very high	92.7	Very high	101 Å²	101	41.9 Å²	41.9	50%	0.498	21%	0.214	S	C	.	.	H	α-helix	trans	-59.3	-42.3	-179.7	-74.7	178.6	70.6	0	0	113.5	I1417 M1424 A1425 L1426	I1417-M1422 HydrophobicContact CG2-CG 4.04Å; I1417-M1422 HydrophobicContact CG2-SD 4.14Å; I1417-M1422 WeakPolarHBondContact O-CB 3.17Å; I1417-M1422 WeakPolarHBondContact O-CG 3.33Å; I1417-M1422 PolarHBondContact O-N 3.43Å; M1422-M1424 PolarHBondContact O-N 3.42Å; M1422-A1425 PolarHBondContact O-N 3.09Å; M1422-L1426 WeakPolarHBondContact O-CG 3.36Å; M1422-L1426 PolarHBondContact O-N 3.33Å
1423	P	93	Very high	92.8	Very high	39 Å²	39	45.7 Å²	45.7	25%	0.253	23%	0.229	S	C	.	.	H	α-helix	trans	-62.8	-40.1	173.9	-24.7	36.7	0	0	0	112.7	A1418 L1426 A1427 P1500	A1418-P1423 WeakPolarHBondContact O-CD 3.35Å; P1423-L1426 PolarHBondContact O-N 2.97Å; P1423-A1427 WeakPolarHBondContact O-CB 3.46Å; P1423-A1427 PolarHBondContact O-N 2.97Å; P1423-P1500 HydrophobicContact CB-CB 4.4Å; P1423-P1500 WeakPolarHBondContact CB-O 3.35Å
1424	M	94.1	Very high	92.8	Very high	6 Å²	6	47.3 Å²	47.3	3%	0.03	24%	0.236	C	C	.	.	H	α-helix	trans	-64.8	-39.4	173.9	-70.4	176.7	62.7	0	0	112.1	W1376 H1420 I1421 M1422 A1427 A1428 V1498 M1499 P1500	W1376-M1424 HydrophobicContact CH2-CB 4.21Å; W1376-M1424 HydrophobicContact CZ2-CB 3.89Å; W1376-M1424 HydrophobicContact CZ2-CE 4.12Å; H1420-M1424 WeakPolarHBondContact O-CG 3.46Å; I1421-M1424 CarbonylContact O-C 3.51Å; I1421-M1424 WeakPolarHBondContact O-CB 3.36Å; I1421-M1424 PolarHBondContact O-N 3.01Å; I1421-M1424 VanDerWaalsContact O-N 3.15Å; M1422-M1424 PolarHBondContact O-N 3.42Å; M1424-A1427 PolarHBondContact O-N 2.99Å; M1424-A1428 WeakPolarHBondContact O-CB 3.26Å; M1424-A1428 PolarHBondContact O-N 3.24Å; M1424-V1498 HydrophobicContact CB-CG1 4.03Å; M1424-V1498 HydrophobicContact CG-CG1 4.27Å; M1424-V1498 WeakPolarHBondContact O-CG1 3.43Å; M1424-M1499 VanDerWaalsContact CG-C 3.46Å; M1424-P1500 HydrophobicContact CG-CG 4.04Å; M1424-P1500 HydrophobicContact SD-CG 4.01Å
1425	A	93.6	Very high	92.8	Very high	6 Å²	6	51 Å²	51	5%	0.05	25%	0.248	C	C	.	.	H	α-helix	trans	-64	-44.7	176.5	0	0	0	0	0	112.2	Q1357 W1376 I1421 M1422 A1428 R1429	Q1357-A1425 PolarHBondContact NE2-O 3.04Å; W1376-A1425 HydrophobicContact CE3-CB 4.15Å; W1376-A1425 HydrophobicContact CH2-CB 4.45Å; W1376-A1425 HydrophobicContact CZ3-CB 3.77Å; I1421-A1425 WeakPolarHBondContact O-CB 3.2Å; I1421-A1425 PolarHBondContact O-N 2.94Å; M1422-A1425 PolarHBondContact O-N 3.09Å; A1425-A1428 PolarHBondContact O-N 3.49Å; A1425-R1429 WeakPolarHBondContact O-CB 3.35Å; A1425-R1429 PolarHBondContact O-N 2.5Å
1426	L	93.8	Very high	92.8	Very high	106 Å²	106	51.4 Å²	51.4	56%	0.555	25%	0.247	S	C	*	.	H	α-helix	trans	-62.3	-40.7	174.8	-70.4	170.9	0	0	0	112.1	M1422 P1423 R1429 E1430	M1422-L1426 WeakPolarHBondContact O-CG 3.36Å; M1422-L1426 PolarHBondContact O-N 3.33Å; P1423-L1426 PolarHBondContact O-N 2.97Å; L1426-R1429 WeakPolarHBondContact O-CB 3.38Å; L1426-R1429 PolarHBondContact O-N 2.78Å; L1426-E1430 PolarHBondContact O-N 3.09Å
1427	A	93	Very high	92.9	Very high	9 Å²	9	53.3 Å²	53.3	7%	0.074	26%	0.255	C	S	.	.	H	α-helix	trans	-68.9	-43.2	177.6	0	0	0	0	0	112.4	P1423 M1424 R1429 E1430 L1431 V1498 Y1503	P1423-A1427 WeakPolarHBondContact O-CB 3.46Å; P1423-A1427 PolarHBondContact O-N 2.97Å; M1424-A1427 PolarHBondContact O-N 2.99Å; A1427-R1429 PolarHBondContact O-N 3.36Å; A1427-E1430 PolarHBondContact O-N 2.92Å; A1427-L1431 PolarHBondContact O-N 2.79Å; A1427-V1498 HydrophobicContact CB-CG1 3.66Å; A1427-Y1503 WeakPolarHBondContact CA-OH 3.41Å; A1427-Y1503 HydrophobicContact CB-CE1 3.74Å; A1427-Y1503 WeakPolarHBondContact O-CE1 3.39Å; A1427-Y1503 PolarHBondContact O-OH 3.14Å
1428	A	93.3	Very high	92.8	Very high	0 Å²	0	55.4 Å²	55.4	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-58.2	-38.2	170.4	0	0	0	0	0	111.5	W1376 V1378 M1424 A1425 L1431 I1432 F1481	W1376-A1428 HydrophobicContact CH2-CB 4Å; W1376-A1428 HydrophobicContact CZ3-CB 4.44Å; V1378-A1428 HydrophobicContact CG1-CB 4.18Å; M1424-A1428 WeakPolarHBondContact O-CB 3.26Å; M1424-A1428 PolarHBondContact O-N 3.24Å; A1425-A1428 PolarHBondContact O-N 3.49Å; A1428-L1431 PolarHBondContact O-N 2.8Å; A1428-I1432 VanDerWaalsContact O-CG1 3.27Å; A1428-I1432 WeakPolarHBondContact O-CG1 3.07Å; A1428-I1432 PolarHBondContact O-N 3.1Å; A1428-F1481 HydrophobicContact CB-CE2 3.95Å; A1428-F1481 HydrophobicContact CB-CZ 3.98Å
1429	R	93.6	Very high	92.5	Very high	95 Å²	95	56.7 Å²	56.7	36%	0.358	27%	0.267	S	S	.	.	H	α-helix	trans	-64.7	-42.1	177.2	-161.5	177.7	-69.1	-177.4	-4.3	113.1	Q1357 A1425 L1426 A1427 L1431 I1432 Q1433	Q1357-R1429 PolarHBondContact O-NH2 2.88Å; A1425-R1429 WeakPolarHBondContact O-CB 3.35Å; A1425-R1429 PolarHBondContact O-N 2.5Å; L1426-R1429 WeakPolarHBondContact O-CB 3.38Å; L1426-R1429 PolarHBondContact O-N 2.78Å; A1427-R1429 PolarHBondContact O-N 3.36Å; R1429-L1431 VanDerWaalsContact C-N 3.28Å; R1429-L1431 PolarHBondContact O-N 2.86Å; R1429-I1432 PolarHBondContact O-N 3.43Å; R1429-Q1433 HydrophobicContact CG-CG 4.4Å; R1429-Q1433 WeakPolarHBondContact O-CB 3.35Å; R1429-Q1433 VanDerWaalsContact O-CG 3.31Å; R1429-Q1433 WeakPolarHBondContact O-CG 3.22Å; R1429-Q1433 PolarHBondContact O-N 2.87Å
1430	E	93.1	Very high	92	Very high	61 Å²	61	54.1 Å²	54.1	29%	0.285	26%	0.26	S	S	.	.	H	α-helix	trans	-61.7	-36.7	175	-162.3	-164.4	170.2	0	0	111.3	L1426 A1427 Y1434 Y1503 V1513	L1426-E1430 PolarHBondContact O-N 3.09Å; A1427-E1430 PolarHBondContact O-N 2.92Å; E1430-Y1434 PolarHBondContact O-N 2.9Å; E1430-Y1503 VanDerWaalsContact CB-OH 3.28Å; E1430-Y1503 WeakPolarHBondContact CB-OH 3.45Å; E1430-Y1503 WeakPolarHBondContact OE2-CE2 3.4Å; E1430-Y1503 PolarHBondContact OE2-OH 3.26Å; E1430-V1513 HydrophobicContact CB-CG2 3.99Å; E1430-V1513 VanDerWaalsContact CD-CG2 3.45Å; E1430-V1513 VanDerWaalsContact CD-N 3.34Å; E1430-V1513 HydrophobicContact CG-CB 4.11Å; E1430-V1513 HydrophobicContact CG-CG2 3.74Å; E1430-V1513 WeakPolarHBondContact OE1-CB 3.49Å; E1430-V1513 PolarHBondContact OE1-N 2.74Å; E1430-V1513 WeakPolarHBondContact OE2-CG2 3.42Å; E1430-V1513 PolarHBondContact OE2-N 2.79Å; E1430-V1513 VanDerWaalsContact OE2-N 3.07Å
1431	L	92.3	Very high	91.1	Very high	0 Å²	0	59.6 Å²	59.6	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-70.6	-43	175.4	-79.8	172.5	0	0	0	112.9	A1427 A1428 R1429 Y1434 F1471 F1481 V1496 V1498 Y1503 V1513	A1427-L1431 PolarHBondContact O-N 2.79Å; A1428-L1431 PolarHBondContact O-N 2.8Å; R1429-L1431 VanDerWaalsContact C-N 3.28Å; R1429-L1431 PolarHBondContact O-N 2.86Å; L1431-Y1434 VanDerWaalsContact O-CB 3.28Å; L1431-Y1434 WeakPolarHBondContact O-CB 3.46Å; L1431-Y1434 PolarHBondContact O-N 2.89Å; L1431-F1471 HydrophobicContact CD2-CD1 4.12Å; L1431-F1471 HydrophobicContact CD2-CD2 4.32Å; L1431-F1471 HydrophobicContact CD2-CE1 3.99Å; L1431-F1471 HydrophobicContact CD2-CE2 4.19Å; L1431-F1471 HydrophobicContact CD2-CG 4.28Å; L1431-F1471 HydrophobicContact CD2-CZ 4.01Å; L1431-F1481 HydrophobicContact CB-CD1 4.05Å; L1431-F1481 HydrophobicContact CB-CE1 3.96Å; L1431-F1481 HydrophobicContact CB-CE2 4.5Å; L1431-F1481 HydrophobicContact CB-CG 4.35Å; L1431-F1481 HydrophobicContact CB-CZ 4.2Å; L1431-F1481 HydrophobicContact CD1-CB 4.06Å; L1431-F1481 HydrophobicContact CD1-CD1 4.25Å; L1431-F1481 HydrophobicContact CD1-CD2 3.59Å; L1431-F1481 HydrophobicContact CD1-CE2 4.07Å; L1431-F1481 HydrophobicContact CD1-CG 3.7Å; L1431-V1496 HydrophobicContact CD1-CG1 4.3Å; L1431-V1498 HydrophobicContact CD1-CG2 4.07Å; L1431-Y1503 HydrophobicContact CD1-CD1 3.65Å; L1431-Y1503 HydrophobicContact CD1-CE1 3.57Å; L1431-Y1503 HydrophobicContact CG-CD1 4.13Å; L1431-Y1503 HydrophobicContact CG-CE1 3.69Å; L1431-V1513 HydrophobicContact CD2-CG1 4.15Å; L1431-V1513 HydrophobicContact CD2-CG2 3.56Å; L1431-V1513 HydrophobicContact CG-CG2 3.72Å
1432	I	92.4	Very high	90.1	Very high	47 Å²	47	60.7 Å²	60.7	24%	0.241	29%	0.294	C	S	.	.	H	α-helix	trans	-65.8	-41.3	178	-68.5	163.8	0	0	0	111	Q1357 V1378 A1379 A1428 R1429 Y1434 Y1437 F1481	Q1357-I1432 HydrophobicContact CG-CD1 4.07Å; V1378-I1432 VanDerWaalsContact O-CD1 3.32Å; V1378-I1432 WeakPolarHBondContact O-CD1 3.46Å; A1379-I1432 HydrophobicContact CB-CD1 3.92Å; A1428-I1432 VanDerWaalsContact O-CG1 3.27Å; A1428-I1432 WeakPolarHBondContact O-CG1 3.07Å; A1428-I1432 PolarHBondContact O-N 3.1Å; R1429-I1432 PolarHBondContact O-N 3.43Å; I1432-Y1434 PolarHBondContact O-N 2.96Å; I1432-Y1437 HydrophobicContact CB-CE1 4.41Å; I1432-Y1437 HydrophobicContact CG1-CE1 4.37Å; I1432-Y1437 HydrophobicContact CG1-CE2 4.16Å; I1432-Y1437 HydrophobicContact CG2-CD1 4.24Å; I1432-Y1437 HydrophobicContact CG2-CE1 3.98Å; I1432-Y1437 WeakPolarHBondContact O-CB 3.38Å; I1432-Y1437 WeakPolarHBondContact O-CD1 3.5Å; I1432-F1481 HydrophobicContact CD1-CE1 4.45Å; I1432-F1481 HydrophobicContact CD1-CZ 4.17Å; I1432-F1481 HydrophobicContact CG1-CE1 3.74Å; I1432-F1481 HydrophobicContact CG1-CZ 3.9Å
1433	Q	91.9	Very high	88.8	Confident	151 Å²	151	61.3 Å²	61.3	71%	0.706	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.7	-4.9	176.3	-66.6	-179.3	-3.5	0	0	113.2	R1429	R1429-Q1433 HydrophobicContact CG-CG 4.4Å; R1429-Q1433 WeakPolarHBondContact O-CB 3.35Å; R1429-Q1433 VanDerWaalsContact O-CG 3.31Å; R1429-Q1433 WeakPolarHBondContact O-CG 3.22Å; R1429-Q1433 PolarHBondContact O-N 2.87Å
1434	Y	92.8	Very high	87.5	Confident	38 Å²	38	62.4 Å²	62.4	15%	0.149	32%	0.322	C	S	.	.	S	Bend	trans	-70.6	134.7	-179.8	-167	-107.7	0	0	0	111.6	E1430 L1431 I1432 Y1436 Y1437 Y1469 F1471 V1513 L1517	E1430-Y1434 PolarHBondContact O-N 2.9Å; L1431-Y1434 VanDerWaalsContact O-CB 3.28Å; L1431-Y1434 WeakPolarHBondContact O-CB 3.46Å; L1431-Y1434 PolarHBondContact O-N 2.89Å; I1432-Y1434 PolarHBondContact O-N 2.96Å; Y1434-Y1436 AromaticContact CE1-CD2 3.78Å; Y1434-Y1436 HydrophobicContact CE1-CD2 3.78Å; Y1434-Y1436 HydrophobicContact CE1-CG 4.26Å; Y1434-Y1436 PolarHBondContact O-N 2.98Å; Y1434-Y1437 WeakPolarHBondContact O-CB 3.48Å; Y1434-Y1437 PolarHBondContact O-N 3.4Å; Y1434-Y1469 HydrophobicContact CE1-CE2 4.43Å; Y1434-F1471 AromaticContact CD1-CD2 3.99Å; Y1434-F1471 HydrophobicContact CD1-CD2 3.99Å; Y1434-F1471 AromaticContact CD1-CE2 3.88Å; Y1434-F1471 HydrophobicContact CD1-CE2 3.88Å; Y1434-F1471 HydrophobicContact CE1-CE2 4.29Å; Y1434-V1513 HydrophobicContact CD2-CG1 3.84Å; Y1434-V1513 HydrophobicContact CE2-CG1 4.26Å; Y1434-V1513 HydrophobicContact CG-CG1 4.07Å; Y1434-L1517 HydrophobicContact CD1-CD1 4.09Å; Y1434-L1517 HydrophobicContact CD2-CD1 4.34Å; Y1434-L1517 HydrophobicContact CE1-CD1 3.38Å; Y1434-L1517 HydrophobicContact CE2-CD1 3.7Å; Y1434-L1517 VanDerWaalsContact OH-CD1 3.3Å; Y1434-L1517 WeakPolarHBondContact OH-CD1 3.37Å
1435	K	91.8	Very high	86.2	Confident	160 Å²	160	70.7 Å²	70.7	70%	0.696	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-5.7	-175.1	71	-179.1	-177.7	-177.3	0	117.5
1436	Y	92.3	Very high	85.2	Confident	63 Å²	63	76 Å²	76	25%	0.247	39%	0.39	C	S	.	.	T	Hydrogen-bonded Turn	trans	-119.2	18.1	172.3	-65.5	-51.5	0	0	0	112	Y1434 Y1469 F1470 F1471	Y1434-Y1436 AromaticContact CE1-CD2 3.78Å; Y1434-Y1436 HydrophobicContact CE1-CD2 3.78Å; Y1434-Y1436 HydrophobicContact CE1-CG 4.26Å; Y1434-Y1436 PolarHBondContact O-N 2.98Å; Y1436-Y1469 HydrophobicContact CD2-CE1 4.07Å; Y1436-Y1469 AromaticContact CD2-CE2 3.77Å; Y1436-Y1469 HydrophobicContact CD2-CE2 3.77Å; Y1436-Y1469 AromaticContact CD2-CZ 3.47Å; Y1436-Y1469 VanDerWaalsContact CD2-CZ 3.47Å; Y1436-Y1469 WeakPolarHBondContact CD2-OH 3.39Å; Y1436-Y1469 HydrophobicContact CE2-CE1 4.04Å; Y1436-Y1469 HydrophobicContact CE2-CE2 4.48Å; Y1436-Y1469 AromaticContact CE2-CZ 3.73Å; Y1436-Y1469 WeakPolarHBondContact CE2-OH 3.38Å; Y1436-Y1469 HydrophobicContact CG-CE2 4.48Å; Y1436-F1470 HydrophobicContact CD1-CD1 4.3Å; Y1436-F1470 HydrophobicContact CD1-CE1 4.05Å; Y1436-F1470 CarbonylContact O-C 3.37Å; Y1436-F1470 WeakPolarHBondContact O-CA 3.41Å; Y1436-F1471 PolarHBondContact O-N 2.79Å
1437	Y	93.1	Very high	84.5	Confident	39 Å²	39	74.3 Å²	74.3	15%	0.153	38%	0.382	C	S	.	.	B	Isolated β-bridge	trans	-68.3	147.7	161	-173.7	-109.8	0	0	0	110.2	I1432 Y1434 P1439 F1471 A1473 F1481	I1432-Y1437 HydrophobicContact CB-CE1 4.41Å; I1432-Y1437 HydrophobicContact CG1-CE1 4.37Å; I1432-Y1437 HydrophobicContact CG1-CE2 4.16Å; I1432-Y1437 HydrophobicContact CG2-CD1 4.24Å; I1432-Y1437 HydrophobicContact CG2-CE1 3.98Å; I1432-Y1437 WeakPolarHBondContact O-CB 3.38Å; I1432-Y1437 WeakPolarHBondContact O-CD1 3.5Å; Y1434-Y1437 WeakPolarHBondContact O-CB 3.48Å; Y1434-Y1437 PolarHBondContact O-N 3.4Å; Y1437-P1439 HydrophobicContact CE1-CG 4.44Å; Y1437-F1471 CarbonylContact C-O 3.5Å; Y1437-F1471 WeakPolarHBondContact CA-O 3.17Å; Y1437-F1471 HydrophobicContact CD2-CB 4.14Å; Y1437-A1473 HydrophobicContact CE2-CB 4.38Å; Y1437-A1473 WeakPolarHBondContact OH-CB 3.29Å; Y1437-F1481 HydrophobicContact CD2-CD1 4.41Å; Y1437-F1481 HydrophobicContact CD2-CE1 4.37Å; Y1437-F1481 AromaticContact CE2-CD1 3.94Å; Y1437-F1481 HydrophobicContact CE2-CD1 3.94Å; Y1437-F1481 AromaticContact CE2-CE1 3.72Å; Y1437-F1481 HydrophobicContact CE2-CE1 3.72Å
1438	K	91.1	Very high	84.1	Confident	64 Å²	64	74.5 Å²	74.5	28%	0.278	38%	0.381	S	S	.	.			trans	-129.6	126.4	168.9	-67.4	-67.7	-173.9	171.8	0	106.5	M1452 L1455 F1470 F1471 T1472	K1438-M1452 HydrophobicContact CB-SD 4.1Å; K1438-M1452 HydrophobicContact CG-SD 4.45Å; K1438-L1455 HydrophobicContact CG-CD1 4.39Å; K1438-F1470 HydrophobicContact CD-CD1 4.5Å; K1438-F1470 HydrophobicContact CG-CB 4Å; K1438-F1470 HydrophobicContact CG-CD1 4.01Å; K1438-F1470 HydrophobicContact CG-CD2 4.43Å; K1438-F1470 HydrophobicContact CG-CG 3.91Å; K1438-F1471 PolarHBondContact N-O 2.66Å; K1438-T1472 WeakPolarHBondContact O-CA 3.46Å; K1438-T1472 WeakPolarHBondContact O-CB 3.47Å; K1438-T1472 PolarHBondContact O-OG1 2.91Å
1439	P	86.9	Confident	83.9	Confident	85 Å²	85	79.4 Å²	79.4	55%	0.552	40%	0.4	S	S	*	.			trans	-51.1	148.6	169.7	-26.5	35.5	0	0	0	110.9	Y1437 M1441	Y1437-P1439 HydrophobicContact CE1-CG 4.44Å; P1439-M1441 HydrophobicContact CB-CG 4.42Å; P1439-M1441 WeakPolarHBondContact O-CG 3.37Å; P1439-M1441 PolarHBondContact O-N 3.2Å
1440	N	80.6	Confident	83.6	Confident	42 Å²	42	79.6 Å²	79.6	23%	0.225	41%	0.408	C	S	.	.			trans	-77.4	112.2	175.2	-166.9	-25.4	0	0	0	107.9	I1382 V1442 T1472 A1473	I1382-N1440 HydrophobicContact CD1-CB 4.43Å; N1440-V1442 WeakPolarHBondContact OD1-CB 3.29Å; N1440-V1442 VanDerWaalsContact OD1-CG2 3.27Å; N1440-V1442 WeakPolarHBondContact OD1-CG2 3.42Å; N1440-V1442 PolarHBondContact OD1-N 3.09Å; N1440-T1472 WeakPolarHBondContact CA-OG1 3.06Å; N1440-T1472 PolarHBondContact N-OG1 3.3Å; N1440-A1473 PolarHBondContact ND2-O 2.9Å
1441	M	73.7	Confident	83.3	Confident	139 Å²	139	78.1 Å²	78.1	69%	0.685	40%	0.403	S	S	*	.			trans	-107.8	26.3	-174.1	-51	-169.9	85.9	0	0	112.3	P1439 T1443	P1439-M1441 HydrophobicContact CB-CG 4.42Å; P1439-M1441 WeakPolarHBondContact O-CG 3.37Å; P1439-M1441 PolarHBondContact O-N 3.2Å; M1441-T1443 PolarHBondContact O-N 3.01Å
1442	V	73.3	Confident	83.2	Confident	24 Å²	24	78.3 Å²	78.3	15%	0.145	40%	0.404	C	S	.	.			trans	-70.9	115.5	177.3	164.1	0	0	0	0	110.6	N1440 E1446 E1448 V1451	N1440-V1442 WeakPolarHBondContact OD1-CB 3.29Å; N1440-V1442 VanDerWaalsContact OD1-CG2 3.27Å; N1440-V1442 WeakPolarHBondContact OD1-CG2 3.42Å; N1440-V1442 PolarHBondContact OD1-N 3.09Å; V1442-E1446 HydrophobicContact CG1-CB 4.35Å; V1442-E1446 WeakPolarHBondContact CG1-O 3.48Å; V1442-E1448 HydrophobicContact CG2-CB 4.28Å; V1442-V1451 HydrophobicContact CG2-CG2 4.14Å
1443	T	65.5	Low	83.1	Confident	113 Å²	113	78.1 Å²	78.1	69%	0.693	40%	0.402	S	S	*	.			trans	-111	127.8	169.6	53.5	0	0	0	0	109.9	M1441	M1441-T1443 PolarHBondContact O-N 3.01Å
1444	G	66	Low	82.9	Confident	63 Å²	63	77.2 Å²	77.2	65%	0.649	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.7	-146.6	-173.6	0	0	0	0	0	113	E1446	G1444-E1446 VanDerWaalsContact C-N 3.29Å; G1444-E1446 PolarHBondContact O-N 3.15Å
1445	D	66.7	Low	82.8	Confident	179 Å²	179	77.6 Å²	77.6	96%	0.957	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.6	7.9	-174.6	-79.6	-26.1	0	0	0	115.2
1446	E	71.3	Confident	82.8	Confident	117 Å²	117	70 Å²	70	55%	0.547	37%	0.367	S	S	.	.			trans	-61.8	142.7	179.3	-70.7	-157.7	152.5	0	0	112.7	V1442 G1444	V1442-E1446 HydrophobicContact CG1-CB 4.35Å; V1442-E1446 WeakPolarHBondContact CG1-O 3.48Å; G1444-E1446 VanDerWaalsContact C-N 3.29Å; G1444-E1446 PolarHBondContact O-N 3.15Å
1447	N	80.7	Confident	82.7	Confident	72 Å²	72	73.8 Å²	73.8	39%	0.385	38%	0.381	S	S	.	.			trans	-82.5	133.2	177.3	-156.1	-66.3	0	0	0	111.3	R1449 D1450 V1451	N1447-R1449 PolarHBondContact O-N 3.44Å; N1447-R1449 WeakPolarHBondContact OD1-CB 3.47Å; N1447-R1449 WeakPolarHBondContact OD1-CG 3.39Å; N1447-R1449 PolarHBondContact OD1-N 3.02Å; N1447-D1450 HydrophobicContact CB-CB 4.35Å; N1447-D1450 VanDerWaalsContact CB-OD2 3.23Å; N1447-D1450 WeakPolarHBondContact CB-OD2 3.32Å; N1447-D1450 PolarHBondContact O-N 3.25Å; N1447-V1451 PolarHBondContact O-N 3.46Å
1448	E	84.4	Confident	82.5	Confident	12 Å²	12	76.4 Å²	76.4	6%	0.056	40%	0.395	C	S	.	.	H	α-helix	trans	-50.9	-24.6	171.2	56.6	177.4	-137.3	0	0	113.5	V1442 M1452 S1474 R1475 L1482 Y1495	V1442-E1448 HydrophobicContact CG2-CB 4.28Å; E1448-M1452 WeakPolarHBondContact O-CG 3.39Å; E1448-S1474 VanDerWaalsContact CD-OG 3.24Å; E1448-S1474 PolarHBondContact OE1-OG 3.47Å; E1448-S1474 WeakPolarHBondContact OE2-CA 3.5Å; E1448-S1474 PolarHBondContact OE2-OG 3.38Å; E1448-R1475 PolarHBondContact OE2-N 3.05Å; E1448-L1482 HydrophobicContact CB-CD2 4.39Å; E1448-L1482 HydrophobicContact CG-CD2 4.17Å; E1448-Y1495 PolarHBondContact OE1-OH 3.23Å
1449	R	88.7	Confident	82.5	Confident	103 Å²	103	76.1 Å²	76.1	39%	0.389	39%	0.394	S	S	.	.	H	α-helix	trans	-77.1	-37.8	174.8	-63.8	177.3	-170.9	165.7	9.9	113.4	N1447 M1452 E1453 L1482 H1493 Y1495	N1447-R1449 PolarHBondContact O-N 3.44Å; N1447-R1449 WeakPolarHBondContact OD1-CB 3.47Å; N1447-R1449 WeakPolarHBondContact OD1-CG 3.39Å; N1447-R1449 PolarHBondContact OD1-N 3.02Å; R1449-M1452 CarbonylContact O-C 3.49Å; R1449-M1452 PolarHBondContact O-N 2.89Å; R1449-E1453 WeakPolarHBondContact O-CB 3.41Å; R1449-E1453 PolarHBondContact O-N 2.82Å; R1449-L1482 HydrophobicContact CG-CD1 4.3Å; R1449-L1482 HydrophobicContact CG-CD2 3.94Å; R1449-H1493 PolarHBondContact O-CE1 3.17Å; R1449-Y1495 PolarHBondContact NE-OH 3.31Å; R1449-Y1495 PolarHBondContact NH2-OH 2.75Å
1450	D	87.3	Confident	82.6	Confident	100 Å²	100	73.7 Å²	73.7	54%	0.535	38%	0.375	S	S	.	.	H	α-helix	trans	-75.3	-40.1	-171.3	-61.4	-28.3	0	0	0	110.7	N1447 M1452 E1453 K1454	N1447-D1450 HydrophobicContact CB-CB 4.35Å; N1447-D1450 VanDerWaalsContact CB-OD2 3.23Å; N1447-D1450 WeakPolarHBondContact CB-OD2 3.32Å; N1447-D1450 PolarHBondContact O-N 3.25Å; D1450-M1452 VanDerWaalsContact C-N 3.29Å; D1450-M1452 PolarHBondContact O-N 3.44Å; D1450-E1453 PolarHBondContact O-N 3.06Å; D1450-K1454 WeakPolarHBondContact O-CB 3.49Å; D1450-K1454 PolarHBondContact O-N 3.37Å
1451	V	87	Confident	82.9	Confident	29 Å²	29	75.2 Å²	75.2	18%	0.176	39%	0.393	C	S	.	.	H	α-helix	trans	-57	-43.9	169	-177.2	0	0	0	0	110.8	V1442 N1447 K1454 L1455	V1442-V1451 HydrophobicContact CG2-CG2 4.14Å; N1447-V1451 PolarHBondContact O-N 3.46Å; V1451-K1454 PolarHBondContact O-N 3.39Å; V1451-L1455 HydrophobicContact CG1-CD1 4.33Å; V1451-L1455 WeakPolarHBondContact O-CG 3.36Å; V1451-L1455 PolarHBondContact O-N 3.19Å
1452	M	89.3	Confident	83.7	Confident	4 Å²	4	75 Å²	75	2%	0.02	40%	0.395	C	S	.	.	H	α-helix	trans	-73	-33.8	179.5	-68.7	-72.2	-86.7	0	0	112.8	K1438 E1448 R1449 D1450 L1455 L1456 F1470 T1472 L1482	K1438-M1452 HydrophobicContact CB-SD 4.1Å; K1438-M1452 HydrophobicContact CG-SD 4.45Å; E1448-M1452 WeakPolarHBondContact O-CG 3.39Å; R1449-M1452 CarbonylContact O-C 3.49Å; R1449-M1452 PolarHBondContact O-N 2.89Å; D1450-M1452 VanDerWaalsContact C-N 3.29Å; D1450-M1452 PolarHBondContact O-N 3.44Å; M1452-L1455 HydrophobicContact SD-CD1 4.3Å; M1452-L1456 WeakPolarHBondContact O-CB 3.45Å; M1452-L1456 WeakPolarHBondContact O-CD1 3.49Å; M1452-L1456 WeakPolarHBondContact O-CG 3.45Å; M1452-L1456 PolarHBondContact O-N 3.35Å; M1452-F1470 HydrophobicContact CE-CB 3.49Å; M1452-F1470 VanDerWaalsContact CE-CB 3.49Å; M1452-F1470 HydrophobicContact SD-CB 4.41Å; M1452-T1472 HydrophobicContact CE-CG2 3.83Å; M1452-T1472 HydrophobicContact CG-CG2 3.88Å; M1452-T1472 HydrophobicContact SD-CG2 4.01Å; M1452-L1482 HydrophobicContact CG-CD2 4.35Å
1453	E	90.3	Very high	84.4	Confident	43 Å²	43	76.7 Å²	76.7	20%	0.201	40%	0.403	C	S	.	.	H	α-helix	trans	-65.3	-43.4	170.9	165.4	135.4	-133.2	0	0	110.8	R1449 D1450 L1456 R1457 V1491	R1449-E1453 WeakPolarHBondContact O-CB 3.41Å; R1449-E1453 PolarHBondContact O-N 2.82Å; D1450-E1453 PolarHBondContact O-N 3.06Å; E1453-L1456 PolarHBondContact O-N 3.27Å; E1453-R1457 HydrophobicContact CG-CG 4.41Å; E1453-R1457 WeakPolarHBondContact O-CB 3.37Å; E1453-R1457 VanDerWaalsContact O-CG 3.26Å; E1453-R1457 WeakPolarHBondContact O-CG 3.45Å; E1453-R1457 PolarHBondContact O-N 2.91Å; E1453-R1457 IonicContact OE1-CZ 3.73Å; E1453-R1457 IonicContact OE1-NE 3.73Å; E1453-R1457 PolarHBondContact OE1-NE 2.83Å; E1453-R1457 IonicContact OE1-NH2 3.28Å; E1453-R1457 PolarHBondContact OE1-NH2 2.76Å; E1453-R1457 IonicContact OE2-NH2 2.77Å; E1453-V1491 HydrophobicContact CB-CB 4.37Å; E1453-V1491 HydrophobicContact CB-CG1 4.32Å; E1453-V1491 HydrophobicContact CB-CG2 4.11Å; E1453-V1491 HydrophobicContact CG-CB 4.3Å; E1453-V1491 HydrophobicContact CG-CG2 3.79Å; E1453-V1491 WeakPolarHBondContact OE1-CG2 3.32Å
1454	K	88.5	Confident	85.4	Confident	132 Å²	132	75.4 Å²	75.4	57%	0.574	40%	0.397	S	S	*	.	H	α-helix	trans	-57.1	-55.3	174.3	-179.9	-179.6	175.2	-174	0	111.6	D1450 V1451 L1456 R1457 E1458	D1450-K1454 WeakPolarHBondContact O-CB 3.49Å; D1450-K1454 PolarHBondContact O-N 3.37Å; V1451-K1454 PolarHBondContact O-N 3.39Å; K1454-L1456 VanDerWaalsContact C-N 3.3Å; K1454-L1456 PolarHBondContact O-N 2.93Å; K1454-R1457 PolarHBondContact O-N 2.97Å; K1454-R1457 VanDerWaalsContact O-N 3.09Å; K1454-E1458 WeakPolarHBondContact CE-OE1 3.34Å; K1454-E1458 VanDerWaalsContact CG-OE1 3.3Å; K1454-E1458 WeakPolarHBondContact CG-OE1 3.26Å; K1454-E1458 WeakPolarHBondContact O-CG 3.44Å; K1454-E1458 PolarHBondContact O-N 2.99Å
1455	L	89.8	Confident	86.5	Confident	47 Å²	47	82 Å²	82	25%	0.246	41%	0.408	C	S	.	.	H	α-helix	trans	-56	-41.2	177.7	-75.1	170.1	0	0	0	112.8	K1438 V1451 M1452 E1459	K1438-L1455 HydrophobicContact CG-CD1 4.39Å; V1451-L1455 HydrophobicContact CG1-CD1 4.33Å; V1451-L1455 WeakPolarHBondContact O-CG 3.36Å; V1451-L1455 PolarHBondContact O-N 3.19Å; M1452-L1455 HydrophobicContact SD-CD1 4.3Å; L1455-E1459 WeakPolarHBondContact O-CB 3.49Å; L1455-E1459 PolarHBondContact O-N 3.19Å
1456	L	91.7	Very high	87.5	Confident	0 Å²	0	76.5 Å²	76.5	0%	0	38%	0.375	C	S	.	.	H	α-helix	trans	-68.1	-38.2	177.6	-76.3	168.5	0	0	0	112.7	M1452 E1453 K1454 K1460 H1468 F1470 L1486 V1491	M1452-L1456 WeakPolarHBondContact O-CB 3.45Å; M1452-L1456 WeakPolarHBondContact O-CD1 3.49Å; M1452-L1456 WeakPolarHBondContact O-CG 3.45Å; M1452-L1456 PolarHBondContact O-N 3.35Å; E1453-L1456 PolarHBondContact O-N 3.27Å; K1454-L1456 VanDerWaalsContact C-N 3.3Å; K1454-L1456 PolarHBondContact O-N 2.93Å; L1456-K1460 WeakPolarHBondContact O-CB 3.46Å; L1456-K1460 PolarHBondContact O-N 3.09Å; L1456-H1468 HydrophobicContact CD2-CB 3.75Å; L1456-H1468 WeakPolarHBondContact CD2-O 3.38Å; L1456-F1470 HydrophobicContact CD2-CD2 3.57Å; L1456-F1470 HydrophobicContact CD2-CE2 3.84Å; L1456-F1470 HydrophobicContact CD2-CG 4.48Å; L1456-F1470 HydrophobicContact CG-CD2 3.96Å; L1456-F1470 HydrophobicContact CG-CE2 4.36Å; L1456-L1486 HydrophobicContact CB-CB 4.07Å; L1456-L1486 HydrophobicContact CB-CD2 4.29Å; L1456-L1486 HydrophobicContact CD2-CB 4.48Å; L1456-V1491 HydrophobicContact CB-CG2 4.36Å; L1456-V1491 HydrophobicContact CD1-CG1 3.67Å; L1456-V1491 HydrophobicContact CD1-CG2 4.45Å
1457	R	90.5	Very high	88.3	Confident	143 Å²	143	73.6 Å²	73.6	54%	0.54	36%	0.363	S	S	.	.	H	α-helix	trans	-67.7	-41.5	177	-73.4	172.1	177	-154.5	10.4	111.6	E1453 K1454 K1460 A1461 L1486	E1453-R1457 HydrophobicContact CG-CG 4.41Å; E1453-R1457 WeakPolarHBondContact O-CB 3.37Å; E1453-R1457 VanDerWaalsContact O-CG 3.26Å; E1453-R1457 WeakPolarHBondContact O-CG 3.45Å; E1453-R1457 PolarHBondContact O-N 2.91Å; E1453-R1457 IonicContact OE1-CZ 3.73Å; E1453-R1457 IonicContact OE1-NE 3.73Å; E1453-R1457 PolarHBondContact OE1-NE 2.83Å; E1453-R1457 IonicContact OE1-NH2 3.28Å; E1453-R1457 PolarHBondContact OE1-NH2 2.76Å; E1453-R1457 IonicContact OE2-NH2 2.77Å; K1454-R1457 PolarHBondContact O-N 2.97Å; K1454-R1457 VanDerWaalsContact O-N 3.09Å; R1457-K1460 PolarHBondContact O-N 3.25Å; R1457-A1461 PolarHBondContact O-N 3.07Å; R1457-L1486 HydrophobicContact CG-CD2 4.13Å
1458	E	90.1	Very high	88.8	Confident	94 Å²	94	70.6 Å²	70.6	44%	0.439	35%	0.347	S	S	.	.	H	α-helix	trans	-62.4	-51.5	176	-71	168.5	-179.2	0	0	111.5	K1454 K1460 A1461 N1462	K1454-E1458 WeakPolarHBondContact CE-OE1 3.34Å; K1454-E1458 VanDerWaalsContact CG-OE1 3.3Å; K1454-E1458 WeakPolarHBondContact CG-OE1 3.26Å; K1454-E1458 WeakPolarHBondContact O-CG 3.44Å; K1454-E1458 PolarHBondContact O-N 2.99Å; E1458-K1460 VanDerWaalsContact C-N 3.29Å; E1458-K1460 PolarHBondContact O-N 2.87Å; E1458-A1461 WeakPolarHBondContact O-CB 3.35Å; E1458-A1461 PolarHBondContact O-N 3.12Å; E1458-A1461 VanDerWaalsContact O-N 3.1Å; E1458-N1462 PolarHBondContact O-N 2.74Å; E1458-N1462 VanDerWaalsContact O-N 3.15Å
1459	E	89.6	Confident	89.2	Confident	58 Å²	58	71.2 Å²	71.2	27%	0.271	35%	0.349	S	S	.	.	H	α-helix	trans	-60.9	-36.9	174.9	-82.8	-94.8	167.4	0	0	112.5	L1455 A1461 N1462 D1463 K1466 H1468 F1470	L1455-E1459 WeakPolarHBondContact O-CB 3.49Å; L1455-E1459 PolarHBondContact O-N 3.19Å; E1459-A1461 VanDerWaalsContact C-N 3.3Å; E1459-A1461 PolarHBondContact O-N 3.39Å; E1459-N1462 PolarHBondContact O-N 3.14Å; E1459-D1463 PolarHBondContact O-N 3.42Å; E1459-K1466 IonicContact OE2-NZ 2.89Å; E1459-K1466 PolarHBondContact OE2-NZ 2.67Å; E1459-H1468 HydrophobicContact CB-CB 4.38Å; E1459-H1468 PolarHBondContact O-CE1 2.91Å; E1459-H1468 PolarHBondContact O-NE2 2.83Å; E1459-H1468 IonicContact OE2-CE1 3.7Å; E1459-H1468 PolarHBondContact OE2-CE1 2.74Å; E1459-H1468 IonicContact OE2-ND1 2.73Å; E1459-H1468 PolarHBondContact OE2-ND1 3.07Å; E1459-H1468 VanDerWaalsContact OE2-ND1 3.17Å; E1459-F1470 HydrophobicContact CG-CE2 4.13Å; E1459-F1470 HydrophobicContact CG-CZ 3.85Å
1460	K	89.1	Confident	89.5	Confident	33 Å²	33	66.7 Å²	66.7	14%	0.143	33%	0.332	C	S	.	.	H	α-helix	trans	-69.7	-24.1	176.2	-171.7	65	176.1	176.9	0	113.3	L1456 R1457 E1458 D1463 P1464 K1466 H1468 L1486	L1456-K1460 WeakPolarHBondContact O-CB 3.46Å; L1456-K1460 PolarHBondContact O-N 3.09Å; R1457-K1460 PolarHBondContact O-N 3.25Å; E1458-K1460 VanDerWaalsContact C-N 3.29Å; E1458-K1460 PolarHBondContact O-N 2.87Å; K1460-D1463 CarbonylContact O-C 3.42Å; K1460-P1464 WeakPolarHBondContact CE-O 3.26Å; K1460-P1464 PolarHBondContact NZ-O 3.16Å; K1460-P1464 VanDerWaalsContact O-CA 3.26Å; K1460-P1464 WeakPolarHBondContact O-CA 3.47Å; K1460-P1464 WeakPolarHBondContact O-CG 3.19Å; K1460-K1466 PolarHBondContact NZ-O 3.41Å; K1460-H1468 WeakPolarHBondContact CA-NE2 3.41Å; K1460-H1468 PolarHBondContact N-NE2 2.87Å; K1460-L1486 HydrophobicContact CB-CD2 3.67Å; K1460-L1486 HydrophobicContact CB-CG 4.35Å; K1460-L1486 HydrophobicContact CG-CD2 3.82Å; K1460-L1486 HydrophobicContact CG-CG 4.12Å
1461	A	88.3	Confident	89.8	Confident	74 Å²	74	61.9 Å²	61.9	61%	0.612	31%	0.306	S	S	*	.	H	α-helix	trans	-73.1	-38.9	168.8	0	0	0	0	0	111.5	R1457 E1458 E1459	R1457-A1461 PolarHBondContact O-N 3.07Å; E1458-A1461 WeakPolarHBondContact O-CB 3.35Å; E1458-A1461 PolarHBondContact O-N 3.12Å; E1458-A1461 VanDerWaalsContact O-N 3.1Å; E1459-A1461 VanDerWaalsContact C-N 3.3Å; E1459-A1461 PolarHBondContact O-N 3.39Å
1462	N	89.7	Confident	90.1	Very high	135 Å²	135	60.6 Å²	60.6	72%	0.722	30%	0.298	S	S	*	.	H	α-helix	trans	-69.1	-41.5	178.3	-67.3	-26.3	0	0	0	113.1	E1458 E1459	E1458-N1462 PolarHBondContact O-N 2.74Å; E1458-N1462 VanDerWaalsContact O-N 3.15Å; E1459-N1462 PolarHBondContact O-N 3.14Å
1463	D	88.5	Confident	90.3	Very high	59 Å²	59	60.5 Å²	60.5	32%	0.316	30%	0.298	S	S	.	.			trans	-131.9	93.2	169.3	-174.8	-10.7	0	0	0	111.3	E1459 K1460 K1465 K1466 H1468	E1459-D1463 PolarHBondContact O-N 3.42Å; K1460-D1463 CarbonylContact O-C 3.42Å; D1463-K1465 PolarHBondContact O-N 3.38Å; D1463-K1465 WeakPolarHBondContact OD1-CA 3.48Å; D1463-K1465 WeakPolarHBondContact OD1-CB 3.38Å; D1463-K1465 PolarHBondContact OD1-N 3.14Å; D1463-K1466 HydrophobicContact CB-CB 4.02Å; D1463-K1466 VanDerWaalsContact CG-CB 3.42Å; D1463-K1466 PolarHBondContact O-N 3.46Å; D1463-K1466 PolarHBondContact OD1-N 3.32Å; D1463-K1466 VanDerWaalsContact OD2-CB 3.23Å; D1463-K1466 WeakPolarHBondContact OD2-CB 3.23Å; D1463-H1468 WeakPolarHBondContact CA-NE2 3.45Å; D1463-H1468 WeakPolarHBondContact CB-NE2 3.35Å; D1463-H1468 PolarHBondContact N-NE2 3.27Å; D1463-H1468 PolarHBondContact O-NE2 2.94Å
1464	P	86.7	Confident	90.3	Very high	86 Å²	86	58.5 Å²	58.5	56%	0.558	29%	0.289	S	S	*	.	S	Bend	trans	-66.1	-17.8	176.6	-24.6	35.4	0	0	0	114.8	K1460	K1460-P1464 WeakPolarHBondContact CE-O 3.26Å; K1460-P1464 PolarHBondContact NZ-O 3.16Å; K1460-P1464 VanDerWaalsContact O-CA 3.26Å; K1460-P1464 WeakPolarHBondContact O-CA 3.47Å; K1460-P1464 WeakPolarHBondContact O-CG 3.19Å
1465	K	87.5	Confident	90.2	Very high	201 Å²	201	58.8 Å²	58.8	87%	0.874	29%	0.286	S	S	*	.	S	Bend	trans	-83.1	-33.8	-179.3	-61.6	176.7	-178	172.2	0	111.6	D1463	D1463-K1465 PolarHBondContact O-N 3.38Å; D1463-K1465 WeakPolarHBondContact OD1-CA 3.48Å; D1463-K1465 WeakPolarHBondContact OD1-CB 3.38Å; D1463-K1465 PolarHBondContact OD1-N 3.14Å
1466	K	87.7	Confident	89.9	Confident	64 Å²	64	60.4 Å²	60.4	28%	0.278	31%	0.307	S	S	.	.	S	Bend	trans	-72.6	144.8	177.6	179.8	173.4	166.1	-136	0	111.7	E1459 K1460 D1463 H1468	E1459-K1466 IonicContact OE2-NZ 2.89Å; E1459-K1466 PolarHBondContact OE2-NZ 2.67Å; K1460-K1466 PolarHBondContact NZ-O 3.41Å; D1463-K1466 HydrophobicContact CB-CB 4.02Å; D1463-K1466 VanDerWaalsContact CG-CB 3.42Å; D1463-K1466 PolarHBondContact O-N 3.46Å; D1463-K1466 PolarHBondContact OD1-N 3.32Å; D1463-K1466 VanDerWaalsContact OD2-CB 3.23Å; D1463-K1466 WeakPolarHBondContact OD2-CB 3.23Å; K1466-H1468 WeakPolarHBondContact CD-CE1 3.32Å; K1466-H1468 VanDerWaalsContact CE-CE1 3.47Å; K1466-H1468 WeakPolarHBondContact CE-CE1 3.34Å; K1466-H1468 WeakPolarHBondContact CE-ND1 3.46Å; K1466-H1468 PolarHBondContact NZ-CE1 2.82Å; K1466-H1468 PolarHBondContact NZ-ND1 2.66Å
1467	I	88.6	Confident	89.8	Confident	57 Å²	57	63.1 Å²	63.1	29%	0.292	32%	0.32	S	S	.	.			trans	-95.6	110.8	164.2	-64.8	178.7	0	0	0	105.9	P1487 W1524	I1467-P1487 HydrophobicContact CD1-CB 4.37Å; I1467-W1524 HydrophobicContact CD1-CH2 3.52Å; I1467-W1524 HydrophobicContact CD1-CZ2 3.41Å; I1467-W1524 VanDerWaalsContact CD1-CZ2 3.41Å; I1467-W1524 HydrophobicContact CD1-CZ3 4.17Å
1468	H	91.7	Very high	89.7	Confident	8 Å²	8	58.4 Å²	58.4	4%	0.037	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	143.3	177.4	-56.9	-88.4	0	0	0	109.7	L1456 E1459 K1460 D1463 K1466 Y1485 L1486	L1456-H1468 HydrophobicContact CD2-CB 3.75Å; L1456-H1468 WeakPolarHBondContact CD2-O 3.38Å; E1459-H1468 HydrophobicContact CB-CB 4.38Å; E1459-H1468 PolarHBondContact O-CE1 2.91Å; E1459-H1468 PolarHBondContact O-NE2 2.83Å; E1459-H1468 IonicContact OE2-CE1 3.7Å; E1459-H1468 PolarHBondContact OE2-CE1 2.74Å; E1459-H1468 IonicContact OE2-ND1 2.73Å; E1459-H1468 PolarHBondContact OE2-ND1 3.07Å; E1459-H1468 VanDerWaalsContact OE2-ND1 3.17Å; K1460-H1468 WeakPolarHBondContact CA-NE2 3.41Å; K1460-H1468 PolarHBondContact N-NE2 2.87Å; D1463-H1468 WeakPolarHBondContact CA-NE2 3.45Å; D1463-H1468 WeakPolarHBondContact CB-NE2 3.35Å; D1463-H1468 PolarHBondContact N-NE2 3.27Å; D1463-H1468 PolarHBondContact O-NE2 2.94Å; K1466-H1468 WeakPolarHBondContact CD-CE1 3.32Å; K1466-H1468 VanDerWaalsContact CE-CE1 3.47Å; K1466-H1468 WeakPolarHBondContact CE-CE1 3.34Å; K1466-H1468 WeakPolarHBondContact CE-ND1 3.46Å; K1466-H1468 PolarHBondContact NZ-CE1 2.82Å; K1466-H1468 PolarHBondContact NZ-ND1 2.66Å; H1468-Y1485 WeakPolarHBondContact O-CA 3.29Å; H1468-L1486 PolarHBondContact O-N 3.21Å
1469	Y	93.4	Very high	89.6	Confident	26 Å²	26	54 Å²	54	10%	0.102	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	142.7	175.2	64.2	-78.3	0	0	0	108.3	Y1434 Y1436 L1483 S1484 L1517 F1520 K1521	Y1434-Y1469 HydrophobicContact CE1-CE2 4.43Å; Y1436-Y1469 HydrophobicContact CD2-CE1 4.07Å; Y1436-Y1469 AromaticContact CD2-CE2 3.77Å; Y1436-Y1469 HydrophobicContact CD2-CE2 3.77Å; Y1436-Y1469 AromaticContact CD2-CZ 3.47Å; Y1436-Y1469 VanDerWaalsContact CD2-CZ 3.47Å; Y1436-Y1469 WeakPolarHBondContact CD2-OH 3.39Å; Y1436-Y1469 HydrophobicContact CE2-CE1 4.04Å; Y1436-Y1469 HydrophobicContact CE2-CE2 4.48Å; Y1436-Y1469 AromaticContact CE2-CZ 3.73Å; Y1436-Y1469 WeakPolarHBondContact CE2-OH 3.38Å; Y1436-Y1469 HydrophobicContact CG-CE2 4.48Å; Y1469-L1483 HydrophobicContact CD2-CD1 4.13Å; Y1469-S1484 CarbonylContact C-O 3.55Å; Y1469-S1484 WeakPolarHBondContact CA-O 3.45Å; Y1469-L1517 HydrophobicContact CD2-CD2 4.34Å; Y1469-L1517 HydrophobicContact CE2-CD2 3.73Å; Y1469-F1520 HydrophobicContact CD1-CE1 4.49Å; Y1469-F1520 AromaticContact CD2-CE1 3.99Å; Y1469-F1520 HydrophobicContact CD2-CE1 3.99Å; Y1469-F1520 AromaticContact CG-CE1 3.96Å; Y1469-F1520 HydrophobicContact CG-CE1 3.96Å; Y1469-K1521 WeakPolarHBondContact OH-CE 3.45Å; Y1469-K1521 PolarHBondContact OH-NZ 3.35Å
1470	F	94.7	Very high	89.8	Confident	7 Å²	7	54.4 Å²	54.4	3%	0.031	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	150.9	178.7	-61.4	-58.8	0	0	0	110.7	Y1436 K1438 M1452 L1456 E1459 S1484	Y1436-F1470 HydrophobicContact CD1-CD1 4.3Å; Y1436-F1470 HydrophobicContact CD1-CE1 4.05Å; Y1436-F1470 CarbonylContact O-C 3.37Å; Y1436-F1470 WeakPolarHBondContact O-CA 3.41Å; K1438-F1470 HydrophobicContact CD-CD1 4.5Å; K1438-F1470 HydrophobicContact CG-CB 4Å; K1438-F1470 HydrophobicContact CG-CD1 4.01Å; K1438-F1470 HydrophobicContact CG-CD2 4.43Å; K1438-F1470 HydrophobicContact CG-CG 3.91Å; M1452-F1470 HydrophobicContact CE-CB 3.49Å; M1452-F1470 VanDerWaalsContact CE-CB 3.49Å; M1452-F1470 HydrophobicContact SD-CB 4.41Å; L1456-F1470 HydrophobicContact CD2-CD2 3.57Å; L1456-F1470 HydrophobicContact CD2-CE2 3.84Å; L1456-F1470 HydrophobicContact CD2-CG 4.48Å; L1456-F1470 HydrophobicContact CG-CD2 3.96Å; L1456-F1470 HydrophobicContact CG-CE2 4.36Å; E1459-F1470 HydrophobicContact CG-CE2 4.13Å; E1459-F1470 HydrophobicContact CG-CZ 3.85Å; F1470-S1484 PolarHBondContact N-O 3.11Å; F1470-S1484 PolarHBondContact O-N 3.22Å
1471	F	93.6	Very high	90.1	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	148.1	165.4	-63.5	-78.7	0	0	0	109.8	L1431 Y1434 Y1436 Y1437 K1438 L1482 L1483 V1496 L1516 L1517	L1431-F1471 HydrophobicContact CD2-CD1 4.12Å; L1431-F1471 HydrophobicContact CD2-CD2 4.32Å; L1431-F1471 HydrophobicContact CD2-CE1 3.99Å; L1431-F1471 HydrophobicContact CD2-CE2 4.19Å; L1431-F1471 HydrophobicContact CD2-CG 4.28Å; L1431-F1471 HydrophobicContact CD2-CZ 4.01Å; Y1434-F1471 AromaticContact CD1-CD2 3.99Å; Y1434-F1471 HydrophobicContact CD1-CD2 3.99Å; Y1434-F1471 AromaticContact CD1-CE2 3.88Å; Y1434-F1471 HydrophobicContact CD1-CE2 3.88Å; Y1434-F1471 HydrophobicContact CE1-CE2 4.29Å; Y1436-F1471 PolarHBondContact O-N 2.79Å; Y1437-F1471 CarbonylContact C-O 3.5Å; Y1437-F1471 WeakPolarHBondContact CA-O 3.17Å; Y1437-F1471 HydrophobicContact CD2-CB 4.14Å; K1438-F1471 PolarHBondContact N-O 2.66Å; F1471-L1482 WeakPolarHBondContact CA-O 3.28Å; F1471-L1483 HydrophobicContact CD1-CB 3.92Å; F1471-L1483 HydrophobicContact CD1-CD1 4.06Å; F1471-L1483 HydrophobicContact CD1-CG 4.46Å; F1471-L1483 HydrophobicContact CE1-CB 3.82Å; F1471-L1483 HydrophobicContact CE1-CD1 3.79Å; F1471-L1483 HydrophobicContact CE1-CD2 4.01Å; F1471-L1483 HydrophobicContact CE1-CG 4.07Å; F1471-L1483 HydrophobicContact CZ-CD1 4.09Å; F1471-L1483 HydrophobicContact CZ-CD2 4.4Å; F1471-V1496 HydrophobicContact CE1-CG2 3.99Å; F1471-L1516 HydrophobicContact CZ-CD2 4.39Å; F1471-L1517 HydrophobicContact CE2-CD1 4.16Å; F1471-L1517 HydrophobicContact CE2-CD2 3.95Å; F1471-L1517 HydrophobicContact CE2-CG 4.36Å; F1471-L1517 HydrophobicContact CZ-CD2 3.72Å; F1471-L1517 HydrophobicContact CZ-CG 4.23Å
1472	T	93.5	Very high	90.3	Very high	2 Å²	2	49.3 Å²	49.3	1%	0.012	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	155.6	159.4	-166.3	0	0	0	0	109.7	K1438 N1440 M1452 F1481 L1482	K1438-T1472 WeakPolarHBondContact O-CA 3.46Å; K1438-T1472 WeakPolarHBondContact O-CB 3.47Å; K1438-T1472 PolarHBondContact O-OG1 2.91Å; N1440-T1472 WeakPolarHBondContact CA-OG1 3.06Å; N1440-T1472 PolarHBondContact N-OG1 3.3Å; M1452-T1472 HydrophobicContact CE-CG2 3.83Å; M1452-T1472 HydrophobicContact CG-CG2 3.88Å; M1452-T1472 HydrophobicContact SD-CG2 4.01Å; T1472-F1481 CarbonylContact O-C 3.58Å; T1472-F1481 VanDerWaalsContact O-CA 3.26Å; T1472-F1481 WeakPolarHBondContact O-CA 3.46Å; T1472-L1482 HydrophobicContact CG2-CB 3.99Å; T1472-L1482 HydrophobicContact CG2-CD2 4.11Å; T1472-L1482 PolarHBondContact N-O 3.04Å; T1472-L1482 VanDerWaalsContact N-O 3.16Å; T1472-L1482 PolarHBondContact O-N 3.06Å
1473	A	92.3	Very high	90.5	Very high	1 Å²	1	42.9 Å²	42.9	1%	0.008	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	130.7	176.7	0	0	0	0	0	109.8	A1379 I1382 Y1437 N1440 R1475 F1481	A1379-A1473 HydrophobicContact CB-CB 3.9Å; I1382-A1473 HydrophobicContact CD1-CB 3.6Å; I1382-A1473 WeakPolarHBondContact CD1-O 3.46Å; Y1437-A1473 HydrophobicContact CE2-CB 4.38Å; Y1437-A1473 WeakPolarHBondContact OH-CB 3.29Å; N1440-A1473 PolarHBondContact ND2-O 2.9Å; A1473-R1475 PolarHBondContact O-N 3.4Å; A1473-F1481 HydrophobicContact CB-CD1 4.13Å; A1473-F1481 HydrophobicContact CB-CE1 3.79Å; A1473-F1481 HydrophobicContact CB-CZ 4.23Å
1474	S	90.4	Very high	90.7	Very high	1 Å²	1	40 Å²	40	1%	0.007	20%	0.204	C	C	.	.			trans	-80.5	118.6	-176.2	-175.4	0	0	0	0	110.8	E1448 A1476 M1477 K1480	E1448-S1474 VanDerWaalsContact CD-OG 3.24Å; E1448-S1474 PolarHBondContact OE1-OG 3.47Å; E1448-S1474 WeakPolarHBondContact OE2-CA 3.5Å; E1448-S1474 PolarHBondContact OE2-OG 3.38Å; S1474-A1476 VanDerWaalsContact C-N 3.34Å; S1474-M1477 CarbonylContact O-C 3.54Å; S1474-M1477 VanDerWaalsContact O-C 3.29Å; S1474-M1477 PolarHBondContact OG-N 2.58Å; S1474-M1477 VanDerWaalsContact OG-N 3.16Å; S1474-K1480 VanDerWaalsContact CB-O 3.27Å; S1474-K1480 WeakPolarHBondContact CB-O 2.9Å; S1474-K1480 PolarHBondContact N-O 2.94Å
1475	R	86.2	Confident	91	Very high	138 Å²	138	36 Å²	36	52%	0.521	18%	0.177	S	C	.	.	S	Bend	trans	-73.4	-33.3	175.3	-165.7	-179.9	-169.2	-160.3	3.5	110.5	I1382 E1448 A1473 M1477	I1382-R1475 HydrophobicContact CD1-CB 4.26Å; I1382-R1475 HydrophobicContact CG1-CB 4.3Å; I1382-R1475 HydrophobicContact CG1-CG 4.32Å; E1448-R1475 PolarHBondContact OE2-N 3.05Å; A1473-R1475 PolarHBondContact O-N 3.4Å; R1475-M1477 VanDerWaalsContact C-N 3.34Å
1476	A	85	Confident	91.1	Very high	82 Å²	82	26.6 Å²	26.6	68%	0.678	14%	0.137	S	C	*	.	S	Bend	trans	-74.5	-20.4	176.6	0	0	0	0	0	113.8	S1474	S1474-A1476 VanDerWaalsContact C-N 3.34Å
1477	M	88.4	Confident	90.9	Very high	56 Å²	56	24.4 Å²	24.4	28%	0.276	13%	0.129	S	C	.	.	S	Bend	trans	-142	81	175.2	-68.6	-173.4	-70.8	0	0	111.5	S1474 R1475 K1480 Y1495	S1474-M1477 CarbonylContact O-C 3.54Å; S1474-M1477 VanDerWaalsContact O-C 3.29Å; S1474-M1477 PolarHBondContact OG-N 2.58Å; S1474-M1477 VanDerWaalsContact OG-N 3.16Å; R1475-M1477 VanDerWaalsContact C-N 3.34Å; M1477-K1480 HydrophobicContact CB-CB 4.19Å; M1477-K1480 HydrophobicContact CB-CD 3.88Å; M1477-K1480 HydrophobicContact CB-CG 4.17Å; M1477-K1480 HydrophobicContact CE-CD 4.06Å; M1477-K1480 HydrophobicContact CG-CD 4.44Å; M1477-K1480 WeakPolarHBondContact O-CB 3.3Å; M1477-K1480 PolarHBondContact O-N 3.29Å; M1477-K1480 HydrophobicContact SD-CD 3.79Å; M1477-K1480 PolarHBondContact SD-NZ 3.17Å; M1477-Y1495 HydrophobicContact CE-CD1 3.63Å; M1477-Y1495 HydrophobicContact CE-CD2 3.77Å; M1477-Y1495 HydrophobicContact CE-CE1 3.38Å; M1477-Y1495 HydrophobicContact CE-CE2 3.55Å; M1477-Y1495 HydrophobicContact CE-CG 3.81Å
1478	P	89.1	Confident	90.6	Very high	44 Å²	44	29.6 Å²	29.6	29%	0.286	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51	140.8	173	-27.2	35.4	0	0	0	112.4	V1378 I1382 F1383 Q1384 K1480	V1378-P1478 HydrophobicContact CG2-CB 4.35Å; I1382-P1478 HydrophobicContact CG2-CB 3.95Å; I1382-P1478 HydrophobicContact CG2-CG 4.09Å; F1383-P1478 WeakPolarHBondContact O-CB 3.49Å; F1383-P1478 WeakPolarHBondContact O-CG 3.27Å; Q1384-P1478 HydrophobicContact CB-CB 3.84Å; Q1384-P1478 HydrophobicContact CG-CB 4.42Å; P1478-K1480 VanDerWaalsContact C-N 3.3Å
1479	G	88.4	Confident	90.2	Very high	3 Å²	3	35.2 Å²	35.2	3%	0.031	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	81.3	2	-169.1	0	0	0	0	0	114.4	V1498	G1479-V1498 PolarHBondContact O-N 3.5Å
1480	K	93.5	Very high	89.9	Confident	65 Å²	65	41.9 Å²	41.9	28%	0.283	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	145.8	172.2	-54.1	-173.6	-170.4	161.3	0	112.2	S1474 M1477 P1478 Y1495 V1496 T1497	S1474-K1480 VanDerWaalsContact CB-O 3.27Å; S1474-K1480 WeakPolarHBondContact CB-O 2.9Å; S1474-K1480 PolarHBondContact N-O 2.94Å; M1477-K1480 HydrophobicContact CB-CB 4.19Å; M1477-K1480 HydrophobicContact CB-CD 3.88Å; M1477-K1480 HydrophobicContact CB-CG 4.17Å; M1477-K1480 HydrophobicContact CE-CD 4.06Å; M1477-K1480 HydrophobicContact CG-CD 4.44Å; M1477-K1480 WeakPolarHBondContact O-CB 3.3Å; M1477-K1480 PolarHBondContact O-N 3.29Å; M1477-K1480 HydrophobicContact SD-CD 3.79Å; M1477-K1480 PolarHBondContact SD-NZ 3.17Å; P1478-K1480 VanDerWaalsContact C-N 3.3Å; K1480-Y1495 HydrophobicContact CB-CD1 4.17Å; K1480-V1496 CarbonylContact C-O 3.5Å; K1480-V1496 VanDerWaalsContact CA-O 3.27Å; K1480-V1496 WeakPolarHBondContact CA-O 3.47Å; K1480-T1497 HydrophobicContact CG-CG2 4.08Å
1481	F	94.3	Very high	89.7	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	132.3	176.2	-72.5	-105.1	0	0	0	109.9	V1378 A1428 L1431 I1432 Y1437 T1472 A1473 L1483 Y1495 V1496 V1498	V1378-F1481 HydrophobicContact CG1-CE2 4.25Å; V1378-F1481 HydrophobicContact CG1-CZ 4.44Å; A1428-F1481 HydrophobicContact CB-CE2 3.95Å; A1428-F1481 HydrophobicContact CB-CZ 3.98Å; L1431-F1481 HydrophobicContact CB-CD1 4.05Å; L1431-F1481 HydrophobicContact CB-CE1 3.96Å; L1431-F1481 HydrophobicContact CB-CE2 4.5Å; L1431-F1481 HydrophobicContact CB-CG 4.35Å; L1431-F1481 HydrophobicContact CB-CZ 4.2Å; L1431-F1481 HydrophobicContact CD1-CB 4.06Å; L1431-F1481 HydrophobicContact CD1-CD1 4.25Å; L1431-F1481 HydrophobicContact CD1-CD2 3.59Å; L1431-F1481 HydrophobicContact CD1-CE2 4.07Å; L1431-F1481 HydrophobicContact CD1-CG 3.7Å; I1432-F1481 HydrophobicContact CD1-CE1 4.45Å; I1432-F1481 HydrophobicContact CD1-CZ 4.17Å; I1432-F1481 HydrophobicContact CG1-CE1 3.74Å; I1432-F1481 HydrophobicContact CG1-CZ 3.9Å; Y1437-F1481 HydrophobicContact CD2-CD1 4.41Å; Y1437-F1481 HydrophobicContact CD2-CE1 4.37Å; Y1437-F1481 AromaticContact CE2-CD1 3.94Å; Y1437-F1481 HydrophobicContact CE2-CD1 3.94Å; Y1437-F1481 AromaticContact CE2-CE1 3.72Å; Y1437-F1481 HydrophobicContact CE2-CE1 3.72Å; T1472-F1481 CarbonylContact O-C 3.58Å; T1472-F1481 VanDerWaalsContact O-CA 3.26Å; T1472-F1481 WeakPolarHBondContact O-CA 3.46Å; A1473-F1481 HydrophobicContact CB-CD1 4.13Å; A1473-F1481 HydrophobicContact CB-CE1 3.79Å; A1473-F1481 HydrophobicContact CB-CZ 4.23Å; F1481-L1483 PolarHBondContact O-N 3.17Å; F1481-Y1495 WeakPolarHBondContact O-CA 3.49Å; F1481-V1496 PolarHBondContact N-O 3.21Å; F1481-V1496 PolarHBondContact O-N 3.23Å; F1481-V1498 HydrophobicContact CD2-CG2 3.75Å; F1481-V1498 HydrophobicContact CE2-CG2 3.73Å
1482	L	93.2	Very high	89.5	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	102.2	-179.5	-177.7	73.5	0	0	0	109.7	E1448 R1449 M1452 F1471 T1472 S1484 H1493 Y1495	E1448-L1482 HydrophobicContact CB-CD2 4.39Å; E1448-L1482 HydrophobicContact CG-CD2 4.17Å; R1449-L1482 HydrophobicContact CG-CD1 4.3Å; R1449-L1482 HydrophobicContact CG-CD2 3.94Å; M1452-L1482 HydrophobicContact CG-CD2 4.35Å; F1471-L1482 WeakPolarHBondContact CA-O 3.28Å; T1472-L1482 HydrophobicContact CG2-CB 3.99Å; T1472-L1482 HydrophobicContact CG2-CD2 4.11Å; T1472-L1482 PolarHBondContact N-O 3.04Å; T1472-L1482 VanDerWaalsContact N-O 3.16Å; T1472-L1482 PolarHBondContact O-N 3.06Å; L1482-S1484 PolarHBondContact O-N 2.9Å; L1482-H1493 HydrophobicContact CD1-CB 3.98Å; L1482-Y1495 HydrophobicContact CB-CD1 4.45Å; L1482-Y1495 HydrophobicContact CB-CE1 4.16Å; L1482-Y1495 HydrophobicContact CD1-CD1 4.12Å; L1482-Y1495 HydrophobicContact CD1-CE1 3.58Å; L1482-Y1495 HydrophobicContact CD1-CE2 4.06Å; L1482-Y1495 HydrophobicContact CG-CE1 4.48Å
1483	L	93.4	Very high	89.4	Confident	0 Å²	0	48 Å²	48	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	103.3	169.9	176.1	52.3	0	0	0	109.3	Y1469 F1471 F1481 E1494 V1496 F1505 F1520	Y1469-L1483 HydrophobicContact CD2-CD1 4.13Å; F1471-L1483 HydrophobicContact CD1-CB 3.92Å; F1471-L1483 HydrophobicContact CD1-CD1 4.06Å; F1471-L1483 HydrophobicContact CD1-CG 4.46Å; F1471-L1483 HydrophobicContact CE1-CB 3.82Å; F1471-L1483 HydrophobicContact CE1-CD1 3.79Å; F1471-L1483 HydrophobicContact CE1-CD2 4.01Å; F1471-L1483 HydrophobicContact CE1-CG 4.07Å; F1471-L1483 HydrophobicContact CZ-CD1 4.09Å; F1471-L1483 HydrophobicContact CZ-CD2 4.4Å; F1481-L1483 PolarHBondContact O-N 3.17Å; L1483-E1494 WeakPolarHBondContact CA-O 3.37Å; L1483-E1494 PolarHBondContact N-O 2.69Å; L1483-E1494 PolarHBondContact O-N 3Å; L1483-V1496 HydrophobicContact CB-CG2 4.36Å; L1483-F1505 HydrophobicContact CD2-CE2 4.01Å; L1483-F1505 HydrophobicContact CD2-CZ 3.88Å; L1483-F1520 HydrophobicContact CD1-CE1 4.36Å; L1483-F1520 HydrophobicContact CD1-CZ 4.32Å; L1483-F1520 HydrophobicContact CD2-CD1 4.26Å; L1483-F1520 HydrophobicContact CD2-CD2 3.83Å; L1483-F1520 HydrophobicContact CD2-CE1 4.29Å; L1483-F1520 HydrophobicContact CD2-CE2 3.86Å; L1483-F1520 HydrophobicContact CD2-CG 4.03Å; L1483-F1520 HydrophobicContact CD2-CZ 4.1Å; L1483-F1520 HydrophobicContact CG-CE2 4.41Å; L1483-F1520 HydrophobicContact CG-CZ 4.37Å
1484	S	92.8	Very high	89.4	Confident	0 Å²	0	49 Å²	49	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	136.2	177.6	-55.3	0	0	0	0	110.1	Y1469 F1470 L1482 R1492 H1493	Y1469-S1484 CarbonylContact C-O 3.55Å; Y1469-S1484 WeakPolarHBondContact CA-O 3.45Å; F1470-S1484 PolarHBondContact N-O 3.11Å; F1470-S1484 PolarHBondContact O-N 3.22Å; L1482-S1484 PolarHBondContact O-N 2.9Å; S1484-R1492 CarbonylContact C-O 3.54Å; S1484-R1492 WeakPolarHBondContact CA-O 3.31Å; S1484-H1493 WeakPolarHBondContact CB-ND1 3.21Å; S1484-H1493 PolarHBondContact OG-ND1 3.39Å
1485	Y	93.1	Very high	89.5	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150	148.3	-178.1	65	-76.4	0	0	0	114	H1468 P1487 R1492 E1494 R1506 F1520 W1524	H1468-Y1485 WeakPolarHBondContact O-CA 3.29Å; Y1485-P1487 HydrophobicContact CD2-CG 3.73Å; Y1485-P1487 HydrophobicContact CE2-CG 3.9Å; Y1485-P1487 WeakPolarHBondContact O-CD 3.46Å; Y1485-R1492 HydrophobicContact CD1-CB 3.97Å; Y1485-R1492 HydrophobicContact CD2-CB 4.44Å; Y1485-R1492 HydrophobicContact CE1-CB 3.55Å; Y1485-R1492 HydrophobicContact CE2-CB 4.08Å; Y1485-R1492 HydrophobicContact CE2-CG 4.4Å; Y1485-R1492 HydrophobicContact CG-CB 4.39Å; Y1485-R1492 VanDerWaalsContact CZ-CD 3.4Å; Y1485-R1492 PolarHBondContact N-O 2.97Å; Y1485-R1492 PolarHBondContact O-N 3.44Å; Y1485-R1492 WeakPolarHBondContact OH-CD 3.32Å; Y1485-R1492 PolarHBondContact OH-NH1 3.34Å; Y1485-R1492 VanDerWaalsContact OH-NH1 3.1Å; Y1485-E1494 HydrophobicContact CE1-CG 4.27Å; Y1485-E1494 VanDerWaalsContact CE1-OE1 3.24Å; Y1485-E1494 WeakPolarHBondContact CE1-OE1 3.46Å; Y1485-E1494 VanDerWaalsContact CZ-OE1 3.3Å; Y1485-E1494 PolarHBondContact OH-OE1 3.32Å; Y1485-R1506 PolarHBondContact OH-NH2 3.22Å; Y1485-F1520 AromaticContact CD1-CE2 3.9Å; Y1485-F1520 HydrophobicContact CD1-CE2 3.9Å; Y1485-F1520 AromaticContact CD1-CZ 3.88Å; Y1485-F1520 HydrophobicContact CD1-CZ 3.88Å; Y1485-F1520 HydrophobicContact CD2-CE2 4.2Å; Y1485-F1520 AromaticContact CD2-CZ 3.95Å; Y1485-F1520 HydrophobicContact CD2-CZ 3.95Å; Y1485-F1520 AromaticContact CE1-CE2 3.83Å; Y1485-F1520 HydrophobicContact CE1-CE2 3.83Å; Y1485-F1520 HydrophobicContact CE1-CZ 4.28Å; Y1485-F1520 HydrophobicContact CE2-CE2 4.13Å; Y1485-F1520 HydrophobicContact CE2-CZ 4.34Å; Y1485-F1520 HydrophobicContact CG-CE2 4.1Å; Y1485-F1520 AromaticContact CG-CZ 3.71Å; Y1485-F1520 HydrophobicContact CG-CZ 3.71Å; Y1485-F1520 AromaticContact CZ-CE2 3.95Å; Y1485-W1524 HydrophobicContact CE2-CB 4.06Å
1486	L	90.6	Very high	89.9	Confident	5 Å²	5	44.9 Å²	44.9	3%	0.026	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	90.3	-175.9	-179.6	48	0	0	0	112.7	L1456 R1457 K1460 H1468 K1490 V1491	L1456-L1486 HydrophobicContact CB-CB 4.07Å; L1456-L1486 HydrophobicContact CB-CD2 4.29Å; L1456-L1486 HydrophobicContact CD2-CB 4.48Å; R1457-L1486 HydrophobicContact CG-CD2 4.13Å; K1460-L1486 HydrophobicContact CB-CD2 3.67Å; K1460-L1486 HydrophobicContact CB-CG 4.35Å; K1460-L1486 HydrophobicContact CG-CD2 3.82Å; K1460-L1486 HydrophobicContact CG-CG 4.12Å; H1468-L1486 PolarHBondContact O-N 3.21Å; L1486-K1490 WeakPolarHBondContact CD1-O 3.38Å; L1486-V1491 HydrophobicContact CB-CG2 4.16Å; L1486-V1491 HydrophobicContact CD1-CG2 3.94Å; L1486-V1491 HydrophobicContact CD2-CG2 4.05Å; L1486-V1491 HydrophobicContact CG-CG2 4.27Å
1487	P	83.7	Confident	90.3	Very high	17 Å²	17	42.7 Å²	42.7	11%	0.11	21%	0.207	C	C	.	.	S	Bend	trans	-68.5	-43.2	178.9	-25.8	36.4	0	0	0	115.5	I1467 Y1485 W1524	I1467-P1487 HydrophobicContact CD1-CB 4.37Å; Y1485-P1487 HydrophobicContact CD2-CG 3.73Å; Y1485-P1487 HydrophobicContact CE2-CG 3.9Å; Y1485-P1487 WeakPolarHBondContact O-CD 3.46Å; P1487-W1524 HydrophobicContact CB-CE3 4Å; P1487-W1524 HydrophobicContact CB-CH2 4.1Å; P1487-W1524 HydrophobicContact CB-CZ3 3.41Å; P1487-W1524 VanDerWaalsContact CB-CZ3 3.41Å; P1487-W1524 HydrophobicContact CG-CE3 3.77Å; P1487-W1524 HydrophobicContact CG-CZ3 3.72Å
1488	K	81.9	Confident	90.6	Very high	166 Å²	166	40.2 Å²	40.2	72%	0.722	20%	0.195	S	C	*	.	S	Bend	trans	-135.9	-94.6	-173	-66.2	-174.4	179.9	-178.7	0	110.2
1489	T	82.5	Confident	90.7	Very high	127 Å²	127	40 Å²	40	78%	0.779	19%	0.191	S	C	*	.	S	Bend	trans	-118.5	-26.5	-177.3	49.8	0	0	0	0	113.6
1490	K	87.7	Confident	90.8	Very high	165 Å²	165	41.3 Å²	41.3	72%	0.717	20%	0.198	S	C	*	.	S	Bend	trans	-100.9	125.4	177.1	177.2	164.3	-175.9	172.5	0	110	L1486	L1486-K1490 WeakPolarHBondContact CD1-O 3.38Å
1491	V	89.6	Confident	90.6	Very high	7 Å²	7	42.5 Å²	42.5	4%	0.042	21%	0.205	C	C	.	.			trans	-68.8	145.4	168.6	179.8	0	0	0	0	109.3	E1453 L1456 L1486 H1493	E1453-V1491 HydrophobicContact CB-CB 4.37Å; E1453-V1491 HydrophobicContact CB-CG1 4.32Å; E1453-V1491 HydrophobicContact CB-CG2 4.11Å; E1453-V1491 HydrophobicContact CG-CB 4.3Å; E1453-V1491 HydrophobicContact CG-CG2 3.79Å; E1453-V1491 WeakPolarHBondContact OE1-CG2 3.32Å; L1456-V1491 HydrophobicContact CB-CG2 4.36Å; L1456-V1491 HydrophobicContact CD1-CG1 3.67Å; L1456-V1491 HydrophobicContact CD1-CG2 4.45Å; L1486-V1491 HydrophobicContact CB-CG2 4.16Å; L1486-V1491 HydrophobicContact CD1-CG2 3.94Å; L1486-V1491 HydrophobicContact CD2-CG2 4.05Å; L1486-V1491 HydrophobicContact CG-CG2 4.27Å; V1491-H1493 VanDerWaalsContact CG1-CE1 3.5Å; V1491-H1493 WeakPolarHBondContact CG1-CE1 3.29Å; V1491-H1493 WeakPolarHBondContact CG1-NE2 3.09Å
1492	R	90	Very high	90.5	Very high	78 Å²	78	42.9 Å²	42.9	29%	0.294	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	140.6	170	-69.4	-176.7	175.5	-172.9	0.1	108.6	S1484 Y1485 W1524 D1526	S1484-R1492 CarbonylContact C-O 3.54Å; S1484-R1492 WeakPolarHBondContact CA-O 3.31Å; Y1485-R1492 HydrophobicContact CD1-CB 3.97Å; Y1485-R1492 HydrophobicContact CD2-CB 4.44Å; Y1485-R1492 HydrophobicContact CE1-CB 3.55Å; Y1485-R1492 HydrophobicContact CE2-CB 4.08Å; Y1485-R1492 HydrophobicContact CE2-CG 4.4Å; Y1485-R1492 HydrophobicContact CG-CB 4.39Å; Y1485-R1492 VanDerWaalsContact CZ-CD 3.4Å; Y1485-R1492 PolarHBondContact N-O 2.97Å; Y1485-R1492 PolarHBondContact O-N 3.44Å; Y1485-R1492 WeakPolarHBondContact OH-CD 3.32Å; Y1485-R1492 PolarHBondContact OH-NH1 3.34Å; Y1485-R1492 VanDerWaalsContact OH-NH1 3.1Å; R1492-W1524 PolarHBondContact NH1-O 3.15Å; R1492-D1526 PolarHBondContact NH1-O 3.22Å
1493	H	91.3	Very high	90.5	Very high	52 Å²	52	43 Å²	43	24%	0.241	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	129.7	176.7	-54.5	-87	0	0	0	108.8	R1449 L1482 S1484 V1491	R1449-H1493 PolarHBondContact O-CE1 3.17Å; L1482-H1493 HydrophobicContact CD1-CB 3.98Å; S1484-H1493 WeakPolarHBondContact CB-ND1 3.21Å; S1484-H1493 PolarHBondContact OG-ND1 3.39Å; V1491-H1493 VanDerWaalsContact CG1-CE1 3.5Å; V1491-H1493 WeakPolarHBondContact CG1-CE1 3.29Å; V1491-H1493 WeakPolarHBondContact CG1-NE2 3.09Å
1494	E	91.9	Very high	90.5	Very high	22 Å²	22	47.7 Å²	47.7	10%	0.103	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	151.6	179.1	-62.9	-177.7	-130.8	0	0	109.5	L1483 Y1485 F1505 R1506 T1528	L1483-E1494 WeakPolarHBondContact CA-O 3.37Å; L1483-E1494 PolarHBondContact N-O 2.69Å; L1483-E1494 PolarHBondContact O-N 3Å; Y1485-E1494 HydrophobicContact CE1-CG 4.27Å; Y1485-E1494 VanDerWaalsContact CE1-OE1 3.24Å; Y1485-E1494 WeakPolarHBondContact CE1-OE1 3.46Å; Y1485-E1494 VanDerWaalsContact CZ-OE1 3.3Å; Y1485-E1494 PolarHBondContact OH-OE1 3.32Å; E1494-F1505 HydrophobicContact CB-CE2 3.67Å; E1494-F1505 HydrophobicContact CB-CZ 4.17Å; E1494-F1505 WeakPolarHBondContact OE2-CZ 3.4Å; E1494-R1506 IonicContact OE1-CZ 3.3Å; E1494-R1506 IonicContact OE1-NE 2.78Å; E1494-R1506 IonicContact OE1-NH2 3.67Å; E1494-R1506 PolarHBondContact OE1-NH2 3.35Å; E1494-R1506 IonicContact OE2-CZ 3.74Å; E1494-R1506 IonicContact OE2-NE 3.36Å; E1494-R1506 PolarHBondContact OE2-NE 3.16Å; E1494-R1506 IonicContact OE2-NH2 3.48Å; E1494-R1506 PolarHBondContact OE2-NH2 3.41Å; E1494-T1528 HydrophobicContact CG-CG2 4.08Å; E1494-T1528 WeakPolarHBondContact OE1-CG2 3.38Å; E1494-T1528 WeakPolarHBondContact OE2-CG2 3.33Å
1495	Y	92.9	Very high	90.5	Very high	53 Å²	53	47.8 Å²	47.8	21%	0.208	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	127.8	-178.4	-69.6	-83.8	0	0	0	111.7	E1448 R1449 M1477 K1480 F1481 L1482	E1448-Y1495 PolarHBondContact OE1-OH 3.23Å; R1449-Y1495 PolarHBondContact NE-OH 3.31Å; R1449-Y1495 PolarHBondContact NH2-OH 2.75Å; M1477-Y1495 HydrophobicContact CE-CD1 3.63Å; M1477-Y1495 HydrophobicContact CE-CD2 3.77Å; M1477-Y1495 HydrophobicContact CE-CE1 3.38Å; M1477-Y1495 HydrophobicContact CE-CE2 3.55Å; M1477-Y1495 HydrophobicContact CE-CG 3.81Å; K1480-Y1495 HydrophobicContact CB-CD1 4.17Å; F1481-Y1495 WeakPolarHBondContact O-CA 3.49Å; L1482-Y1495 HydrophobicContact CB-CD1 4.45Å; L1482-Y1495 HydrophobicContact CB-CE1 4.16Å; L1482-Y1495 HydrophobicContact CD1-CD1 4.12Å; L1482-Y1495 HydrophobicContact CD1-CE1 3.58Å; L1482-Y1495 HydrophobicContact CD1-CE2 4.06Å; L1482-Y1495 HydrophobicContact CG-CE1 4.48Å
1496	V	94.3	Very high	90.3	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	125.8	160.8	-179.7	0	0	0	0	107.3	L1431 F1471 K1480 F1481 L1483 Y1503 F1505 L1516	L1431-V1496 HydrophobicContact CD1-CG1 4.3Å; F1471-V1496 HydrophobicContact CE1-CG2 3.99Å; K1480-V1496 CarbonylContact C-O 3.5Å; K1480-V1496 VanDerWaalsContact CA-O 3.27Å; K1480-V1496 WeakPolarHBondContact CA-O 3.47Å; F1481-V1496 PolarHBondContact N-O 3.21Å; F1481-V1496 PolarHBondContact O-N 3.23Å; L1483-V1496 HydrophobicContact CB-CG2 4.36Å; V1496-Y1503 HydrophobicContact CG1-CD1 4.12Å; V1496-Y1503 HydrophobicContact CG1-CG 4.37Å; V1496-F1505 HydrophobicContact CG2-CB 4.29Å; V1496-F1505 HydrophobicContact CG2-CD2 3.62Å; V1496-F1505 HydrophobicContact CG2-CE2 4.25Å; V1496-F1505 HydrophobicContact CG2-CG 4.18Å; V1496-L1516 HydrophobicContact CG1-CD2 4.02Å; V1496-L1516 HydrophobicContact CG2-CD1 4.4Å; V1496-L1516 HydrophobicContact CG2-CD2 4.09Å
1497	T	94.5	Very high	90.1	Very high	36 Å²	36	54 Å²	54	22%	0.221	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	129.3	173.4	-54.9	0	0	0	0	109	K1480 M1499 R1504	K1480-T1497 HydrophobicContact CG-CG2 4.08Å; T1497-M1499 HydrophobicContact CG2-SD 4.1Å; T1497-R1504 PolarHBondContact N-O 3.23Å; T1497-R1504 PolarHBondContact O-N 3.26Å
1498	V	94.4	Very high	90.4	Very high	4 Å²	4	57.5 Å²	57.5	2%	0.024	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	134.8	172.9	-178.8	0	0	0	0	108.9	M1424 A1427 L1431 G1479 F1481	M1424-V1498 HydrophobicContact CB-CG1 4.03Å; M1424-V1498 HydrophobicContact CG-CG1 4.27Å; M1424-V1498 WeakPolarHBondContact O-CG1 3.43Å; A1427-V1498 HydrophobicContact CB-CG1 3.66Å; L1431-V1498 HydrophobicContact CD1-CG2 4.07Å; G1479-V1498 PolarHBondContact O-N 3.5Å; F1481-V1498 HydrophobicContact CD2-CG2 3.75Å; F1481-V1498 HydrophobicContact CE2-CG2 3.73Å
1499	M	91.5	Very high	90.8	Very high	41 Å²	41	53.6 Å²	53.6	20%	0.202	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	163.6	-179	-58.3	-68.6	-37.3	0	0	108.8	M1424 T1497 E1501 G1502 R1504	M1424-M1499 VanDerWaalsContact CG-C 3.46Å; T1497-M1499 HydrophobicContact CG2-SD 4.1Å; M1499-E1501 VanDerWaalsContact CB-OE2 3.3Å; M1499-E1501 WeakPolarHBondContact CB-OE2 3.32Å; M1499-E1501 PolarHBondContact O-N 3.01Å; M1499-G1502 PolarHBondContact N-O 3.21Å; M1499-G1502 PolarHBondContact O-N 3.46Å; M1499-R1504 HydrophobicContact CG-CB 3.86Å; M1499-R1504 HydrophobicContact SD-CB 4.49Å; M1499-R1504 PolarHBondContact SD-NE 3Å
1500	P	90.5	Very high	91.3	Very high	29 Å²	29	48.3 Å²	48.3	19%	0.188	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-28.1	170.8	-23.6	34.8	0	0	0	113.1	P1423 M1424 G1502	P1423-P1500 HydrophobicContact CB-CB 4.4Å; P1423-P1500 WeakPolarHBondContact CB-O 3.35Å; M1424-P1500 HydrophobicContact CG-CG 4.04Å; M1424-P1500 HydrophobicContact SD-CG 4.01Å; P1500-G1502 VanDerWaalsContact C-N 3.33Å
1501	E	88.8	Confident	91.4	Very high	91 Å²	91	46.2 Å²	46.2	43%	0.425	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.3	8.8	177.1	-36.8	78.4	-143	0	0	114.4	M1499 I1509	M1499-E1501 VanDerWaalsContact CB-OE2 3.3Å; M1499-E1501 WeakPolarHBondContact CB-OE2 3.32Å; M1499-E1501 PolarHBondContact O-N 3.01Å; E1501-I1509 HydrophobicContact CB-CG2 4.16Å
1502	G	91.1	Very high	91.5	Very high	7 Å²	7	48.2 Å²	48.2	7%	0.072	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	108.5	-125.1	-177.9	0	0	0	0	0	113.5	M1499 P1500	M1499-G1502 PolarHBondContact N-O 3.21Å; M1499-G1502 PolarHBondContact O-N 3.46Å; P1500-G1502 VanDerWaalsContact C-N 3.33Å
1503	Y	94.8	Very high	91.5	Very high	3 Å²	3	44.5 Å²	44.5	1%	0.012	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	116.8	-167	-47.8	-73.5	0	0	0	112.8	A1427 E1430 L1431 V1496 I1509 F1510 V1513 L1516	A1427-Y1503 WeakPolarHBondContact CA-OH 3.41Å; A1427-Y1503 HydrophobicContact CB-CE1 3.74Å; A1427-Y1503 WeakPolarHBondContact O-CE1 3.39Å; A1427-Y1503 PolarHBondContact O-OH 3.14Å; E1430-Y1503 VanDerWaalsContact CB-OH 3.28Å; E1430-Y1503 WeakPolarHBondContact CB-OH 3.45Å; E1430-Y1503 WeakPolarHBondContact OE2-CE2 3.4Å; E1430-Y1503 PolarHBondContact OE2-OH 3.26Å; L1431-Y1503 HydrophobicContact CD1-CD1 3.65Å; L1431-Y1503 HydrophobicContact CD1-CE1 3.57Å; L1431-Y1503 HydrophobicContact CG-CD1 4.13Å; L1431-Y1503 HydrophobicContact CG-CE1 3.69Å; V1496-Y1503 HydrophobicContact CG1-CD1 4.12Å; V1496-Y1503 HydrophobicContact CG1-CG 4.37Å; Y1503-I1509 CarbonylContact O-C 3.45Å; Y1503-I1509 WeakPolarHBondContact O-CA 3.43Å; Y1503-F1510 WeakPolarHBondContact CD2-O 3.49Å; Y1503-F1510 PolarHBondContact N-O 3.1Å; Y1503-F1510 PolarHBondContact O-N 2.85Å; Y1503-V1513 HydrophobicContact CD2-CG2 4.41Å; Y1503-V1513 HydrophobicContact CE1-CG2 4Å; Y1503-V1513 HydrophobicContact CE2-CG2 3.77Å; Y1503-V1513 VanDerWaalsContact CE2-N 3.28Å; Y1503-L1516 HydrophobicContact CG-CD2 4.14Å
1504	R	93.8	Very high	91.5	Very high	99 Å²	99	46.2 Å²	46.2	37%	0.374	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	114.6	171.8	-169.8	-176.6	-58.9	-119.9	-3.5	110.5	T1497 M1499 Q1508 I1509	T1497-R1504 PolarHBondContact N-O 3.23Å; T1497-R1504 PolarHBondContact O-N 3.26Å; M1499-R1504 HydrophobicContact CG-CB 3.86Å; M1499-R1504 HydrophobicContact SD-CB 4.49Å; M1499-R1504 PolarHBondContact SD-NE 3Å; R1504-Q1508 CarbonylContact C-O 3.54Å; R1504-Q1508 VanDerWaalsContact CA-O 3.29Å; R1504-Q1508 WeakPolarHBondContact CA-O 3.45Å; R1504-I1509 HydrophobicContact CG-CG1 4.43Å
1505	F	92.8	Very high	91.5	Very high	2 Å²	2	46.4 Å²	46.4	1%	0.009	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	132.2	179.4	-178.6	-111.7	0	0	0	111	L1483 E1494 V1496 G1507 Q1508 F1510 L1516 W1519 F1520	L1483-F1505 HydrophobicContact CD2-CE2 4.01Å; L1483-F1505 HydrophobicContact CD2-CZ 3.88Å; E1494-F1505 HydrophobicContact CB-CE2 3.67Å; E1494-F1505 HydrophobicContact CB-CZ 4.17Å; E1494-F1505 WeakPolarHBondContact OE2-CZ 3.4Å; V1496-F1505 HydrophobicContact CG2-CB 4.29Å; V1496-F1505 HydrophobicContact CG2-CD2 3.62Å; V1496-F1505 HydrophobicContact CG2-CE2 4.25Å; V1496-F1505 HydrophobicContact CG2-CG 4.18Å; F1505-G1507 PolarHBondContact O-N 2.96Å; F1505-Q1508 PolarHBondContact N-O 3Å; F1505-Q1508 PolarHBondContact O-N 3.27Å; F1505-F1510 HydrophobicContact CB-CD2 4.2Å; F1505-F1510 HydrophobicContact CB-CE2 3.99Å; F1505-F1510 HydrophobicContact CD1-CE2 4.49Å; F1505-L1516 HydrophobicContact CB-CD1 3.44Å; F1505-L1516 VanDerWaalsContact CB-CD1 3.44Å; F1505-L1516 HydrophobicContact CD1-CD1 3.77Å; F1505-L1516 HydrophobicContact CG-CD1 3.72Å; F1505-W1519 HydrophobicContact CD1-CE3 4.04Å; F1505-W1519 AromaticContact CD1-CZ3 3.77Å; F1505-W1519 HydrophobicContact CD1-CZ3 3.77Å; F1505-W1519 HydrophobicContact CE1-CE3 4.24Å; F1505-W1519 AromaticContact CE1-CZ3 3.84Å; F1505-W1519 HydrophobicContact CE1-CZ3 3.84Å; F1505-F1520 HydrophobicContact CE1-CB 4.48Å; F1505-F1520 HydrophobicContact CE1-CD2 4.16Å; F1505-F1520 HydrophobicContact CZ-CD2 4.21Å
1506	R	88.4	Confident	91.5	Very high	70 Å²	70	43.9 Å²	43.9	26%	0.264	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	45.9	29.9	-171.5	-64.6	-170.9	-178.8	170	1.7	114.8	Y1485 E1494 Q1508 W1519 H1523	Y1485-R1506 PolarHBondContact OH-NH2 3.22Å; E1494-R1506 IonicContact OE1-CZ 3.3Å; E1494-R1506 IonicContact OE1-NE 2.78Å; E1494-R1506 IonicContact OE1-NH2 3.67Å; E1494-R1506 PolarHBondContact OE1-NH2 3.35Å; E1494-R1506 IonicContact OE2-CZ 3.74Å; E1494-R1506 IonicContact OE2-NE 3.36Å; E1494-R1506 PolarHBondContact OE2-NE 3.16Å; E1494-R1506 IonicContact OE2-NH2 3.48Å; E1494-R1506 PolarHBondContact OE2-NH2 3.41Å; R1506-Q1508 VanDerWaalsContact C-N 3.32Å; R1506-Q1508 PolarHBondContact O-N 3.49Å; R1506-W1519 HydrophobicContact CB-CH2 4.07Å; R1506-W1519 HydrophobicContact CB-CZ3 4.18Å; R1506-W1519 HydrophobicContact CG-CH2 4.43Å; R1506-W1519 HydrophobicContact CG-CZ3 4.3Å; R1506-H1523 PolarHBondContact NH1-O 2.69Å
1507	G	85.4	Confident	91.4	Very high	66 Å²	66	44 Å²	44	68%	0.68	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	84.2	-8.3	-179	0	0	0	0	0	115.7	F1505	F1505-G1507 PolarHBondContact O-N 2.96Å
1508	Q	89.5	Confident	91.2	Very high	90 Å²	90	50.3 Å²	50.3	42%	0.421	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	155.1	168.7	-62.7	-174.4	13.5	0	0	110.3	R1504 F1505 R1506 F1510	R1504-Q1508 CarbonylContact C-O 3.54Å; R1504-Q1508 VanDerWaalsContact CA-O 3.29Å; R1504-Q1508 WeakPolarHBondContact CA-O 3.45Å; F1505-Q1508 PolarHBondContact N-O 3Å; F1505-Q1508 PolarHBondContact O-N 3.27Å; R1506-Q1508 VanDerWaalsContact C-N 3.32Å; R1506-Q1508 PolarHBondContact O-N 3.49Å; Q1508-F1510 HydrophobicContact CB-CE1 4.49Å; Q1508-F1510 HydrophobicContact CB-CE2 3.65Å; Q1508-F1510 HydrophobicContact CB-CZ 3.62Å
1509	I	90.7	Very high	91.1	Very high	83 Å²	83	52 Å²	52	43%	0.426	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	134.2	175.3	-58.6	175.8	0	0	0	108	E1501 Y1503 R1504	E1501-I1509 HydrophobicContact CB-CG2 4.16Å; Y1503-I1509 CarbonylContact O-C 3.45Å; Y1503-I1509 WeakPolarHBondContact O-CA 3.43Å; R1504-I1509 HydrophobicContact CG-CG1 4.43Å
1510	F	93.7	Very high	91.1	Very high	17 Å²	17	50.4 Å²	50.4	8%	0.075	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	129.7	-177	-61.1	-79.4	0	0	0	109.7	Y1503 F1505 Q1508 T1512 L1516 W1519	Y1503-F1510 WeakPolarHBondContact CD2-O 3.49Å; Y1503-F1510 PolarHBondContact N-O 3.1Å; Y1503-F1510 PolarHBondContact O-N 2.85Å; F1505-F1510 HydrophobicContact CB-CD2 4.2Å; F1505-F1510 HydrophobicContact CB-CE2 3.99Å; F1505-F1510 HydrophobicContact CD1-CE2 4.49Å; Q1508-F1510 HydrophobicContact CB-CE1 4.49Å; Q1508-F1510 HydrophobicContact CB-CE2 3.65Å; Q1508-F1510 HydrophobicContact CB-CZ 3.62Å; F1510-T1512 VanDerWaalsContact C-N 3.3Å; F1510-T1512 PolarHBondContact O-N 2.68Å; F1510-L1516 HydrophobicContact CB-CB 3.82Å; F1510-L1516 HydrophobicContact CD2-CB 4.24Å; F1510-L1516 HydrophobicContact CD2-CD1 3.68Å; F1510-L1516 HydrophobicContact CE2-CD1 4.05Å; F1510-L1516 HydrophobicContact CG-CB 3.95Å; F1510-L1516 HydrophobicContact CG-CD1 4.26Å; F1510-W1519 HydrophobicContact CD1-CB 4.39Å; F1510-W1519 HydrophobicContact CE1-CB 3.49Å; F1510-W1519 VanDerWaalsContact CE1-CB 3.49Å; F1510-W1519 HydrophobicContact CE1-CD2 4.07Å; F1510-W1519 HydrophobicContact CE1-CE3 4.47Å; F1510-W1519 AromaticContact CE1-CG 3.61Å; F1510-W1519 HydrophobicContact CE1-CG 3.61Å; F1510-W1519 HydrophobicContact CE2-CE3 4.24Å; F1510-W1519 HydrophobicContact CZ-CB 3.85Å; F1510-W1519 AromaticContact CZ-CD2 3.54Å; F1510-W1519 HydrophobicContact CZ-CD2 3.54Å; F1510-W1519 AromaticContact CZ-CE3 3.63Å; F1510-W1519 HydrophobicContact CZ-CE3 3.63Å; F1510-W1519 AromaticContact CZ-CG 3.62Å; F1510-W1519 HydrophobicContact CZ-CG 3.62Å; F1510-W1519 HydrophobicContact CZ-CZ3 4.41Å
1511	D	90.4	Very high	91.1	Very high	120 Å²	120	53.5 Å²	53.5	64%	0.642	27%	0.266	S	S	*	.	S	Bend	trans	-69.4	-21.6	-176.5	61.2	-1.3	0	0	0	114.8	S1515	D1511-S1515 PolarHBondContact N-OG 2.98Å; D1511-S1515 WeakPolarHBondContact OD1-CB 3.48Å; D1511-S1515 PolarHBondContact OD1-OG 3.45Å
1512	T	90.7	Very high	91	Very high	49 Å²	49	55.7 Å²	55.7	30%	0.301	28%	0.276	S	S	.	.	S	Bend	trans	-150.6	152.5	-170	54.1	0	0	0	0	109.9	F1510 N1514 S1515 L1516	F1510-T1512 VanDerWaalsContact C-N 3.3Å; F1510-T1512 PolarHBondContact O-N 2.68Å; T1512-N1514 PolarHBondContact O-N 2.6Å; T1512-N1514 VanDerWaalsContact O-N 3.12Å; T1512-S1515 PolarHBondContact N-OG 3.17Å; T1512-S1515 PolarHBondContact O-N 2.82Å; T1512-S1515 VanDerWaalsContact O-N 3.17Å; T1512-S1515 PolarHBondContact O-OG 2.84Å; T1512-S1515 VanDerWaalsContact O-OG 3.09Å; T1512-S1515 PolarHBondContact OG1-N 2.79Å; T1512-S1515 PolarHBondContact OG1-OG 3.49Å; T1512-L1516 WeakPolarHBondContact O-CB 3.37Å; T1512-L1516 PolarHBondContact O-N 3.45Å; T1512-L1516 VanDerWaalsContact O-N 3.13Å
1513	V	90.6	Very high	90.8	Very high	0 Å²	0	57.8 Å²	57.8	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-60	-25.8	171.6	175.2	0	0	0	0	110.3	E1430 L1431 Y1434 Y1503 L1517	E1430-V1513 HydrophobicContact CB-CG2 3.99Å; E1430-V1513 VanDerWaalsContact CD-CG2 3.45Å; E1430-V1513 VanDerWaalsContact CD-N 3.34Å; E1430-V1513 HydrophobicContact CG-CB 4.11Å; E1430-V1513 HydrophobicContact CG-CG2 3.74Å; E1430-V1513 WeakPolarHBondContact OE1-CB 3.49Å; E1430-V1513 PolarHBondContact OE1-N 2.74Å; E1430-V1513 WeakPolarHBondContact OE2-CG2 3.42Å; E1430-V1513 PolarHBondContact OE2-N 2.79Å; E1430-V1513 VanDerWaalsContact OE2-N 3.07Å; L1431-V1513 HydrophobicContact CD2-CG1 4.15Å; L1431-V1513 HydrophobicContact CD2-CG2 3.56Å; L1431-V1513 HydrophobicContact CG-CG2 3.72Å; Y1434-V1513 HydrophobicContact CD2-CG1 3.84Å; Y1434-V1513 HydrophobicContact CE2-CG1 4.26Å; Y1434-V1513 HydrophobicContact CG-CG1 4.07Å; Y1503-V1513 HydrophobicContact CD2-CG2 4.41Å; Y1503-V1513 HydrophobicContact CE1-CG2 4Å; Y1503-V1513 HydrophobicContact CE2-CG2 3.77Å; Y1503-V1513 VanDerWaalsContact CE2-N 3.28Å; V1513-L1517 HydrophobicContact CG1-CD1 3.62Å; V1513-L1517 HydrophobicContact CG1-CG 4.09Å; V1513-L1517 WeakPolarHBondContact O-CB 3.42Å; V1513-L1517 WeakPolarHBondContact O-CG 3.19Å; V1513-L1517 PolarHBondContact O-N 3.33Å
1514	N	90.9	Very high	90.3	Very high	88 Å²	88	60.4 Å²	60.4	47%	0.471	29%	0.294	S	S	.	.	H	α-helix	trans	-70.6	-40.6	175.7	-74	-75.7	0	0	0	114.3	T1512 R1518	T1512-N1514 PolarHBondContact O-N 2.6Å; T1512-N1514 VanDerWaalsContact O-N 3.12Å; N1514-R1518 VanDerWaalsContact O-CG 3.27Å; N1514-R1518 WeakPolarHBondContact O-CG 3.45Å; N1514-R1518 PolarHBondContact O-N 2.99Å
1515	S	92	Very high	89.5	Confident	26 Å²	26	60.8 Å²	60.8	18%	0.182	30%	0.303	C	S	.	.	H	α-helix	trans	-71.8	-44.5	175.5	62	0	0	0	0	111.2	D1511 T1512 L1517 R1518 W1519	D1511-S1515 PolarHBondContact N-OG 2.98Å; D1511-S1515 WeakPolarHBondContact OD1-CB 3.48Å; D1511-S1515 PolarHBondContact OD1-OG 3.45Å; T1512-S1515 PolarHBondContact N-OG 3.17Å; T1512-S1515 PolarHBondContact O-N 2.82Å; T1512-S1515 VanDerWaalsContact O-N 3.17Å; T1512-S1515 PolarHBondContact O-OG 2.84Å; T1512-S1515 VanDerWaalsContact O-OG 3.09Å; T1512-S1515 PolarHBondContact OG1-N 2.79Å; T1512-S1515 PolarHBondContact OG1-OG 3.49Å; S1515-L1517 VanDerWaalsContact C-N 3.31Å; S1515-L1517 PolarHBondContact O-N 3.47Å; S1515-R1518 PolarHBondContact O-N 2.97Å; S1515-W1519 PolarHBondContact O-N 3.33Å
1516	L	92.9	Very high	88.8	Confident	0 Å²	0	63.8 Å²	63.8	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-49.1	-50.2	169.6	170.9	65.3	0	0	0	111.8	F1471 V1496 Y1503 F1505 F1510 T1512 W1519 F1520	F1471-L1516 HydrophobicContact CZ-CD2 4.39Å; V1496-L1516 HydrophobicContact CG1-CD2 4.02Å; V1496-L1516 HydrophobicContact CG2-CD1 4.4Å; V1496-L1516 HydrophobicContact CG2-CD2 4.09Å; Y1503-L1516 HydrophobicContact CG-CD2 4.14Å; F1505-L1516 HydrophobicContact CB-CD1 3.44Å; F1505-L1516 VanDerWaalsContact CB-CD1 3.44Å; F1505-L1516 HydrophobicContact CD1-CD1 3.77Å; F1505-L1516 HydrophobicContact CG-CD1 3.72Å; F1510-L1516 HydrophobicContact CB-CB 3.82Å; F1510-L1516 HydrophobicContact CD2-CB 4.24Å; F1510-L1516 HydrophobicContact CD2-CD1 3.68Å; F1510-L1516 HydrophobicContact CE2-CD1 4.05Å; F1510-L1516 HydrophobicContact CG-CB 3.95Å; F1510-L1516 HydrophobicContact CG-CD1 4.26Å; T1512-L1516 WeakPolarHBondContact O-CB 3.37Å; T1512-L1516 PolarHBondContact O-N 3.45Å; T1512-L1516 VanDerWaalsContact O-N 3.13Å; L1516-W1519 PolarHBondContact O-N 3.03Å; L1516-F1520 VanDerWaalsContact O-CB 3.32Å; L1516-F1520 WeakPolarHBondContact O-CB 3.33Å; L1516-F1520 PolarHBondContact O-N 3.05Å
1517	L	91.6	Very high	87.5	Confident	2 Å²	2	66 Å²	66	1%	0.01	34%	0.343	C	S	.	.	H	α-helix	trans	-78.8	-23.7	-176.5	-76.2	177.2	0	0	0	114.7	Y1434 Y1469 F1471 V1513 S1515 F1520 K1521	Y1434-L1517 HydrophobicContact CD1-CD1 4.09Å; Y1434-L1517 HydrophobicContact CD2-CD1 4.34Å; Y1434-L1517 HydrophobicContact CE1-CD1 3.38Å; Y1434-L1517 HydrophobicContact CE2-CD1 3.7Å; Y1434-L1517 VanDerWaalsContact OH-CD1 3.3Å; Y1434-L1517 WeakPolarHBondContact OH-CD1 3.37Å; Y1469-L1517 HydrophobicContact CD2-CD2 4.34Å; Y1469-L1517 HydrophobicContact CE2-CD2 3.73Å; F1471-L1517 HydrophobicContact CE2-CD1 4.16Å; F1471-L1517 HydrophobicContact CE2-CD2 3.95Å; F1471-L1517 HydrophobicContact CE2-CG 4.36Å; F1471-L1517 HydrophobicContact CZ-CD2 3.72Å; F1471-L1517 HydrophobicContact CZ-CG 4.23Å; V1513-L1517 HydrophobicContact CG1-CD1 3.62Å; V1513-L1517 HydrophobicContact CG1-CG 4.09Å; V1513-L1517 WeakPolarHBondContact O-CB 3.42Å; V1513-L1517 WeakPolarHBondContact O-CG 3.19Å; V1513-L1517 PolarHBondContact O-N 3.33Å; S1515-L1517 VanDerWaalsContact C-N 3.31Å; S1515-L1517 PolarHBondContact O-N 3.47Å; L1517-F1520 HydrophobicContact CD2-CD1 3.97Å; L1517-K1521 WeakPolarHBondContact O-CB 3.46Å; L1517-K1521 WeakPolarHBondContact O-CD 3.5Å; L1517-K1521 WeakPolarHBondContact O-CG 3.49Å; L1517-K1521 PolarHBondContact O-N 2.81Å; L1517-K1521 VanDerWaalsContact O-N 3.13Å
1518	R	91.5	Very high	86	Confident	170 Å²	170	65.8 Å²	65.8	64%	0.642	33%	0.328	S	S	*	.	H	α-helix	trans	-65.2	-53.5	167.1	-76.8	169.4	-173.2	165.2	4.4	109.1	N1514 S1515 F1520 K1521 E1522	N1514-R1518 VanDerWaalsContact O-CG 3.27Å; N1514-R1518 WeakPolarHBondContact O-CG 3.45Å; N1514-R1518 PolarHBondContact O-N 2.99Å; S1515-R1518 PolarHBondContact O-N 2.97Å; R1518-F1520 PolarHBondContact O-N 2.66Å; R1518-K1521 PolarHBondContact O-N 3.02Å; R1518-E1522 PolarHBondContact O-N 3.38Å; R1518-E1522 VanDerWaalsContact O-N 3.1Å
1519	W	92.2	Very high	83.7	Confident	39 Å²	39	65.8 Å²	65.8	15%	0.148	34%	0.344	C	S	.	.	H	α-helix	trans	-58.5	-47.4	179.7	-170.1	82.2	0	0	0	111.9	F1505 R1506 F1510 S1515 L1516 K1521 E1522 H1523	F1505-W1519 HydrophobicContact CD1-CE3 4.04Å; F1505-W1519 AromaticContact CD1-CZ3 3.77Å; F1505-W1519 HydrophobicContact CD1-CZ3 3.77Å; F1505-W1519 HydrophobicContact CE1-CE3 4.24Å; F1505-W1519 AromaticContact CE1-CZ3 3.84Å; F1505-W1519 HydrophobicContact CE1-CZ3 3.84Å; R1506-W1519 HydrophobicContact CB-CH2 4.07Å; R1506-W1519 HydrophobicContact CB-CZ3 4.18Å; R1506-W1519 HydrophobicContact CG-CH2 4.43Å; R1506-W1519 HydrophobicContact CG-CZ3 4.3Å; F1510-W1519 HydrophobicContact CD1-CB 4.39Å; F1510-W1519 HydrophobicContact CE1-CB 3.49Å; F1510-W1519 VanDerWaalsContact CE1-CB 3.49Å; F1510-W1519 HydrophobicContact CE1-CD2 4.07Å; F1510-W1519 HydrophobicContact CE1-CE3 4.47Å; F1510-W1519 AromaticContact CE1-CG 3.61Å; F1510-W1519 HydrophobicContact CE1-CG 3.61Å; F1510-W1519 HydrophobicContact CE2-CE3 4.24Å; F1510-W1519 HydrophobicContact CZ-CB 3.85Å; F1510-W1519 AromaticContact CZ-CD2 3.54Å; F1510-W1519 HydrophobicContact CZ-CD2 3.54Å; F1510-W1519 AromaticContact CZ-CE3 3.63Å; F1510-W1519 HydrophobicContact CZ-CE3 3.63Å; F1510-W1519 AromaticContact CZ-CG 3.62Å; F1510-W1519 HydrophobicContact CZ-CG 3.62Å; F1510-W1519 HydrophobicContact CZ-CZ3 4.41Å; S1515-W1519 PolarHBondContact O-N 3.33Å; L1516-W1519 PolarHBondContact O-N 3.03Å; W1519-K1521 VanDerWaalsContact C-N 3.34Å; W1519-K1521 PolarHBondContact O-N 2.87Å; W1519-E1522 PolarHBondContact O-N 3.48Å; W1519-E1522 VanDerWaalsContact O-N 3.15Å; W1519-H1523 AromaticContact CD1-CE1 3.36Å; W1519-H1523 AromaticContact CD1-ND1 3.38Å; W1519-H1523 HydrophobicContact CD2-CB 4.23Å; W1519-H1523 AromaticContact CD2-ND1 3.79Å; W1519-H1523 AromaticContact CE2-CD2 3.87Å; W1519-H1523 AromaticContact CE2-CE1 3.93Å; W1519-H1523 AromaticContact CE2-CG 3.54Å; W1519-H1523 AromaticContact CE2-ND1 3.56Å; W1519-H1523 HydrophobicContact CE3-CB 4.36Å; W1519-H1523 AromaticContact CG-ND1 3.68Å; W1519-H1523 HydrophobicContact CH2-CB 4.1Å; W1519-H1523 HydrophobicContact CZ2-CB 3.92Å; W1519-H1523 AromaticContact CZ2-CD2 3.93Å; W1519-H1523 AromaticContact CZ2-CG 3.78Å; W1519-H1523 HydrophobicContact CZ3-CB 4.31Å; W1519-H1523 AromaticContact NE1-CD2 3.73Å; W1519-H1523 AromaticContact NE1-CE1 3.2Å; W1519-H1523 PolarHBondContact NE1-CE1 3.47Å; W1519-H1523 AromaticContact NE1-CG 3.63Å; W1519-H1523 AromaticContact NE1-ND1 3.27Å; W1519-H1523 PolarHBondContact NE1-ND1 2.87Å; W1519-H1523 AromaticContact NE1-NE2 3.46Å; W1519-H1523 PolarHBondContact NE1-NE2 3.2Å; W1519-H1523 WeakPolarHBondContact O-CB 3.48Å; W1519-H1523 PolarHBondContact O-N 3Å; W1519-H1523 PolarHBondContact O-ND1 3.34Å
1520	F	91.7	Very high	80.9	Confident	7 Å²	7	67.1 Å²	67.1	3%	0.031	36%	0.356	C	S	.	.	H	α-helix	trans	-57.9	-40.5	174	169.6	-110.1	0	0	0	113	Y1469 L1483 Y1485 F1505 L1516 L1517 R1518 E1522 H1523 W1524	Y1469-F1520 HydrophobicContact CD1-CE1 4.49Å; Y1469-F1520 AromaticContact CD2-CE1 3.99Å; Y1469-F1520 HydrophobicContact CD2-CE1 3.99Å; Y1469-F1520 AromaticContact CG-CE1 3.96Å; Y1469-F1520 HydrophobicContact CG-CE1 3.96Å; L1483-F1520 HydrophobicContact CD1-CE1 4.36Å; L1483-F1520 HydrophobicContact CD1-CZ 4.32Å; L1483-F1520 HydrophobicContact CD2-CD1 4.26Å; L1483-F1520 HydrophobicContact CD2-CD2 3.83Å; L1483-F1520 HydrophobicContact CD2-CE1 4.29Å; L1483-F1520 HydrophobicContact CD2-CE2 3.86Å; L1483-F1520 HydrophobicContact CD2-CG 4.03Å; L1483-F1520 HydrophobicContact CD2-CZ 4.1Å; L1483-F1520 HydrophobicContact CG-CE2 4.41Å; L1483-F1520 HydrophobicContact CG-CZ 4.37Å; Y1485-F1520 AromaticContact CD1-CE2 3.9Å; Y1485-F1520 HydrophobicContact CD1-CE2 3.9Å; Y1485-F1520 AromaticContact CD1-CZ 3.88Å; Y1485-F1520 HydrophobicContact CD1-CZ 3.88Å; Y1485-F1520 HydrophobicContact CD2-CE2 4.2Å; Y1485-F1520 AromaticContact CD2-CZ 3.95Å; Y1485-F1520 HydrophobicContact CD2-CZ 3.95Å; Y1485-F1520 AromaticContact CE1-CE2 3.83Å; Y1485-F1520 HydrophobicContact CE1-CE2 3.83Å; Y1485-F1520 HydrophobicContact CE1-CZ 4.28Å; Y1485-F1520 HydrophobicContact CE2-CE2 4.13Å; Y1485-F1520 HydrophobicContact CE2-CZ 4.34Å; Y1485-F1520 HydrophobicContact CG-CE2 4.1Å; Y1485-F1520 AromaticContact CG-CZ 3.71Å; Y1485-F1520 HydrophobicContact CG-CZ 3.71Å; Y1485-F1520 AromaticContact CZ-CE2 3.95Å; F1505-F1520 HydrophobicContact CE1-CB 4.48Å; F1505-F1520 HydrophobicContact CE1-CD2 4.16Å; F1505-F1520 HydrophobicContact CZ-CD2 4.21Å; L1516-F1520 VanDerWaalsContact O-CB 3.32Å; L1516-F1520 WeakPolarHBondContact O-CB 3.33Å; L1516-F1520 PolarHBondContact O-N 3.05Å; L1517-F1520 HydrophobicContact CD2-CD1 3.97Å; R1518-F1520 PolarHBondContact O-N 2.66Å; F1520-E1522 VanDerWaalsContact C-N 3.26Å; F1520-E1522 PolarHBondContact O-N 2.99Å; F1520-H1523 PolarHBondContact O-N 2.81Å; F1520-W1524 HydrophobicContact CD2-CB 4.17Å; F1520-W1524 HydrophobicContact CE2-CB 3.83Å; F1520-W1524 HydrophobicContact CZ-CB 4.21Å; F1520-W1524 WeakPolarHBondContact O-CA 3.34Å; F1520-W1524 VanDerWaalsContact O-CB 3.26Å; F1520-W1524 WeakPolarHBondContact O-CB 3.44Å; F1520-W1524 PolarHBondContact O-N 3.21Å
1521	K	89	Confident	78.1	Confident	95 Å²	95	72.8 Å²	72.8	41%	0.413	39%	0.394	S	S	.	.	H	α-helix	trans	-70.4	-21.7	179.1	-75.2	164	-166.2	156.4	0	113.7	Y1469 L1517 R1518 W1519 W1524	Y1469-K1521 WeakPolarHBondContact OH-CE 3.45Å; Y1469-K1521 PolarHBondContact OH-NZ 3.35Å; L1517-K1521 WeakPolarHBondContact O-CB 3.46Å; L1517-K1521 WeakPolarHBondContact O-CD 3.5Å; L1517-K1521 WeakPolarHBondContact O-CG 3.49Å; L1517-K1521 PolarHBondContact O-N 2.81Å; L1517-K1521 VanDerWaalsContact O-N 3.13Å; R1518-K1521 PolarHBondContact O-N 3.02Å; W1519-K1521 VanDerWaalsContact C-N 3.34Å; W1519-K1521 PolarHBondContact O-N 2.87Å; K1521-W1524 VanDerWaalsContact O-CD1 3.26Å
1522	E	87.9	Confident	75.2	Confident	136 Å²	136	70.7 Å²	70.7	64%	0.636	39%	0.394	S	S	*	.	H	α-helix	trans	-85.2	-39.2	172.1	-70.2	161.1	-171.8	0	0	111.4	R1518 W1519 F1520	R1518-E1522 PolarHBondContact O-N 3.38Å; R1518-E1522 VanDerWaalsContact O-N 3.1Å; W1519-E1522 PolarHBondContact O-N 3.48Å; W1519-E1522 VanDerWaalsContact O-N 3.15Å; F1520-E1522 VanDerWaalsContact C-N 3.26Å; F1520-E1522 PolarHBondContact O-N 2.99Å
1523	H	87.2	Confident	72.3	Confident	52 Å²	52	74.7 Å²	74.7	24%	0.241	42%	0.424	C	S	.	.	H	α-helix	trans	-110.5	9.8	-167.3	-55.9	77.4	0	0	0	114.5	R1506 W1519 F1520 L1525 D1526	R1506-H1523 PolarHBondContact NH1-O 2.69Å; W1519-H1523 AromaticContact CD1-CE1 3.36Å; W1519-H1523 AromaticContact CD1-ND1 3.38Å; W1519-H1523 HydrophobicContact CD2-CB 4.23Å; W1519-H1523 AromaticContact CD2-ND1 3.79Å; W1519-H1523 AromaticContact CE2-CD2 3.87Å; W1519-H1523 AromaticContact CE2-CE1 3.93Å; W1519-H1523 AromaticContact CE2-CG 3.54Å; W1519-H1523 AromaticContact CE2-ND1 3.56Å; W1519-H1523 HydrophobicContact CE3-CB 4.36Å; W1519-H1523 AromaticContact CG-ND1 3.68Å; W1519-H1523 HydrophobicContact CH2-CB 4.1Å; W1519-H1523 HydrophobicContact CZ2-CB 3.92Å; W1519-H1523 AromaticContact CZ2-CD2 3.93Å; W1519-H1523 AromaticContact CZ2-CG 3.78Å; W1519-H1523 HydrophobicContact CZ3-CB 4.31Å; W1519-H1523 AromaticContact NE1-CD2 3.73Å; W1519-H1523 AromaticContact NE1-CE1 3.2Å; W1519-H1523 PolarHBondContact NE1-CE1 3.47Å; W1519-H1523 AromaticContact NE1-CG 3.63Å; W1519-H1523 AromaticContact NE1-ND1 3.27Å; W1519-H1523 PolarHBondContact NE1-ND1 2.87Å; W1519-H1523 AromaticContact NE1-NE2 3.46Å; W1519-H1523 PolarHBondContact NE1-NE2 3.2Å; W1519-H1523 WeakPolarHBondContact O-CB 3.48Å; W1519-H1523 PolarHBondContact O-N 3Å; W1519-H1523 PolarHBondContact O-ND1 3.34Å; F1520-H1523 PolarHBondContact O-N 2.81Å; H1523-L1525 PolarHBondContact O-N 3.46Å; H1523-D1526 WeakPolarHBondContact CB-OD2 3.31Å; H1523-D1526 IonicContact CD2-OD2 2.68Å; H1523-D1526 PolarHBondContact CD2-OD2 3.3Å; H1523-D1526 VanDerWaalsContact CD2-OD2 3.3Å; H1523-D1526 IonicContact CG-OD2 3.49Å; H1523-D1526 WeakPolarHBondContact O-CB 3.48Å; H1523-D1526 PolarHBondContact O-N 3.09Å
1524	W	83.7	Confident	69.3	Low	57 Å²	57	78.4 Å²	78.4	22%	0.216	46%	0.455	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-27.9	178.9	67.5	-91.1	0	0	0	113.2	I1467 Y1485 P1487 R1492 F1520 K1521 D1526	I1467-W1524 HydrophobicContact CD1-CH2 3.52Å; I1467-W1524 HydrophobicContact CD1-CZ2 3.41Å; I1467-W1524 VanDerWaalsContact CD1-CZ2 3.41Å; I1467-W1524 HydrophobicContact CD1-CZ3 4.17Å; Y1485-W1524 HydrophobicContact CE2-CB 4.06Å; P1487-W1524 HydrophobicContact CB-CE3 4Å; P1487-W1524 HydrophobicContact CB-CH2 4.1Å; P1487-W1524 HydrophobicContact CB-CZ3 3.41Å; P1487-W1524 VanDerWaalsContact CB-CZ3 3.41Å; P1487-W1524 HydrophobicContact CG-CE3 3.77Å; P1487-W1524 HydrophobicContact CG-CZ3 3.72Å; R1492-W1524 PolarHBondContact NH1-O 3.15Å; F1520-W1524 HydrophobicContact CD2-CB 4.17Å; F1520-W1524 HydrophobicContact CE2-CB 3.83Å; F1520-W1524 HydrophobicContact CZ-CB 4.21Å; F1520-W1524 WeakPolarHBondContact O-CA 3.34Å; F1520-W1524 VanDerWaalsContact O-CB 3.26Å; F1520-W1524 WeakPolarHBondContact O-CB 3.44Å; F1520-W1524 PolarHBondContact O-N 3.21Å; K1521-W1524 VanDerWaalsContact O-CD1 3.26Å; W1524-D1526 VanDerWaalsContact C-N 3.33Å
1525	L	77.7	Confident	66.3	Low	107 Å²	107	79 Å²	79	56%	0.56	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.7	-34.9	177.1	-91.8	167.9	0	0	0	112	H1523	H1523-L1525 PolarHBondContact O-N 3.46Å
1526	D	77.4	Confident	63.2	Low	66 Å²	66	82.8 Å²	82.8	35%	0.353	50%	0.499	S	S	.	.	S	Bend	trans	-53.4	145.6	-170.8	-64.4	-3.2	0	0	0	111.1	R1492 H1523 W1524 T1528	R1492-D1526 PolarHBondContact NH1-O 3.22Å; H1523-D1526 WeakPolarHBondContact CB-OD2 3.31Å; H1523-D1526 IonicContact CD2-OD2 2.68Å; H1523-D1526 PolarHBondContact CD2-OD2 3.3Å; H1523-D1526 VanDerWaalsContact CD2-OD2 3.3Å; H1523-D1526 IonicContact CG-OD2 3.49Å; H1523-D1526 WeakPolarHBondContact O-CB 3.48Å; H1523-D1526 PolarHBondContact O-N 3.09Å; W1524-D1526 VanDerWaalsContact C-N 3.33Å; D1526-T1528 PolarHBondContact O-N 2.78Å; D1526-T1528 VanDerWaalsContact O-N 3.1Å
1527	P	60.3	Low	60.1	Low	117 Å²	117	86.3 Å²	86.3	76%	0.76	52%	0.523	S	S	*	.			trans	-53.9	121.2	168.1	-21.4	32.9	0	0	0	108.5	A1529	P1527-A1529 PolarHBondContact O-N 3.36Å
1528	T	55.4	Low	57.2	Low	60 Å²	60	94 Å²	94	37%	0.368	56%	0.564	S	S	.	*			trans	-56.5	114	165.1	40.3	0	0	0	0	106.9	E1494 D1526 T1530	E1494-T1528 HydrophobicContact CG-CG2 4.08Å; E1494-T1528 WeakPolarHBondContact OE1-CG2 3.38Å; E1494-T1528 WeakPolarHBondContact OE2-CG2 3.33Å; D1526-T1528 PolarHBondContact O-N 2.78Å; D1526-T1528 VanDerWaalsContact O-N 3.1Å; T1528-T1530 VanDerWaalsContact C-N 3.26Å; T1528-T1530 PolarHBondContact O-N 2.96Å
1529	A	41	Very low	54.1	Low	91 Å²	91	92.4 Å²	92.4	75%	0.752	57%	0.568	S	S	*	*			trans	-59.8	97.8	169.3	0	0	0	0	0	106.9	P1527	P1527-A1529 PolarHBondContact O-N 3.36Å
1530	T	32.2	Very low	51.1	Low	111 Å²	111	97.2 Å²	97.2	68%	0.681	60%	0.602	S	S	*	*			trans	-49.9	131.8	164.8	43.1	0	0	0	0	106.7	T1528 A1532	T1528-T1530 VanDerWaalsContact C-N 3.26Å; T1528-T1530 PolarHBondContact O-N 2.96Å; T1530-A1532 PolarHBondContact O-N 2.81Å
1531	P	33.1	Very low	48.2	Very low	135 Å²	135	101.3 Å²	101.3	88%	0.877	63%	0.629	S	S	*	*			trans	-59	92	168	-22.2	34.1	0	0	0	107.9
1532	A	30.7	Very low	45.4	Very low	76 Å²	76	103.8 Å²	103.8	63%	0.628	65%	0.646	S	S	*	*			trans	-63	146.5	179.4	0	0	0	0	0	107.7	T1530 A1534	T1530-A1532 PolarHBondContact O-N 2.81Å; A1532-A1534 VanDerWaalsContact C-N 3.28Å; A1532-A1534 WeakPolarHBondContact O-CB 3.22Å; A1532-A1534 PolarHBondContact O-N 2.93Å
1533	S	29.5	Very low	42.6	Very low	133 Å²	133	103.9 Å²	103.9	93%	0.93	65%	0.646	S	S	*	*			trans	-58.3	83.8	-173.4	-49.5	0	0	0	0	112.7
1534	A	27.7	Very low	40	Very low	79 Å²	79	108.2 Å²	108.2	65%	0.653	67%	0.67	S	S	*	*			trans	-113.8	87.7	179.9	0	0	0	0	0	107.8	A1532	A1532-A1534 VanDerWaalsContact C-N 3.28Å; A1532-A1534 WeakPolarHBondContact O-CB 3.22Å; A1532-A1534 PolarHBondContact O-N 2.93Å
1535	S	27.8	Very low	37.5	Very low	100 Å²	100	111.9 Å²	111.9	70%	0.699	69%	0.691	S	S	*	*				68.2	45	84.7	79.6	0	0	0	0	114.1	S1537	S1535-S1537 PolarHBondContact O-N 3.32Å
1536	A	26.8	Very low	35.2	Very low	106 Å²	106	117.5 Å²	117.5	88%	0.876	71%	0.705	S	S	*	*			trans	-75.2	57.1	160.8	0	0	0	0	0	111.1	N1538	A1536-N1538 PolarHBondContact O-N 3.23Å
1537	S	27.3	Very low	33.2	Very low	74 Å²	74	119.2 Å²	119.2	52%	0.517	72%	0.72	S	S	.	*			trans	-101.2	68	-178.5	60.2	0	0	0	0	111.9	S1535	S1535-S1537 PolarHBondContact O-N 3.32Å
1538	N	30.7	Very low	32.1	Very low	162 Å²	162	119 Å²	119	87%	0.866	72%	0.718	S	S	*	*			trans	-116.2	96.5	159	-77.9	-15.8	0	0	0	105.1	A1536	A1536-N1538 PolarHBondContact O-N 3.23Å
1539	L	27.6	Very low	31.3	Very low	137 Å²	137	121 Å²	121	72%	0.717	73%	0.733	S	S	*	*			cis	65.3	67.3	36.9	-69.1	176.9	0	0	0	114.8
1540	T	28.6	Very low	31	Very low	141 Å²	141	122 Å²	122	87%	0.865	73%	0.73	S	S	*	*			trans	-133.9	143.9	137.5	24.9	0	0	0	0	109.5
1541	P	30.7	Very low	31.1	Very low	92 Å²	92	124.7 Å²	124.7	60%	0.597	74%	0.738	S	S	*	*				-143.6	-164.9	-121.5	35.9	-13.1	0	0	0	115.9
1542	L	29.7	Very low	31.1	Very low	148 Å²	148	122.4 Å²	122.4	78%	0.775	73%	0.725	S	S	*	*			trans	82.1	152.1	158.2	-60.8	154.2	0	0	0	118
1543	H	29.2	Very low	31.3	Very low	138 Å²	138	124.2 Å²	124.2	64%	0.639	73%	0.733	S	S	*	*			cis	-171.3	-178.8	-34.7	-146.2	-120.2	0	0	0	111.2
1544	L	33.4	Very low	31.7	Very low	142 Å²	142	122.6 Å²	122.6	74%	0.743	72%	0.722	S	S	*	*			trans	85.7	106.7	165	-63.3	124.8	0	0	0	116.4
1545	M	31	Very low	32.1	Very low	134 Å²	134	123 Å²	123	66%	0.66	72%	0.72	S	S	*	*				86.6	135.6	76.4	-77.5	-35.2	96.4	0	0	111.7
1546	R	29	Very low	32.6	Very low	226 Å²	226	126.5 Å²	126.5	85%	0.853	73%	0.725	S	S	*	*			cis	-150.8	177.8	5.3	-112	-165.7	118.6	-170.6	0.3	110.9
1547	P	35.5	Very low	33.1	Very low	102 Å²	102	126.9 Å²	126.9	66%	0.662	72%	0.717	S	S	*	*			trans	-115.5	-133.7	-163.3	44.8	-33.1	0	0	0	111.4
1548	P	38	Very low	33.6	Very low	111 Å²	111	127.6 Å²	127.6	72%	0.721	72%	0.722	S	S	*	*			cis	-120.6	-153	-43.7	35.3	-14.5	0	0	0	110.9
1549	P	38.8	Very low	33.9	Very low	104 Å²	104	128.3 Å²	128.3	68%	0.675	73%	0.725	S	S	*	*				-133.8	165.4	-61.4	38.2	-21.1	0	0	0	116.5
1550	T	34.6	Very low	34.3	Very low	112 Å²	112	125.3 Å²	125.3	69%	0.687	73%	0.727	S	S	*	*			trans	35.4	134.8	141.6	63.7	0	0	0	0	123.6
1551	I	33.8	Very low	34.8	Very low	166 Å²	166	124.2 Å²	124.2	85%	0.851	72%	0.723	S	S	*	*				-177.9	169.5	116.2	-96.3	163.2	0	0	0	111.1
1552	S	33.4	Very low	35	Very low	88 Å²	88	128.8 Å²	128.8	62%	0.615	74%	0.736	S	S	*	*				-165.8	171.1	-108.1	-71.3	0	0	0	0	112.8
1553	S	34.1	Very low	35.2	Very low	114 Å²	114	126.3 Å²	126.3	80%	0.797	74%	0.737	S	S	*	*			trans	70.5	150	154.1	62.6	0	0	0	0	120.8
1554	S	37.4	Very low	35.6	Very low	98 Å²	98	125.3 Å²	125.3	69%	0.685	74%	0.742	S	S	*	*			cis	-174.8	172.3	-20	55.7	0	0	0	0	113.5
1555	S	37.1	Very low	35.6	Very low	88 Å²	88	128.9 Å²	128.9	62%	0.615	75%	0.748	S	S	*	*			trans	74.1	146.3	139	55.2	0	0	0	0	120.4
1556	Q	38.5	Very low	35.6	Very low	173 Å²	173	127.6 Å²	127.6	81%	0.808	75%	0.751	S	S	*	*			cis	-158.3	179.9	-3.9	-119	169.3	96.9	0	0	107.5
1557	T	36.5	Very low	35.6	Very low	115 Å²	115	123 Å²	123	71%	0.706	75%	0.748	S	S	*	*			cis	-164.3	178.3	16.7	0.3	0	0	0	0	106.2
1558	S	37.7	Very low	35.4	Very low	89 Å²	89	124.3 Å²	124.3	62%	0.622	76%	0.755	S	S	*	*			cis	-174.6	161.4	-6.7	44.3	0	0	0	0	109.4
1559	L	36.8	Very low	35	Very low	176 Å²	176	122.3 Å²	122.3	92%	0.921	76%	0.755	S	S	*	*			trans	69	124.6	172.1	-47.8	170.6	0	0	0	115.1
1560	G	36.7	Very low	34.6	Very low	75 Å²	75	123 Å²	123	77%	0.773	76%	0.761	S	S	*	*			cis	133.5	150.2	-6.9	0	0	0	0	0	112.2
1561	P	39.1	Very low	34.4	Very low	118 Å²	118	123.3 Å²	123.3	77%	0.766	76%	0.763	S	S	*	*			cis	-112.5	144.7	-3.5	39.2	-26.5	0	0	0	113.8
1562	Q	34.3	Very low	34.2	Very low	188 Å²	188	122.1 Å²	122.1	88%	0.879	76%	0.764	S	S	*	*				65.3	139.2	82.5	-61.8	-173.5	-5.8	0	0	116.5
1563	A	34	Very low	34	Very low	96 Å²	96	121.8 Å²	121.8	79%	0.793	77%	0.774	S	S	*	*			cis	-143.9	156.7	24.8	0	0	0	0	0	116.8
1564	P	37.5	Very low	33.8	Very low	116 Å²	116	119.5 Å²	119.5	75%	0.753	77%	0.768	S	S	*	*			trans	-138.3	162.8	-172.9	43.2	-26.8	0	0	0	118.9
1565	Y	33.6	Very low	33.7	Very low	218 Å²	218	120.8 Å²	120.8	86%	0.855	77%	0.772	S	S	*	*			trans	-168.4	134.5	153.2	49.9	-90.7	0	0	0	109.5
1566	S	30.5	Very low	33.7	Very low	106 Å²	106	121.8 Å²	121.8	74%	0.741	78%	0.777	S	S	*	*			cis	74.7	135.4	32.6	-136.4	0	0	0	0	113.4
1567	V	30.6	Very low	33.5	Very low	130 Å²	130	124.5 Å²	124.5	79%	0.788	78%	0.78	S	S	*	*			cis	-153.4	164.7	44.8	169.2	0	0	0	0	113.8
1568	T	30.1	Very low	33.4	Very low	129 Å²	129	124.7 Å²	124.7	79%	0.791	79%	0.786	S	S	*	*			trans	-60.5	156.8	-173.5	59.7	0	0	0	0	123.4
1569	G	29.8	Very low	33.2	Very low	70 Å²	70	124 Å²	124	72%	0.722	79%	0.792	S	S	*	*			trans	74.7	177.7	139.4	0	0	0	0	0	119.8
1570	S	30.2	Very low	33.1	Very low	117 Å²	117	123.5 Å²	123.5	82%	0.818	79%	0.789	S	S	*	*			cis	169.6	146.4	-12.3	-97.1	0	0	0	0	109.9
1571	V	30.5	Very low	32.9	Very low	120 Å²	120	124.8 Å²	124.8	73%	0.727	79%	0.786	S	S	*	*			cis	-159.1	172.3	-14.2	-143.5	0	0	0	0	110.3
1572	T	29.8	Very low	32.7	Very low	141 Å²	141	124.6 Å²	124.6	87%	0.865	79%	0.788	S	S	*	*			trans	66	134.5	153.2	48	0	0	0	0	124.4
1573	G	28.6	Very low	32.7	Very low	80 Å²	80	119.8 Å²	119.8	83%	0.825	78%	0.78	S	S	*	*				138.9	99.5	120.6	0	0	0	0	0	122.8
1574	G	30	Very low	32.7	Very low	66 Å²	66	122.5 Å²	122.5	68%	0.68	79%	0.786	S	S	*	*			trans	78.7	129.5	154.1	0	0	0	0	0	118.7
1575	T	35.8	Very low	32.5	Very low	125 Å²	125	120.3 Å²	120.3	77%	0.767	79%	0.785	S	S	*	*			cis	76.6	145.8	45.3	68	0	0	0	0	115.5
1576	P	37.4	Very low	32.4	Very low	110 Å²	110	114.2 Å²	114.2	71%	0.714	79%	0.788	S	S	*	*			cis	-143.1	169.4	14.3	42.7	-23.5	0	0	0	119.7
1577	R	34.6	Very low	32.4	Very low	229 Å²	229	113 Å²	113	86%	0.864	79%	0.793	S	S	*	*			trans	29	140	143.8	-55.8	169.8	86	-177.8	8	122.5
1578	S	33.4	Very low	32.4	Very low	119 Å²	119	110.5 Å²	110.5	83%	0.832	79%	0.794	S	S	*	*				172.4	135.8	99.7	-72.7	0	0	0	0	117
1579	G	34.2	Very low	32.4	Very low	74 Å²	74	110.1 Å²	110.1	76%	0.763	80%	0.796	S	S	*	*			trans	79.9	158.8	158.5	0	0	0	0	0	118.4
1580	I	34.9	Very low	32.4	Very low	166 Å²	166	110.4 Å²	110.4	85%	0.851	79%	0.787	S	S	*	*			cis	-154	166.6	-9.2	-106.6	164.4	0	0	0	109.5
1581	S	33.3	Very low	32.5	Very low	103 Å²	103	108 Å²	108	72%	0.72	77%	0.774	S	S	*	*			trans	-48.1	175.1	173.6	-31.9	0	0	0	0	116
1582	S	33.5	Very low	32.5	Very low	114 Å²	114	113.3 Å²	113.3	80%	0.797	78%	0.783	S	S	*	*			cis	-179.7	172	7.1	22.4	0	0	0	0	108.2
1583	A	34.9	Very low	32.5	Very low	86 Å²	86	111.2 Å²	111.2	71%	0.711	77%	0.774	S	S	*	*			cis	179.6	178.3	-23.3	0	0	0	0	0	108.9
1584	V	33.8	Very low	32.4	Very low	153 Å²	153	115.4 Å²	115.4	93%	0.927	78%	0.775	S	S	*	*			trans	74.1	139.7	174.7	-172.6	0	0	0	0	115.4
1585	G	32.5	Very low	32.3	Very low	71 Å²	71	117.9 Å²	117.9	73%	0.732	78%	0.778	S	S	*	*			cis	162	148.5	-12	0	0	0	0	0	115
1586	G	32.1	Very low	31.9	Very low	89 Å²	89	120.3 Å²	120.3	92%	0.918	78%	0.78	S	S	*	*			trans	87.7	147.7	174	0	0	0	0	0	115.9
1587	G	30.6	Very low	31.6	Very low	82 Å²	82	119.5 Å²	119.5	85%	0.845	78%	0.777	S	S	*	*			cis	165.5	117.1	-12.9	0	0	0	0	0	115
1588	G	30.4	Very low	31.2	Very low	77 Å²	77	116.7 Å²	116.7	79%	0.794	78%	0.777	S	S	*	*			trans	79.7	140.3	-178.8	0	0	0	0	0	113.3
1589	S	31.1	Very low	31	Very low	121 Å²	121	116.2 Å²	116.2	85%	0.846	77%	0.77	S	S	*	*			cis	-130.4	-144.3	-1	-64.1	0	0	0	0	108.5
1590	S	29.6	Very low	30.8	Very low	76 Å²	76	116 Å²	116	53%	0.531	77%	0.768	S	S	.	*			cis	-151.3	-168.6	-6.2	-156.9	0	0	0	0	110.2
1591	A	32.4	Very low	30.7	Very low	66 Å²	66	118.6 Å²	118.6	55%	0.545	77%	0.769	S	S	.	*			trans	39.4	134.9	153.2	0	0	0	0	0	123.2
1592	Y	29.1	Very low	30.5	Very low	232 Å²	232	117.1 Å²	117.1	91%	0.91	77%	0.769	S	S	*	*			trans	-53.5	122.4	-179.8	-41.7	-87.3	0	0	0	117.8
1593	S	30.5	Very low	30.4	Very low	97 Å²	97	117.6 Å²	117.6	68%	0.678	77%	0.768	S	S	*	*			trans	-166.1	128.2	140.7	-171.4	0	0	0	0	111.3
1594	I	27.4	Very low	30.2	Very low	167 Å²	167	119 Å²	119	86%	0.856	77%	0.772	S	S	*	*			trans	-108.6	91	-179.9	-60.8	-175.8	0	0	0	110.9
1595	T	26.7	Very low	30.1	Very low	119 Å²	119	114.7 Å²	114.7	73%	0.73	76%	0.759	S	S	*	*			trans	-128	46.1	168.8	46	0	0	0	0	111.5	S1597	T1595-S1597 PolarHBondContact O-N 3.01Å; T1595-S1597 VanDerWaalsContact O-N 3.16Å
1596	Q	28.3	Very low	30.1	Very low	176 Å²	176	116.8 Å²	116.8	82%	0.822	76%	0.763	S	S	*	*			trans	-92.6	81.3	-173	-64.9	-152.3	1	0	0	115.2
1597	S	30.2	Very low	30	Very low	92 Å²	92	118.8 Å²	118.8	64%	0.643	76%	0.762	S	S	*	*			trans	-9.4	124.8	142.1	54.6	0	0	0	0	117.4	T1595 T1599	T1595-S1597 PolarHBondContact O-N 3.01Å; T1595-S1597 VanDerWaalsContact O-N 3.16Å; S1597-T1599 PolarHBondContact O-N 2.74Å
1598	I	27.2	Very low	30.2	Very low	170 Å²	170	119.3 Å²	119.3	87%	0.872	76%	0.759	S	S	*	*			trans	-68.6	96.8	170.8	-63.6	175.7	0	0	0	109.8	G1600	I1598-G1600 VanDerWaalsContact C-N 3.34Å; I1598-G1600 PolarHBondContact O-N 3.22Å; I1598-G1600 VanDerWaalsContact O-N 3.08Å
1599	T	28.8	Very low	30.5	Very low	109 Å²	109	121.8 Å²	121.8	67%	0.669	76%	0.761	S	S	*	*			trans	-82.8	74.8	175.5	39.2	0	0	0	0	111.3	S1597 Y1601	S1597-T1599 PolarHBondContact O-N 2.74Å; T1599-Y1601 PolarHBondContact O-N 2.94Å
1600	G	30.4	Very low	30.4	Very low	71 Å²	71	119.4 Å²	119.4	73%	0.732	76%	0.755	S	S	*	*			trans	-67.4	87	177.5	0	0	0	0	0	113.6	I1598 G1602	I1598-G1600 VanDerWaalsContact C-N 3.34Å; I1598-G1600 PolarHBondContact O-N 3.22Å; I1598-G1600 VanDerWaalsContact O-N 3.08Å; G1600-G1602 PolarHBondContact O-N 3.47Å
1601	Y	31.3	Very low	30.4	Very low	220 Å²	220	121 Å²	121	86%	0.863	77%	0.773	S	S	*	*			trans	-60.5	115.2	171.2	-91.9	-90.8	0	0	0	111.4	T1599	T1599-Y1601 PolarHBondContact O-N 2.94Å
1602	G	30.4	Very low	30.3	Very low	71 Å²	71	121.1 Å²	121.1	73%	0.732	78%	0.78	S	S	*	*			trans	-125.7	115.4	176.6	0	0	0	0	0	112.5	G1600	G1600-G1602 PolarHBondContact O-N 3.47Å
1603	T	30.6	Very low	30.4	Very low	125 Å²	125	116.7 Å²	116.7	77%	0.767	78%	0.777	S	S	*	*			trans	-135.3	98.6	176.2	34.1	0	0	0	0	113.1
1604	S	31.3	Very low	30.4	Very low	114 Å²	114	117.2 Å²	117.2	80%	0.797	78%	0.781	S	S	*	*			trans	59.1	143.8	139.3	60.7	0	0	0	0	123.5
1605	G	30.8	Very low	30.4	Very low	64 Å²	64	114.4 Å²	114.4	66%	0.66	78%	0.776	S	S	*	*			trans	102.4	77.6	160.6	0	0	0	0	0	114.4
1606	S	32	Very low	30.6	Very low	115 Å²	115	113.7 Å²	113.7	80%	0.804	78%	0.776	S	S	*	*				63.3	93.9	55.4	-49.4	0	0	0	0	115.1
1607	S	31.7	Very low	30.6	Very low	130 Å²	130	113.8 Å²	113.8	91%	0.909	78%	0.776	S	S	*	*			trans	-168.9	126.5	137.2	-80.9	0	0	0	0	111.1
1608	A	33.1	Very low	30.7	Very low	93 Å²	93	121 Å²	121	77%	0.769	79%	0.791	S	S	*	*			trans	-118.6	-166.9	165.4	0	0	0	0	0	106.5
1609	P	38.1	Very low	30.9	Very low	130 Å²	130	115.9 Å²	115.9	84%	0.844	78%	0.781	S	S	*	*			cis	-135.3	-168.7	-7.4	42.4	-25.7	0	0	0	113.1
1610	G	29.3	Very low	30.8	Very low	70 Å²	70	116.8 Å²	116.8	72%	0.722	79%	0.791	S	S	*	*			trans	134.6	114.5	135	0	0	0	0	0	118.3
1611	A	29.7	Very low	31	Very low	110 Å²	110	118.4 Å²	118.4	91%	0.909	79%	0.791	S	S	*	*			trans	44.9	114.3	144.1	0	0	0	0	0	120.6
1612	G	30.3	Very low	31.1	Very low	68 Å²	68	113 Å²	113	70%	0.701	79%	0.786	S	S	*	*				135.3	142.1	93.6	0	0	0	0	0	119.5
1613	V	29.8	Very low	31	Very low	139 Å²	139	116.1 Å²	116.1	84%	0.842	79%	0.791	S	S	*	*			trans	72.5	122.5	137.5	-177.1	0	0	0	0	119.5
1614	S	31	Very low	31.1	Very low	108 Å²	108	115.5 Å²	115.5	76%	0.755	79%	0.789	S	S	*	*			trans	69	138.1	162.9	-64.2	0	0	0	0	117.5
1615	S	27	Very low	30.9	Very low	109 Å²	109	115.4 Å²	115.4	76%	0.762	79%	0.788	S	S	*	*			cis	85.9	150.8	29.9	-163.1	0	0	0	0	114.8
1616	S	31.2	Very low	31	Very low	104 Å²	104	122.1 Å²	122.1	73%	0.727	80%	0.799	S	S	*	*			trans	63.4	123.8	-160.1	67.7	0	0	0	0	114.1
1617	H	27.5	Very low	30.9	Very low	178 Å²	178	119.5 Å²	119.5	82%	0.824	79%	0.791	S	S	*	*			cis	79.5	76.3	42.8	-71.7	10.2	0	0	0	115.3
1618	Y	33.1	Very low	30.8	Very low	243 Å²	243	117 Å²	117	95%	0.953	78%	0.778	S	S	*	*			trans	-147.3	147.8	136	-85.8	-83	0	0	0	107.5
1619	G	30.6	Very low	30.8	Very low	63 Å²	63	120.2 Å²	120.2	65%	0.649	78%	0.78	S	S	*	*			cis	159.4	105.2	-9.4	0	0	0	0	0	113.6
1620	S	28.3	Very low	30.3	Very low	128 Å²	128	120.4 Å²	120.4	90%	0.895	77%	0.774	S	S	*	*			trans	47.5	90.1	153.9	-178.4	0	0	0	0	120
1621	S	33.6	Very low	30.7	Very low	105 Å²	105	123.8 Å²	123.8	73%	0.734	78%	0.781	S	S	*	*			trans	-157.6	99.5	146.9	40	0	0	0	0	110.3
1622	S	34.3	Very low	31	Very low	107 Å²	107	124.4 Å²	124.4	75%	0.748	78%	0.776	S	S	*	*				72.6	105	103.7	68.9	0	0	0	0	114.9
1623	T	27.9	Very low	31	Very low	135 Å²	135	131.8 Å²	131.8	83%	0.828	78%	0.784	S	S	*	*			trans	-62.9	147.5	170.7	37.6	0	0	0	0	113.1
1624	P	33	Very low	31.3	Very low	113 Å²	113	131 Å²	131	73%	0.734	78%	0.78	S	S	*	*			trans	-115.1	126.2	139.3	33.3	-26.6	0	0	0	110.5
1625	S	27.2	Very low	31.5	Very low	111 Å²	111	130.7 Å²	130.7	78%	0.776	78%	0.775	S	S	*	*			trans	-76.9	139	166.6	-65.5	0	0	0	0	110.9
1626	F	32.2	Very low	31.9	Very low	205 Å²	205	131.1 Å²	131.1	90%	0.899	78%	0.778	S	S	*	*			trans	-145.8	111.9	161.1	-97.2	-80.1	0	0	0	108
1627	G	30.5	Very low	31.9	Very low	60 Å²	60	129.4 Å²	129.4	62%	0.619	78%	0.777	S	S	*	*			cis	123.7	113.3	-13.9	0	0	0	0	0	114.2
1628	A	29.8	Very low	32.1	Very low	77 Å²	77	130.6 Å²	130.6	64%	0.636	78%	0.783	S	S	*	*			trans	64.9	165.6	-179.4	0	0	0	0	0	114
1629	I	32.2	Very low	32.1	Very low	162 Å²	162	125.1 Å²	125.1	83%	0.831	78%	0.775	S	S	*	*			cis	-142.9	147.3	20.1	-59.5	168.4	0	0	0	109.3
1630	N	27.3	Very low	32.4	Very low	133 Å²	133	127.1 Å²	127.1	71%	0.711	78%	0.776	S	S	*	*			cis	-172.3	127.1	-35.1	-93	-16.3	0	0	0	108.2
1631	T	38.1	Very low	32.5	Very low	141 Å²	141	130.4 Å²	130.4	87%	0.865	78%	0.775	S	S	*	*			trans	-132.9	150.8	159.2	42.1	0	0	0	0	109.8
1632	P	35.6	Very low	32.5	Very low	124 Å²	124	133.5 Å²	133.5	81%	0.805	78%	0.78	S	S	*	*			trans	-88.7	136.3	-148.6	31.8	-36.2	0	0	0	116.8
1633	Y	31.4	Very low	32.5	Very low	223 Å²	223	134.2 Å²	134.2	88%	0.875	78%	0.78	S	S	*	*			trans	30.7	117.1	134.1	-113	-110.8	0	0	0	119.8
1634	T	35.7	Very low	33	Very low	122 Å²	122	131.9 Å²	131.9	75%	0.748	77%	0.767	S	S	*	*			trans	-78.3	165.8	147.6	66.8	0	0	0	0	109.3
1635	P	35.2	Very low	33.1	Very low	102 Å²	102	133.4 Å²	133.4	66%	0.662	76%	0.759	S	S	*	*				-146.9	168	79.3	39.7	-23.4	0	0	0	114.7
1636	S	34.5	Very low	33.6	Very low	118 Å²	118	132.2 Å²	132.2	83%	0.825	75%	0.747	S	S	*	*			trans	50.8	127	159.5	51.3	0	0	0	0	118.4
1637	G	31.4	Very low	34	Very low	67 Å²	67	125.9 Å²	125.9	69%	0.691	73%	0.727	S	S	*	*			cis	116.1	149.1	23.6	0	0	0	0	0	109.8
1638	Q	33.4	Very low	34.1	Very low	203 Å²	203	131.5 Å²	131.5	95%	0.949	74%	0.736	S	S	*	*			trans	79.1	131.4	-169.1	-55.9	-176.6	-47	0	0	115.8
1639	T	31.7	Very low	34.3	Very low	129 Å²	129	131.6 Å²	131.6	79%	0.791	74%	0.738	S	S	*	*			trans	-80.5	-171.5	171.4	52.3	0	0	0	0	110.1
1640	P	38.3	Very low	34.5	Very low	104 Å²	104	128.7 Å²	128.7	68%	0.675	73%	0.732	S	S	*	*			cis	-136.4	172.3	-6.7	22	3.3	0	0	0	116.2
1641	F	29.9	Very low	34.9	Very low	197 Å²	197	131.2 Å²	131.2	86%	0.864	74%	0.739	S	S	*	*			trans	65.2	157.5	142.2	-92.8	-117.5	0	0	0	123.9
1642	M	32.2	Very low	34.8	Very low	170 Å²	170	130.7 Å²	130.7	84%	0.837	74%	0.736	S	S	*	*			trans	83.1	143.8	161.3	-53.3	-145.5	73	0	0	121
1643	T	34.5	Very low	35.1	Very low	123 Å²	123	130.2 Å²	130.2	76%	0.755	73%	0.733	S	S	*	*			trans	-105.5	-164.3	175.9	58.6	0	0	0	0	108.8
1644	P	39.6	Very low	35.3	Very low	86 Å²	86	128.8 Å²	128.8	56%	0.558	73%	0.726	S	S	*	*			cis	-137.9	-176.9	-8.4	38.5	-18.5	0	0	0	116.2
1645	Y	34.5	Very low	35.4	Very low	144 Å²	144	132.9 Å²	132.9	57%	0.565	73%	0.729	S	S	*	*			trans	75.5	160.8	149.1	-68.3	-40.3	0	0	0	123.4	A1705	Y1645-A1705 VanDerWaalsContact CD1-CA 3.5Å; Y1645-A1705 HydrophobicContact CD1-CB 3.97Å; Y1645-A1705 HydrophobicContact CD2-CB 4.27Å; Y1645-A1705 HydrophobicContact CE1-CB 3.58Å; Y1645-A1705 HydrophobicContact CE2-CB 3.93Å; Y1645-A1705 HydrophobicContact CG-CB 4.3Å
1646	T	38.2	Very low	35.4	Very low	86 Å²	86	131.2 Å²	131.2	53%	0.528	73%	0.73	S	S	.	*	B	Isolated β-bridge	trans	-97.7	-141.7	-164.9	38.8	0	0	0	0	111.9	S1703 N1704	T1646-S1703 CarbonylContact O-C 3.46Å; T1646-S1703 WeakPolarHBondContact O-CA 3.46Å; T1646-S1703 PolarHBondContact O-N 2.85Å; T1646-N1704 CarbonylContact C-O 3.24Å; T1646-N1704 VanDerWaalsContact C-O 3.24Å; T1646-N1704 WeakPolarHBondContact CA-O 3.24Å; T1646-N1704 PolarHBondContact N-O 2.88Å; T1646-N1704 PolarHBondContact O-N 3.15Å; T1646-N1704 PolarHBondContact OG1-O 3.41Å
1647	P	39.3	Very low	35.3	Very low	72 Å²	72	134.4 Å²	134.4	47%	0.468	73%	0.732	S	S	.	*			cis	-140.6	-170.8	-13.2	44	-23.8	0	0	0	117.1
1648	H	32.5	Very low	35.5	Very low	178 Å²	178	138.1 Å²	138.1	82%	0.824	74%	0.736	S	S	*	*			trans	66.5	117	152.2	-72.2	-53.5	0	0	0	125
1649	A	35.5	Very low	35.5	Very low	80 Å²	80	134.8 Å²	134.8	66%	0.661	73%	0.729	S	S	*	*				90.7	121.1	115.7	0	0	0	0	0	124.6
1650	S	35.5	Very low	35.7	Very low	101 Å²	101	134.1 Å²	134.1	71%	0.706	73%	0.727	S	S	*	*			trans	73.8	124.7	135.3	75.1	0	0	0	0	121.8
1651	Q	36	Very low	35.7	Very low	186 Å²	186	134.5 Å²	134.5	87%	0.869	73%	0.732	S	S	*	*				-174.7	151.2	94.4	-94.4	174.1	42.5	0	0	112.4
1652	T	36.7	Very low	36.1	Very low	129 Å²	129	131.2 Å²	131.2	79%	0.791	73%	0.731	S	S	*	*			trans	-102.7	158.6	176.5	59.1	0	0	0	0	111.2
1653	P	42.1	Very low	36.1	Very low	115 Å²	115	128 Å²	128	75%	0.747	73%	0.725	S	S	*	*				-153.4	175	105.5	39.1	-21.9	0	0	0	113.8
1654	R	35.1	Very low	36.1	Very low	192 Å²	192	126.3 Å²	126.3	73%	0.725	72%	0.718	S	S	*	*			cis	-175.5	143.2	-22.8	-102.9	-178.2	173.8	-136.1	0.8	107.5
1655	Y	36.5	Very low	35.8	Very low	208 Å²	208	130.6 Å²	130.6	82%	0.816	73%	0.731	S	S	*	*			trans	64.3	150.3	157	-65.8	-143.8	0	0	0	116.8
1656	G	35.3	Very low	35.7	Very low	67 Å²	67	128.7 Å²	128.7	69%	0.691	74%	0.739	S	S	*	*			cis	168.1	140.1	-11.2	0	0	0	0	0	114.3
1657	H	34	Very low	35.6	Very low	185 Å²	185	129.1 Å²	129.1	86%	0.856	75%	0.745	S	S	*	*			trans	60.2	146.4	161	-77.4	-44.6	0	0	0	123.2
1658	N	34.7	Very low	35.4	Very low	146 Å²	146	131 Å²	131	78%	0.781	76%	0.759	S	S	*	*			trans	88.5	110.9	153.8	-62.8	-12.9	0	0	0	121.3
1659	V	34	Very low	35.5	Very low	132 Å²	132	127.1 Å²	127.1	80%	0.8	75%	0.752	S	S	*	*			trans	-34.1	160.3	140.5	-75.4	0	0	0	0	114.8
1660	P	36.2	Very low	35.3	Very low	115 Å²	115	131.3 Å²	131.3	75%	0.747	76%	0.758	S	S	*	*			cis	-137.8	-178.2	24.7	42.6	-25	0	0	0	117
1661	S	36.9	Very low	35.3	Very low	113 Å²	113	137.6 Å²	137.6	79%	0.79	77%	0.767	S	S	*	*			trans	-52.9	148	160.9	-39.3	0	0	0	0	111.5
1662	P	39.5	Very low	35.3	Very low	128 Å²	128	135.3 Å²	135.3	83%	0.831	76%	0.756	S	S	*	*				-142.3	176.7	99.8	39.8	-27.1	0	0	0	114.8
1663	S	31.3	Very low	35.2	Very low	102 Å²	102	135.8 Å²	135.8	71%	0.713	75%	0.749	S	S	*	*			trans	-90.1	171	-169.1	53.9	0	0	0	0	115.7
1664	S	33.7	Very low	34.9	Very low	88 Å²	88	140.5 Å²	140.5	62%	0.615	75%	0.753	S	S	*	*			trans	97.8	152.4	136.4	82.5	0	0	0	0	120.5
1665	Q	34.2	Very low	34.8	Very low	176 Å²	176	135 Å²	135	82%	0.822	76%	0.757	S	S	*	*			trans	71.6	143.2	166.3	-57.1	170.4	59.9	0	0	116
1666	S	32.4	Very low	34.6	Very low	104 Å²	104	131 Å²	131	73%	0.727	76%	0.759	S	S	*	*			cis	-166.4	159.5	-23.3	52.6	0	0	0	0	104.7
1667	S	36.4	Very low	34.5	Very low	95 Å²	95	132.7 Å²	132.7	66%	0.664	76%	0.76	S	S	*	*				174.3	127.4	64.6	35.1	0	0	0	0	106.7
1668	S	34.5	Very low	34.4	Very low	110 Å²	110	129.4 Å²	129.4	77%	0.769	76%	0.758	S	S	*	*				49.3	133.4	100.1	76.2	0	0	0	0	115.8
1669	S	34.4	Very low	34.3	Very low	97 Å²	97	126.3 Å²	126.3	68%	0.678	76%	0.761	S	S	*	*			cis	-176.9	153.4	8.1	39.4	0	0	0	0	113.4
1670	Q	31	Very low	34.3	Very low	168 Å²	168	127.2 Å²	127.2	79%	0.785	77%	0.767	S	S	*	*			trans	46.8	118.6	142.1	-64.9	175.1	-18.1	0	0	121.3
1671	R	35.9	Very low	34.1	Very low	233 Å²	233	125.1 Å²	125.1	88%	0.879	77%	0.766	S	S	*	*			trans	-154.3	128	132.5	-97.4	145.2	-166.1	-120.8	-0.1	107
1672	H	35.5	Very low	34	Very low	139 Å²	139	125.1 Å²	125.1	64%	0.644	77%	0.766	S	S	*	*				56.9	129.1	74.4	-58.9	-66.2	0	0	0	112.1
1673	H	35.5	Very low	33.9	Very low	139 Å²	139	125.2 Å²	125.2	64%	0.644	76%	0.764	S	S	*	*			cis	-163.3	171.3	-3.3	-115.2	-43	0	0	0	110.1
1674	Y	35.4	Very low	34.3	Very low	213 Å²	213	126.7 Å²	126.7	84%	0.835	77%	0.772	S	S	*	*			trans	7.4	142.3	159.3	-60.2	-74	0	0	0	121.5
1675	G	33.2	Very low	34.4	Very low	78 Å²	78	132.9 Å²	132.9	80%	0.804	78%	0.781	S	S	*	*			trans	162.8	82.2	149.1	0	0	0	0	0	117.4
1676	S	32.8	Very low	34.5	Very low	123 Å²	123	134.1 Å²	134.1	86%	0.86	78%	0.78	S	S	*	*			trans	-57.5	137.5	166.5	179.3	0	0	0	0	112.7
1677	S	32.7	Very low	34.7	Very low	103 Å²	103	136.3 Å²	136.3	72%	0.72	78%	0.779	S	S	*	*				176.1	166.5	112.2	-157.6	0	0	0	0	113.7
1678	S	32.3	Very low	34.7	Very low	115 Å²	115	139.1 Å²	139.1	80%	0.804	79%	0.786	S	S	*	*			trans	-39.5	144.8	171.1	56.7	0	0	0	0	117.4
1679	G	32.6	Very low	35.1	Very low	82 Å²	82	141.5 Å²	141.5	85%	0.845	79%	0.787	S	S	*	*			trans	-164.9	123.3	163.5	0	0	0	0	0	113.6
1680	T	33	Very low	35.3	Very low	151 Å²	151	140.8 Å²	140.8	93%	0.926	79%	0.794	S	S	*	*			trans	-99.3	144	175	49.8	0	0	0	0	112.3
1681	G	32.4	Very low	35.6	Very low	70 Å²	70	136.9 Å²	136.9	72%	0.722	80%	0.799	S	S	*	*			trans	116.2	130.5	143.7	0	0	0	0	0	119
1682	S	35.8	Very low	35.7	Very low	113 Å²	113	129.7 Å²	129.7	79%	0.79	80%	0.798	S	S	*	*			trans	60.9	109.1	138.8	-54.2	0	0	0	0	122.3
1683	T	38	Very low	35.8	Very low	130 Å²	130	127.2 Å²	127.2	80%	0.798	81%	0.81	S	S	*	*				27.9	136.2	127.2	60.2	0	0	0	0	120.6
1684	P	39.6	Very low	35.8	Very low	134 Å²	134	124.5 Å²	124.5	87%	0.87	82%	0.819	S	S	*	*				-145.6	-168.3	92.2	39.5	-23	0	0	0	116.3
1685	R	34.5	Very low	35.9	Very low	217 Å²	217	118.5 Å²	118.5	82%	0.819	82%	0.822	S	S	*	*			trans	-94.9	-177	-169.6	-61.8	175.7	172.5	170.4	-3.3	115
1686	Y	36.8	Very low	36.1	Very low	202 Å²	202	118.2 Å²	118.2	79%	0.792	82%	0.819	S	S	*	*			trans	102.2	150	156.7	-68.3	-89.3	0	0	0	115.8
1687	H	35.6	Very low	36.3	Very low	151 Å²	151	119.7 Å²	119.7	70%	0.699	82%	0.823	S	S	*	*			cis	167.8	116.3	-30.3	-138.1	-66.5	0	0	0	106.4
1688	D	38.3	Very low	36.4	Very low	153 Å²	153	118.6 Å²	118.6	82%	0.818	83%	0.828	S	S	*	*			trans	-175	127.5	156.8	-113	-0.4	0	0	0	106.5
1689	M	42.1	Very low	36.6	Very low	161 Å²	161	117 Å²	117	79%	0.793	83%	0.83	S	S	*	*			cis	82.8	128	49.4	-66.2	-67.3	-167.6	0	0	114.2
1690	G	37.7	Very low	36.7	Very low	81 Å²	81	117.4 Å²	117.4	84%	0.835	83%	0.834	S	S	*	*			trans	155.4	20.8	159.5	0	0	0	0	0	125.8
1691	G	37.1	Very low	36.7	Very low	86 Å²	86	114.1 Å²	114.1	89%	0.887	83%	0.83	S	S	*	*			trans	67.7	177.6	163	0	0	0	0	0	118.9
1692	G	38.2	Very low	36.9	Very low	83 Å²	83	114.3 Å²	114.3	86%	0.856	83%	0.832	S	S	*	*			cis	164.4	114.6	-13.4	0	0	0	0	0	116.4
1693	G	37.6	Very low	36.8	Very low	86 Å²	86	112.5 Å²	112.5	89%	0.887	82%	0.819	S	S	*	*			trans	85.2	156.3	165.3	0	0	0	0	0	117.3
1694	G	37.3	Very low	36.7	Very low	82 Å²	82	111.4 Å²	111.4	85%	0.845	81%	0.809	S	S	*	*			cis	165.8	142.7	-10.6	0	0	0	0	0	114.8
1695	G	36.8	Very low	36.3	Very low	87 Å²	87	106.1 Å²	106.1	90%	0.897	78%	0.776	S	S	*	*			trans	80.5	156.7	172.5	0	0	0	0	0	116.5
1696	G	36.7	Very low	36.2	Very low	72 Å²	72	106.3 Å²	106.3	74%	0.742	78%	0.778	S	S	*	*			cis	173.6	127.3	-10.8	0	0	0	0	0	116.1
1697	V	36.8	Very low	35.9	Very low	154 Å²	154	101.7 Å²	101.7	93%	0.933	78%	0.776	S	S	*	*			trans	57.1	119.9	141.5	-171.8	0	0	0	0	122.2
1698	G	36	Very low	35.7	Very low	80 Å²	80	99.9 Å²	99.9	83%	0.825	77%	0.769	S	S	*	*			trans	99.6	143.7	144.7	0	0	0	0	0	118
1699	G	35	Very low	35.2	Very low	82 Å²	82	97.1 Å²	97.1	85%	0.845	75%	0.751	S	S	*	*			cis	162.4	129.7	-12.8	0	0	0	0	0	115.5
1700	G	35.1	Very low	34.6	Very low	90 Å²	90	95.4 Å²	95.4	93%	0.928	75%	0.752	S	S	*	*			trans	80.3	147.7	165.9	0	0	0	0	0	117.9
1701	G	34.4	Very low	34.2	Very low	82 Å²	82	99.7 Å²	99.7	85%	0.845	75%	0.75	S	S	*	*			cis	168.8	145.9	-11.7	0	0	0	0	0	115.7
1702	G	34.9	Very low	33.9	Very low	74 Å²	74	103.6 Å²	103.6	76%	0.763	75%	0.745	S	S	*	*			trans	84	160.4	164.2	0	0	0	0	0	118.6
1703	S	34.1	Very low	33.5	Very low	76 Å²	76	107.9 Å²	107.9	53%	0.531	74%	0.743	S	S	.	*			cis	176.1	123.8	-19.4	46.6	0	0	0	0	112.4	T1646	T1646-S1703 CarbonylContact O-C 3.46Å; T1646-S1703 WeakPolarHBondContact O-CA 3.46Å; T1646-S1703 PolarHBondContact O-N 2.85Å
1704	N	35.2	Very low	33.3	Very low	107 Å²	107	110.3 Å²	110.3	57%	0.572	73%	0.731	S	S	*	*	B	Isolated β-bridge	trans	171.8	168.7	144	-92.6	-8.4	0	0	0	115.5	T1646	T1646-N1704 CarbonylContact C-O 3.24Å; T1646-N1704 VanDerWaalsContact C-O 3.24Å; T1646-N1704 WeakPolarHBondContact CA-O 3.24Å; T1646-N1704 PolarHBondContact N-O 2.88Å; T1646-N1704 PolarHBondContact O-N 3.15Å; T1646-N1704 PolarHBondContact OG1-O 3.41Å
1705	A	31.6	Very low	33.1	Very low	23 Å²	23	116.1 Å²	116.1	19%	0.19	73%	0.727	C	S	.	*			trans	-56.8	172.2	-164.6	0	0	0	0	0	117	Y1645	Y1645-A1705 VanDerWaalsContact CD1-CA 3.5Å; Y1645-A1705 HydrophobicContact CD1-CB 3.97Å; Y1645-A1705 HydrophobicContact CD2-CB 4.27Å; Y1645-A1705 HydrophobicContact CE1-CB 3.58Å; Y1645-A1705 HydrophobicContact CE2-CB 3.93Å; Y1645-A1705 HydrophobicContact CG-CB 4.3Å
1706	Y	33.2	Very low	32.9	Very low	220 Å²	220	116 Å²	116	86%	0.863	72%	0.718	S	S	*	*			cis	-133.6	-165.4	43.1	-81.1	-94.7	0	0	0	115.8
1707	S	30	Very low	32.9	Very low	106 Å²	106	120.2 Å²	120.2	74%	0.741	72%	0.716	S	S	*	*			trans	-103	153.1	-166.6	-173.9	0	0	0	0	114.1
1708	M	31.1	Very low	32.9	Very low	113 Å²	113	117.4 Å²	117.4	56%	0.557	69%	0.693	S	S	*	*			trans	179.8	150.4	130.3	-100.1	-57.4	176.1	0	0	115	D1107 Y1126	D1107-M1708 VanDerWaalsContact OD2-CE 3.31Å; D1107-M1708 WeakPolarHBondContact OD2-CE 3.38Å; Y1126-M1708 VanDerWaalsContact OH-CE 3.26Å; Y1126-M1708 WeakPolarHBondContact OH-CE 3.47Å
1709	Q	29.5	Very low	32.9	Very low	94 Å²	94	119.6 Å²	119.6	44%	0.439	69%	0.686	S	S	.	*			trans	35.9	113.7	159.3	-54.9	-166.3	-35.7	0	0	122	R1129	R1129-Q1709 VanDerWaalsContact NH2-OE1 3.09Å
1710	P	28.2	Very low	32.9	Very low	126 Å²	126	120.4 Å²	120.4	82%	0.818	67%	0.67	S	S	*	*			trans	-109.1	54.7	175.2	40.8	-34.2	0	0	0	115.7	H1712	P1710-H1712 PolarHBondContact O-N 3.47Å
1711	H	28.6	Very low	33.2	Very low	171 Å²	171	120 Å²	120	79%	0.792	65%	0.647	S	S	*	*			trans	-78.8	43.1	-178.6	-110.6	-60.1	0	0	0	115.1
1712	H	31.9	Very low	33.2	Very low	167 Å²	167	121.7 Å²	121.7	77%	0.773	63%	0.628	S	S	*	*			trans	-141.2	26.4	-168.9	-107.7	36.7	0	0	0	117.2	P1710	P1710-H1712 PolarHBondContact O-N 3.47Å
1713	Q	30.2	Very low	33.3	Very low	173 Å²	173	123.6 Å²	123.6	81%	0.808	62%	0.617	S	S	*	*	S	Bend	trans	-121.1	-4.1	176.3	-69.8	-168.5	-4.6	0	0	117
1714	Q	32.6	Very low	33.4	Very low	137 Å²	137	124 Å²	124	64%	0.64	61%	0.612	S	S	*	*	S	Bend	trans	-78.5	-39.3	177.2	-112.8	156	-47.6	0	0	113.6	A1716 K1717	Q1714-A1716 PolarHBondContact O-N 2.85Å; Q1714-K1717 PolarHBondContact O-N 3.33Å
1715	R	33	Very low	33.7	Very low	204 Å²	204	120.2 Å²	120.2	77%	0.77	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.6	-7	-177.1	-82	-174.6	168.9	-175.6	-4.6	116.5
1716	A	33.5	Very low	34	Very low	86 Å²	86	123.1 Å²	123.1	71%	0.711	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.1	-1.8	-179.9	0	0	0	0	0	114.7	Q1714	Q1714-A1716 PolarHBondContact O-N 2.85Å
1717	K	36.6	Very low	34.1	Very low	159 Å²	159	115.1 Å²	115.1	69%	0.691	58%	0.581	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.5	-36.9	179.6	-81.9	-178.1	172	176.8	0	114.2	Q1714 N1719 L1720 D1721	Q1714-K1717 PolarHBondContact O-N 3.33Å; K1717-N1719 PolarHBondContact O-N 2.95Å; K1717-L1720 VanDerWaalsContact O-CB 3.24Å; K1717-L1720 WeakPolarHBondContact O-CB 3.48Å; K1717-L1720 PolarHBondContact O-N 3.44Å; K1717-D1721 PolarHBondContact O-N 3.28Å
1718	E	37	Very low	34.5	Very low	95 Å²	95	111.5 Å²	111.5	44%	0.444	56%	0.557	S	S	.	*	H	α-helix	trans	-69.5	-32.9	-168.6	-69.6	158.9	-154.6	0	0	114	L1720 D1721	E1718-L1720 PolarHBondContact O-N 3.03Å; E1718-D1721 PolarHBondContact O-N 2.92Å
1719	N	36	Very low	34.8	Very low	126 Å²	126	113.3 Å²	113.3	67%	0.674	56%	0.558	S	S	*	*	H	α-helix	trans	-71.4	-20.7	172.2	-77.9	3.1	0	0	0	112.7	K1717	K1717-N1719 PolarHBondContact O-N 2.95Å
1720	L	34.2	Very low	35	Very low	99 Å²	99	112.7 Å²	112.7	52%	0.518	57%	0.569	S	S	.	*	H	α-helix	trans	-76.3	-32.7	177	-147.3	75.3	0	0	0	111.3	K1717 E1718 W1722 Q1723 L1724	K1717-L1720 VanDerWaalsContact O-CB 3.24Å; K1717-L1720 WeakPolarHBondContact O-CB 3.48Å; K1717-L1720 PolarHBondContact O-N 3.44Å; E1718-L1720 PolarHBondContact O-N 3.03Å; L1720-W1722 VanDerWaalsContact C-N 3.34Å; L1720-W1722 PolarHBondContact O-N 2.88Å; L1720-Q1723 PolarHBondContact O-N 2.8Å; L1720-L1724 HydrophobicContact CB-CD1 4.39Å; L1720-L1724 HydrophobicContact CD2-CD1 3.75Å; L1720-L1724 HydrophobicContact CG-CD1 3.74Å; L1720-L1724 HydrophobicContact CG-CG 4.25Å; L1720-L1724 WeakPolarHBondContact O-CB 3.38Å; L1720-L1724 VanDerWaalsContact O-CG 3.23Å; L1720-L1724 WeakPolarHBondContact O-CG 3.22Å; L1720-L1724 PolarHBondContact O-N 3.11Å
1721	D	41.4	Very low	35.1	Very low	83 Å²	83	115 Å²	115	44%	0.444	56%	0.561	S	S	.	*	H	α-helix	trans	-68.5	-28.7	-170.3	-123.9	-37.3	0	0	0	113.8	K1717 E1718 L1724 A1725	K1717-D1721 PolarHBondContact O-N 3.28Å; E1718-D1721 PolarHBondContact O-N 2.92Å; D1721-L1724 CarbonylContact O-C 3.51Å; D1721-A1725 WeakPolarHBondContact O-CB 3.47Å; D1721-A1725 PolarHBondContact O-N 2.56Å
1722	W	34.4	Very low	35.4	Very low	116 Å²	116	114.1 Å²	114.1	44%	0.439	55%	0.551	S	S	.	*	H	α-helix	trans	-88.1	-33.7	176.5	-97	90	0	0	0	114.3	K757 L1720 L1724 A1725 N1726	K757-W1722 VanDerWaalsContact CE-CD1 3.44Å; K757-W1722 VanDerWaalsContact CE-CD2 3.5Å; K757-W1722 VanDerWaalsContact CE-CE2 3.42Å; K757-W1722 VanDerWaalsContact CE-CG 3.47Å; K757-W1722 VanDerWaalsContact NZ-CE2 3.29Å; K757-W1722 VanDerWaalsContact NZ-CG 3.31Å; L1720-W1722 VanDerWaalsContact C-N 3.34Å; L1720-W1722 PolarHBondContact O-N 2.88Å; W1722-L1724 VanDerWaalsContact C-N 3.28Å; W1722-A1725 HydrophobicContact CD2-CB 4.32Å; W1722-A1725 HydrophobicContact CE3-CB 4.15Å; W1722-A1725 WeakPolarHBondContact O-CB 3.47Å; W1722-A1725 PolarHBondContact O-N 3.48Å; W1722-A1725 VanDerWaalsContact O-N 3.07Å; W1722-N1726 PolarHBondContact O-N 2.8Å
1723	Q	36.3	Very low	35.2	Very low	115 Å²	115	115 Å²	115	54%	0.537	55%	0.548	S	S	.	.	H	α-helix	trans	-62.6	-40.9	164.2	-78.5	-172.7	-38.5	0	0	109.8	L1720 A1725 N1726 D1727	L1720-Q1723 PolarHBondContact O-N 2.8Å; Q1723-A1725 PolarHBondContact O-N 3.21Å; Q1723-N1726 PolarHBondContact O-N 3Å; Q1723-D1727 VanDerWaalsContact O-CB 3.22Å; Q1723-D1727 WeakPolarHBondContact O-CB 3.07Å; Q1723-D1727 PolarHBondContact O-N 3.49Å
1724	L	38.1	Very low	35.3	Very low	83 Å²	83	110.9 Å²	110.9	44%	0.435	54%	0.536	S	S	.	.	H	α-helix	trans	-74.8	-1	170.3	-66.3	172.4	0	0	0	114.6	K332 L1720 D1721 W1722 A1728	K332-L1724 PolarHBondContact NZ-O 2.84Å; L1720-L1724 HydrophobicContact CB-CD1 4.39Å; L1720-L1724 HydrophobicContact CD2-CD1 3.75Å; L1720-L1724 HydrophobicContact CG-CD1 3.74Å; L1720-L1724 HydrophobicContact CG-CG 4.25Å; L1720-L1724 WeakPolarHBondContact O-CB 3.38Å; L1720-L1724 VanDerWaalsContact O-CG 3.23Å; L1720-L1724 WeakPolarHBondContact O-CG 3.22Å; L1720-L1724 PolarHBondContact O-N 3.11Å; D1721-L1724 CarbonylContact O-C 3.51Å; W1722-L1724 VanDerWaalsContact C-N 3.28Å; L1724-A1728 WeakPolarHBondContact O-CB 3.49Å; L1724-A1728 PolarHBondContact O-N 2.74Å
1725	A	39.8	Very low	35	Very low	28 Å²	28	113.6 Å²	113.6	23%	0.231	55%	0.549	C	S	.	.	H	α-helix	trans	-82.8	-58.6	166	0	0	0	0	0	108.5	D1721 W1722 Q1723 A1728 W1729	D1721-A1725 WeakPolarHBondContact O-CB 3.47Å; D1721-A1725 PolarHBondContact O-N 2.56Å; W1722-A1725 HydrophobicContact CD2-CB 4.32Å; W1722-A1725 HydrophobicContact CE3-CB 4.15Å; W1722-A1725 WeakPolarHBondContact O-CB 3.47Å; W1722-A1725 PolarHBondContact O-N 3.48Å; W1722-A1725 VanDerWaalsContact O-N 3.07Å; Q1723-A1725 PolarHBondContact O-N 3.21Å; A1725-A1728 PolarHBondContact O-N 3.36Å; A1725-A1728 VanDerWaalsContact O-N 3.16Å; A1725-W1729 PolarHBondContact O-N 3.24Å; A1725-W1729 VanDerWaalsContact O-N 3.14Å
1726	N	39.3	Very low	34.9	Very low	85 Å²	85	112.3 Å²	112.3	46%	0.455	55%	0.551	S	S	.	*	H	α-helix	trans	-62	-46.3	178.3	-67.5	15.1	0	0	0	111.4	W1722 Q1723 A1728 W1729 A1730	W1722-N1726 PolarHBondContact O-N 2.8Å; Q1723-N1726 PolarHBondContact O-N 3Å; N1726-A1728 VanDerWaalsContact C-N 3.33Å; N1726-A1728 PolarHBondContact O-N 2.77Å; N1726-W1729 PolarHBondContact O-N 3.17Å; N1726-A1730 PolarHBondContact O-N 3.43Å
1727	D	35.2	Very low	34.8	Very low	51 Å²	51	117.1 Å²	117.1	27%	0.273	56%	0.559	S	S	.	*	H	α-helix	trans	-66.2	-30.4	175.1	-94.5	-31.4	0	0	0	112.8	Q1723 W1729 A1730 R1731	Q1723-D1727 VanDerWaalsContact O-CB 3.22Å; Q1723-D1727 WeakPolarHBondContact O-CB 3.07Å; Q1723-D1727 PolarHBondContact O-N 3.49Å; D1727-W1729 VanDerWaalsContact C-N 3.35Å; D1727-A1730 PolarHBondContact O-N 3.22Å; D1727-R1731 VanDerWaalsContact CG-CZ 3.41Å; D1727-R1731 WeakPolarHBondContact O-CA 3.04Å; D1727-R1731 WeakPolarHBondContact O-CB 3.49Å; D1727-R1731 WeakPolarHBondContact O-CG 3.44Å; D1727-R1731 PolarHBondContact O-N 3.06Å; D1727-R1731 IonicContact OD1-CZ 3.51Å; D1727-R1731 IonicContact OD1-NE 3.91Å; D1727-R1731 PolarHBondContact OD1-NE 3.25Å; D1727-R1731 IonicContact OD1-NH2 2.73Å; D1727-R1731 PolarHBondContact OD1-NH2 3.29Å; D1727-R1731 IonicContact OD2-CZ 1.78Å; D1727-R1731 VanDerWaalsContact OD2-CZ 3.26Å; D1727-R1731 IonicContact OD2-NE 2.77Å; D1727-R1731 PolarHBondContact OD2-NE 2.96Å; D1727-R1731 IonicContact OD2-NH2 3.65Å; D1727-R1731 PolarHBondContact OD2-NH2 3.27Å
1728	A	38.6	Very low	34.4	Very low	30 Å²	30	118.9 Å²	118.9	25%	0.248	57%	0.569	C	S	.	*	H	α-helix	trans	-71.8	-31.7	177.1	0	0	0	0	0	112.3	L1724 A1725 N1726	L1724-A1728 WeakPolarHBondContact O-CB 3.49Å; L1724-A1728 PolarHBondContact O-N 2.74Å; A1725-A1728 PolarHBondContact O-N 3.36Å; A1725-A1728 VanDerWaalsContact O-N 3.16Å; N1726-A1728 VanDerWaalsContact C-N 3.33Å; N1726-A1728 PolarHBondContact O-N 2.77Å
1729	W	37	Very low	34.2	Very low	151 Å²	151	118.6 Å²	118.6	57%	0.572	58%	0.578	S	S	*	*	H	α-helix	trans	-66.3	-47.3	167.7	-99.4	53.3	0	0	0	111	A1725 N1726 D1727 R1731	A1725-W1729 PolarHBondContact O-N 3.24Å; A1725-W1729 VanDerWaalsContact O-N 3.14Å; N1726-W1729 PolarHBondContact O-N 3.17Å; D1727-W1729 VanDerWaalsContact C-N 3.35Å; W1729-R1731 PolarHBondContact O-N 2.61Å
1730	A	34.2	Very low	33.9	Very low	82 Å²	82	121 Å²	121	68%	0.678	59%	0.585	S	S	*	*	H	α-helix	trans	-69.7	-23.2	179.2	0	0	0	0	0	115	N1726 D1727	N1726-A1730 PolarHBondContact O-N 3.43Å; D1727-A1730 PolarHBondContact O-N 3.22Å
1731	R	30.2	Very low	33.8	Very low	173 Å²	173	124.9 Å²	124.9	65%	0.653	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-120.8	22.7	-166.6	-55.1	-176.1	-166.3	-163.4	11.5	116.6	D1727 W1729 R1733	D1727-R1731 VanDerWaalsContact CG-CZ 3.41Å; D1727-R1731 WeakPolarHBondContact O-CA 3.04Å; D1727-R1731 WeakPolarHBondContact O-CB 3.49Å; D1727-R1731 WeakPolarHBondContact O-CG 3.44Å; D1727-R1731 PolarHBondContact O-N 3.06Å; D1727-R1731 IonicContact OD1-CZ 3.51Å; D1727-R1731 IonicContact OD1-NE 3.91Å; D1727-R1731 PolarHBondContact OD1-NE 3.25Å; D1727-R1731 IonicContact OD1-NH2 2.73Å; D1727-R1731 PolarHBondContact OD1-NH2 3.29Å; D1727-R1731 IonicContact OD2-CZ 1.78Å; D1727-R1731 VanDerWaalsContact OD2-CZ 3.26Å; D1727-R1731 IonicContact OD2-NE 2.77Å; D1727-R1731 PolarHBondContact OD2-NE 2.96Å; D1727-R1731 IonicContact OD2-NH2 3.65Å; D1727-R1731 PolarHBondContact OD2-NH2 3.27Å; W1729-R1731 PolarHBondContact O-N 2.61Å; R1731-R1733 PolarHBondContact O-N 3.08Å
1732	R	33.9	Very low	33.3	Very low	153 Å²	153	125.7 Å²	125.7	58%	0.577	61%	0.613	S	S	*	*			trans	-77.5	65.1	164	-79.3	-169.5	176	-164.7	2.3	112.6	P1734	R1732-P1734 WeakPolarHBondContact O-CD 3.45Å
1733	R	28.1	Very low	33.2	Very low	187 Å²	187	131.4 Å²	131.4	71%	0.706	64%	0.636	S	S	*	*			trans	-87.3	111.8	154.3	-78.8	-167.5	174.7	-153.2	-1.5	108.4	R1731 Q1735	R1731-R1733 PolarHBondContact O-N 3.08Å; R1733-Q1735 PolarHBondContact O-N 2.74Å
1734	P	32.1	Very low	33	Very low	86 Å²	86	134.7 Å²	134.7	56%	0.558	65%	0.651	S	S	*	*			trans	-63.5	130.1	169.7	-18.4	32	0	0	0	109.8	R1732 Q1736	R1732-P1734 WeakPolarHBondContact O-CD 3.45Å; P1734-Q1736 PolarHBondContact O-N 3.22Å; P1734-Q1736 VanDerWaalsContact O-N 3.07Å
1735	Q	26.9	Very low	32.8	Very low	194 Å²	194	134.1 Å²	134.1	91%	0.907	66%	0.658	S	S	*	*			trans	-70.9	99.6	163	-72.9	-170.8	-1.9	0	0	108	R1733 H1737	R1733-Q1735 PolarHBondContact O-N 2.74Å; Q1735-H1737 PolarHBondContact O-N 3.1Å
1736	Q	30.1	Very low	32.4	Very low	176 Å²	176	140.5 Å²	140.5	82%	0.822	68%	0.683	S	S	*	*			trans	-63.6	122.3	170.6	-78	-176.6	-23.5	0	0	109.4	P1734 Q1738	P1734-Q1736 PolarHBondContact O-N 3.22Å; P1734-Q1736 VanDerWaalsContact O-N 3.07Å; Q1736-Q1738 PolarHBondContact O-N 2.86Å
1737	H	31.3	Very low	32.1	Very low	188 Å²	188	143.6 Å²	143.6	87%	0.87	70%	0.695	S	S	*	*			trans	-59.6	105.1	167.1	-98.4	-69.9	0	0	0	109.4	Q1735 S1739	Q1735-H1737 PolarHBondContact O-N 3.1Å; H1737-S1739 PolarHBondContact O-N 3.01Å; H1737-S1739 VanDerWaalsContact O-N 3.16Å
1738	Q	28.8	Very low	32	Very low	195 Å²	195	148.7 Å²	148.7	91%	0.911	72%	0.717	S	S	*	*			trans	-71.6	106.2	167.7	-70.9	-173.6	-5.8	0	0	109.1	Q1736	Q1736-Q1738 PolarHBondContact O-N 2.86Å
1739	S	31.5	Very low	31.8	Very low	90 Å²	90	154.4 Å²	154.4	63%	0.629	74%	0.738	S	S	*	*			trans	-111.4	128.2	167.2	59.1	0	0	0	0	109.5	H1737	H1737-S1739 PolarHBondContact O-N 3.01Å; H1737-S1739 VanDerWaalsContact O-N 3.16Å
1740	H	31	Very low	31.6	Very low	177 Å²	177	153.5 Å²	153.5	82%	0.819	74%	0.74	S	S	*	*			trans	63.8	133.7	-175.5	-45.1	-87.7	0	0	0	113.4
1741	Q	31.6	Very low	31.6	Very low	179 Å²	179	157.5 Å²	157.5	84%	0.836	75%	0.745	S	S	*	*			cis	-140.2	155.1	33	-68.5	174.1	8.1	0	0	113.5
1742	S	30.9	Very low	31.8	Very low	101 Å²	101	153 Å²	153	71%	0.706	74%	0.74	S	S	*	*			trans	-59.1	138.5	169.6	51.5	0	0	0	0	113.9
1743	Y	31.3	Very low	31.9	Very low	235 Å²	235	153.4 Å²	153.4	92%	0.922	75%	0.748	S	S	*	*			trans	-134.2	151.1	138.8	-99.6	-78.5	0	0	0	110.9
1744	H	33.5	Very low	32.4	Very low	184 Å²	184	152 Å²	152	85%	0.852	75%	0.749	S	S	*	*			trans	-111.2	178.5	-162.3	-135.6	-74.2	0	0	0	111.6
1745	A	33	Very low	32.5	Very low	72 Å²	72	156.2 Å²	156.2	60%	0.595	76%	0.762	S	S	*	*			trans	80.3	144.2	169.5	0	0	0	0	0	115.1
1746	Q	33	Very low	33.2	Very low	161 Å²	161	151.4 Å²	151.4	75%	0.752	75%	0.747	S	S	*	*			cis	-160.7	169.7	-6	-111.1	166.6	43	0	0	105.9
1747	Q	31.9	Very low	33.5	Very low	151 Å²	151	150.1 Å²	150.1	71%	0.706	74%	0.741	S	S	*	*			cis	-167.4	149	20.5	-140.4	173.5	77.4	0	0	108.4
1748	Q	32.8	Very low	33.8	Very low	157 Å²	157	149.1 Å²	149.1	73%	0.734	74%	0.739	S	S	*	*			trans	144.4	122.6	141	-82.1	-179.7	21.6	0	0	114.4
1749	H	33.8	Very low	34.1	Very low	151 Å²	151	142.9 Å²	142.9	70%	0.699	73%	0.727	S	S	*	*			trans	56.9	138.4	161.4	-53	-60.4	0	0	0	118.9
1750	H	34.2	Very low	34.3	Very low	131 Å²	131	147.9 Å²	147.9	61%	0.606	74%	0.743	S	S	*	*			cis	-157.7	133.6	-10.4	-125.6	-64.2	0	0	0	109.9
1751	H	33.7	Very low	34.5	Very low	167 Å²	167	145.2 Å²	145.2	77%	0.773	74%	0.744	S	S	*	*			trans	61.6	149.8	155.6	-68.9	-18.9	0	0	0	119.6
1752	S	34.8	Very low	34.6	Very low	79 Å²	79	144.8 Å²	144.8	55%	0.552	74%	0.744	S	S	*	*			cis	-169.6	156.1	-12	54.6	0	0	0	0	112
1753	Q	36.1	Very low	34.8	Very low	160 Å²	160	146.8 Å²	146.8	75%	0.748	75%	0.747	S	S	*	*			trans	68.7	143.4	157.1	-69.4	171.8	78.8	0	0	117.1
1754	Q	38	Very low	35.1	Very low	157 Å²	157	143.9 Å²	143.9	73%	0.734	74%	0.744	S	S	*	*			cis	-144.7	141.7	-15	-85.7	155.2	45	0	0	104.7
1755	Q	34.9	Very low	35.2	Very low	175 Å²	175	139 Å²	139	82%	0.818	74%	0.744	S	S	*	*				57.5	148.4	62	-82.1	-152.8	16.2	0	0	115.8
1756	P	40.8	Very low	35.3	Very low	94 Å²	94	143.4 Å²	143.4	61%	0.61	76%	0.755	S	S	*	*			cis	-147.7	-176.2	-24.5	36.8	-15.7	0	0	0	116.7
1757	H	37.1	Very low	35.5	Very low	149 Å²	149	142.4 Å²	142.4	69%	0.69	76%	0.76	S	S	*	*			trans	93.1	140.2	131.2	-106.5	-61.5	0	0	0	125.1
1758	M	37.6	Very low	35.6	Very low	166 Å²	166	144 Å²	144	82%	0.818	77%	0.77	S	S	*	*			trans	67.8	147.6	161.2	-51.6	-53.2	-176.1	0	0	118.4
1759	G	35.2	Very low	35.7	Very low	65 Å²	65	142 Å²	142	67%	0.67	77%	0.773	S	S	*	*			cis	156.5	130.5	-11.6	0	0	0	0	0	114.7
1760	M	34.8	Very low	35.8	Very low	195 Å²	195	143 Å²	143	96%	0.961	78%	0.783	S	S	*	*			trans	32.4	130.5	156.1	-60.4	179.5	174.3	0	0	120.9
1761	S	35.1	Very low	35.8	Very low	120 Å²	120	140.5 Å²	140.5	84%	0.839	79%	0.793	S	S	*	*				173.8	172.2	96.8	-158.5	0	0	0	0	113.7
1762	M	33.4	Very low	36	Very low	170 Å²	170	144.9 Å²	144.9	84%	0.837	80%	0.803	S	S	*	*			trans	-81.8	163.3	-175.7	-44	168.4	-169.2	0	0	113.1
1763	N	36.7	Very low	36.1	Very low	143 Å²	143	144.1 Å²	144.1	77%	0.765	81%	0.807	S	S	*	*				158.7	155.3	95.7	-157.1	20.6	0	0	0	115.2
1764	M	36.2	Very low	36.1	Very low	175 Å²	175	143.7 Å²	143.7	86%	0.862	82%	0.816	S	S	*	*			trans	-8.4	145.9	162.4	-65.1	-93.1	-163.1	0	0	121.4
1765	G	35.9	Very low	36	Very low	82 Å²	82	140 Å²	140	85%	0.845	82%	0.82	S	S	*	*			trans	171.3	90.8	156	0	0	0	0	0	118.9
1766	I	35.8	Very low	36.1	Very low	163 Å²	163	135.9 Å²	135.9	84%	0.836	82%	0.824	S	S	*	*			trans	-68.5	136.8	175.3	-51.6	162.1	0	0	0	112.2
1767	T	36.2	Very low	35.9	Very low	140 Å²	140	135.3 Å²	135.3	86%	0.859	84%	0.835	S	S	*	*				174.1	156.1	125.9	30	0	0	0	0	116.9
1768	M	33.8	Very low	35.9	Very low	184 Å²	184	132.4 Å²	132.4	91%	0.906	85%	0.846	S	S	*	*			trans	-47.5	147.6	177.1	-54.8	-77.5	-170.9	0	0	117
1769	S	36.2	Very low	35.9	Very low	116 Å²	116	128.6 Å²	128.6	81%	0.811	85%	0.849	S	S	*	*				178.3	170.2	112.3	-159.9	0	0	0	0	113.3
1770	L	34.4	Very low	35.9	Very low	172 Å²	172	129.4 Å²	129.4	90%	0.901	86%	0.857	S	S	*	*			trans	-77.8	156.3	176.9	-51.5	88.3	0	0	0	112.7
1771	G	36.1	Very low	36	Very low	79 Å²	79	123.3 Å²	123.3	81%	0.814	85%	0.845	S	S	*	*			trans	175.9	124.4	162.7	0	0	0	0	0	116.5
1772	R	36.4	Very low	36	Very low	259 Å²	259	129.2 Å²	129.2	98%	0.977	85%	0.85	S	S	*	*			trans	-71.7	155.5	166.4	-71.5	171	158.5	-166.6	-5.6	111.4
1773	G	37.1	Very low	36.1	Very low	63 Å²	63	124.4 Å²	124.4	65%	0.649	84%	0.844	S	S	*	*				125.3	107.3	127.7	0	0	0	0	0	119.4
1774	T	36.9	Very low	36.2	Very low	151 Å²	151	123.4 Å²	123.4	93%	0.926	85%	0.848	S	S	*	*				38.5	125.8	129.9	57.4	0	0	0	0	121.7
1775	G	36.2	Very low	36.2	Very low	79 Å²	79	121 Å²	121	81%	0.814	84%	0.844	S	S	*	*				134.8	89	129.8	0	0	0	0	0	120.3
1776	G	36.7	Very low	36.6	Very low	89 Å²	89	123 Å²	123	92%	0.918	84%	0.841	S	S	*	*			trans	45.7	155.3	133	0	0	0	0	0	125.4
1777	G	36.5	Very low	36.7	Very low	81 Å²	81	120.5 Å²	120.5	84%	0.835	83%	0.834	S	S	*	*			trans	142.4	105.8	145.3	0	0	0	0	0	119.4
1778	G	36.6	Very low	36.7	Very low	89 Å²	89	120 Å²	120	92%	0.918	83%	0.826	S	S	*	*			trans	76	152.4	161.9	0	0	0	0	0	116.7
1779	G	36.8	Very low	36.7	Very low	86 Å²	86	116 Å²	116	89%	0.887	81%	0.808	S	S	*	*			cis	128	140.5	3.6	0	0	0	0	0	110.8
1780	G	35.7	Very low	36.8	Very low	82 Å²	82	119.6 Å²	119.6	85%	0.845	81%	0.805	S	S	*	*			cis	177.7	-178.8	-2.6	0	0	0	0	0	110.3
1781	G	36.4	Very low	36.9	Very low	67 Å²	67	116 Å²	116	69%	0.691	80%	0.795	S	S	*	*			trans	112.4	139.3	175.6	0	0	0	0	0	115.2
1782	Y	34.9	Very low	37	Very low	243 Å²	243	118.7 Å²	118.7	95%	0.953	80%	0.795	S	S	*	*			cis	144.6	125	-20	-90.4	-55	0	0	0	109
1783	G	36.6	Very low	36.9	Very low	69 Å²	69	110.3 Å²	110.3	71%	0.711	79%	0.79	S	S	*	*			trans	91.9	152.1	166.2	0	0	0	0	0	116.5
1784	S	38.6	Very low	36.7	Very low	122 Å²	122	111.3 Å²	111.3	85%	0.853	80%	0.8	S	S	*	*			cis	-161.2	158.5	-12.7	-83.4	0	0	0	0	110.2
1785	T	37.1	Very low	36.6	Very low	126 Å²	126	107.5 Å²	107.5	77%	0.773	79%	0.791	S	S	*	*			trans	-78.9	154.8	171.1	47.3	0	0	0	0	112.4
1786	P	43.3	Very low	36.5	Very low	122 Å²	122	112.6 Å²	112.6	79%	0.792	79%	0.793	S	S	*	*				-129.5	156.8	107.1	8.4	13.6	0	0	0	112.3
1787	V	38.2	Very low	36.4	Very low	111 Å²	111	115.5 Å²	115.5	67%	0.673	79%	0.787	S	S	*	*			cis	107.1	116.2	20.2	168.5	0	0	0	0	113.3
1788	N	35.3	Very low	36.2	Very low	129 Å²	129	123.4 Å²	123.4	69%	0.69	79%	0.792	S	S	*	*			trans	70.3	158.5	154.7	-74.3	32.4	0	0	0	119.7
1789	D	35.6	Very low	35.9	Very low	101 Å²	101	122.8 Å²	122.8	54%	0.54	79%	0.786	S	S	.	*			cis	-160.4	178	4	-128.3	-29.6	0	0	0	114.3
1790	Y	36.4	Very low	35.7	Very low	191 Å²	191	127.6 Å²	127.6	75%	0.749	79%	0.788	S	S	*	*			trans	73.6	113.7	161.7	-53.5	-46.8	0	0	0	119
1791	S	37	Very low	35.5	Very low	98 Å²	98	128.4 Å²	128.4	69%	0.685	78%	0.78	S	S	*	*				88.2	137.9	70	-67.9	0	0	0	0	113.3
1792	T	37.9	Very low	35.3	Very low	134 Å²	134	129.4 Å²	129.4	82%	0.822	78%	0.776	S	S	*	*			cis	-163.2	137.4	5.3	6.6	0	0	0	0	112
1793	G	34.3	Very low	35.1	Very low	84 Å²	84	127 Å²	127	87%	0.866	77%	0.771	S	S	*	*			trans	71.9	146.6	162.7	0	0	0	0	0	117.2
1794	G	33.8	Very low	34.9	Very low	84 Å²	84	128.4 Å²	128.4	87%	0.866	78%	0.776	S	S	*	*			cis	173.5	160	-7.8	0	0	0	0	0	110.9
1795	G	34	Very low	34.4	Very low	70 Å²	70	128.3 Å²	128.3	72%	0.722	78%	0.775	S	S	*	*			trans	109.8	81.8	167.5	0	0	0	0	0	118.6
1796	H	35	Very low	34.3	Very low	187 Å²	187	128.5 Å²	128.5	87%	0.866	78%	0.776	S	S	*	*			trans	64	151.6	148.3	-62.3	-27.7	0	0	0	123.9
1797	N	33.5	Very low	33.7	Very low	149 Å²	149	131.6 Å²	131.6	80%	0.797	77%	0.772	S	S	*	*			trans	51.4	95.7	165.3	-69	-0.2	0	0	0	121.6
1798	R	32.7	Very low	33.5	Very low	247 Å²	247	131.9 Å²	131.9	93%	0.932	78%	0.779	S	S	*	*				5.2	138.2	119.9	-56.2	174.7	179.6	176.9	-0.4	116
1799	G	31.3	Very low	33.4	Very low	77 Å²	77	131.9 Å²	131.9	79%	0.794	78%	0.784	S	S	*	*			cis	172.4	148.9	-1.3	0	0	0	0	0	110.8
1800	M	32.2	Very low	33.4	Very low	187 Å²	187	133.2 Å²	133.2	92%	0.921	80%	0.798	S	S	*	*			trans	-113.5	150.6	-169.2	-62.5	173.3	64.6	0	0	113.8
1801	S	32.4	Very low	33.3	Very low	98 Å²	98	135.9 Å²	135.9	69%	0.685	81%	0.806	S	S	*	*			trans	71.7	101.5	139.2	-158.3	0	0	0	0	121.2
1802	S	30.5	Very low	33.2	Very low	88 Å²	88	137.5 Å²	137.5	62%	0.615	81%	0.812	S	S	*	*				78.1	155.8	127	83.7	0	0	0	0	121.8
1803	K	32.2	Very low	33.2	Very low	194 Å²	194	139 Å²	139	84%	0.843	82%	0.815	S	S	*	*			trans	75.2	100.9	157.5	-64.7	173.4	-175.5	178.6	0	119.6
1804	A	31.1	Very low	33.3	Very low	97 Å²	97	139.4 Å²	139.4	80%	0.802	81%	0.81	S	S	*	*				66	127	122.3	0	0	0	0	0	121.9
1805	S	29.7	Very low	33.3	Very low	121 Å²	121	140.7 Å²	140.7	85%	0.846	81%	0.806	S	S	*	*			trans	79.5	169.9	148.7	-156.3	0	0	0	0	119
1806	V	33.2	Very low	33.6	Very low	130 Å²	130	142 Å²	142	79%	0.788	80%	0.802	S	S	*	*			trans	93	114.2	170.3	-173	0	0	0	0	117.5
1807	R	31.3	Very low	33.8	Very low	187 Å²	187	142 Å²	142	71%	0.706	80%	0.802	S	S	*	*			trans	-60.9	146	164	-66.8	169.6	161.1	-170	-7.6	112
1808	S	33.3	Very low	33.8	Very low	117 Å²	117	139.6 Å²	139.6	82%	0.818	80%	0.797	S	S	*	*			trans	-157.9	130.7	144.5	58.7	0	0	0	0	112
1809	T	34	Very low	34.1	Very low	129 Å²	129	136.8 Å²	136.8	79%	0.791	80%	0.797	S	S	*	*			trans	-75.7	150.2	178.9	50.9	0	0	0	0	112.7
1810	P	36.7	Very low	34.3	Very low	129 Å²	129	139.8 Å²	139.8	84%	0.838	79%	0.794	S	S	*	*			trans	-69.6	154.4	166.7	31.6	-34.5	0	0	0	111
1811	R	34.4	Very low	34.5	Very low	246 Å²	246	139 Å²	139	93%	0.928	79%	0.793	S	S	*	*			trans	-110.3	135	172.6	-94.3	-176.4	165	-177.7	-4.8	110.5
1812	T	33.5	Very low	34.7	Very low	132 Å²	132	137.9 Å²	137.9	81%	0.81	80%	0.797	S	S	*	*			trans	-92.9	145.9	167.6	47.4	0	0	0	0	111.4
1813	N	37.5	Very low	34.9	Very low	165 Å²	165	141.6 Å²	141.6	88%	0.882	81%	0.81	S	S	*	*			trans	166.9	136.7	162.7	-91.5	-26.8	0	0	0	107.4
1814	A	37.2	Very low	35.1	Very low	93 Å²	93	136.9 Å²	136.9	77%	0.769	81%	0.807	S	S	*	*			cis	-159.5	162.5	-10.8	0	0	0	0	0	109.9
1815	S	33.1	Very low	35.5	Very low	112 Å²	112	138.6 Å²	138.6	78%	0.783	81%	0.808	S	S	*	*			trans	-88.1	-179.4	165.7	-145.9	0	0	0	0	109.3
1816	P	41.2	Very low	36.1	Very low	96 Å²	96	137.8 Å²	137.8	62%	0.623	80%	0.8	S	S	*	*			cis	-144.5	-164.9	6.2	44.5	-24.2	0	0	0	116.9
1817	H	38.2	Very low	36.2	Very low	188 Å²	188	138.2 Å²	138.2	87%	0.87	80%	0.797	S	S	*	*			trans	107.2	151.1	153.6	-73.5	-15.3	0	0	0	119.4
1818	S	35.3	Very low	36.6	Very low	99 Å²	99	138.4 Å²	138.4	69%	0.692	80%	0.799	S	S	*	*			trans	-112.2	155.7	-164.6	49.9	0	0	0	0	112.8
1819	M	37.7	Very low	36.8	Very low	188 Å²	188	139.2 Å²	139.2	93%	0.926	79%	0.794	S	S	*	*			trans	-163.4	156.2	132.9	-111.5	-178.4	-66.3	0	0	112.2
1820	N	36.7	Very low	36.9	Very low	139 Å²	139	141.2 Å²	141.2	74%	0.743	79%	0.794	S	S	*	*			trans	-73.4	167	-166.2	-65.8	0.9	0	0	0	116.4
1821	L	35.6	Very low	36.7	Very low	171 Å²	171	146.5 Å²	146.5	90%	0.895	82%	0.816	S	S	*	*			trans	71.4	124.2	144.6	-77.1	155.6	0	0	0	119.1
1822	G	35.6	Very low	36.8	Very low	75 Å²	75	141.6 Å²	141.6	77%	0.773	81%	0.81	S	S	*	*			trans	164.9	111.3	162.9	0	0	0	0	0	112.5
1823	D	36	Very low	37	Very low	166 Å²	166	142.1 Å²	142.1	89%	0.888	81%	0.81	S	S	*	*			trans	-68	175	176	-61.7	-77.7	0	0	0	114
1824	A	37.1	Very low	37	Very low	94 Å²	94	140.8 Å²	140.8	78%	0.777	81%	0.806	S	S	*	*			trans	97.7	93.1	158.8	0	0	0	0	0	119
1825	T	37.9	Very low	37	Very low	134 Å²	134	143.6 Å²	143.6	82%	0.822	81%	0.808	S	S	*	*			trans	-44.2	169.8	130.9	16.1	0	0	0	0	113.6
1826	P	42.3	Very low	37.2	Very low	104 Å²	104	145.6 Å²	145.6	68%	0.675	81%	0.81	S	S	*	*			cis	-142.8	-163.9	1.3	31.5	-5.8	0	0	0	115.5
1827	L	36.7	Very low	36.9	Very low	138 Å²	138	148.9 Å²	148.9	72%	0.723	82%	0.823	S	S	*	*			trans	88.6	129.5	149	-68.3	161.7	0	0	0	122.1
1828	Y	38.6	Very low	36.8	Very low	192 Å²	192	146.1 Å²	146.1	75%	0.753	82%	0.819	S	S	*	*			trans	71.5	118.1	147.1	-75.7	-57.4	0	0	0	124.2
1829	D	37.1	Very low	37	Very low	134 Å²	134	149.7 Å²	149.7	72%	0.717	83%	0.829	S	S	*	*				97.6	134.3	124.8	-76.3	-24.3	0	0	0	124.8
1830	E	36.8	Very low	36.9	Very low	170 Å²	170	146.5 Å²	146.5	79%	0.794	82%	0.821	S	S	*	*			trans	54	98.6	154	-64	-174.1	158.4	0	0	120.2
1831	N	32.5	Very low	36.9	Very low	241 Å²	241	147.2 Å²	147.2	100%	1.289	83%	0.828	S	S	*	*				-164.4	0	107.6	-102.1	-94.9	0	0	0	111.4

Retrieved 1,831 of 1,831 residues in 566.7 ms (Link to these results)

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